USER MOD reduce.3.24.130724 H: found=0, std=0, add=5450, rem=0, adj=213 USER MOD reduce.3.24.130724 removed 0 hydrogens (0 hets) HEADER ELECTRON TRANSPORT 04-JUN-10 3NBT TITLE CRYSTAL STRUCTURE OF TRIMERIC CYTOCHROME C FROM HORSE HEART COMPND MOL_ID: 1; COMPND 2 MOLECULE: CYTOCHROME C; COMPND 3 CHAIN: A, B, C, D, E, F SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: EQUUS CABALLUS; SOURCE 3 ORGANISM_COMMON: DOMESTIC HORSE,EQUINE; SOURCE 4 ORGANISM_TAXID: 9796; SOURCE 5 ORGAN: HEART KEYWDS CYTOCHROME C, POLYMERIZATION, DOMAIN SWAPPING, ELECTRON TRANSPORT EXPDTA X-RAY DIFFRACTION AUTHOR M.TAKETA,H.KOMORI,S.HIROTA,Y.HIGUCHI REVDAT 3 28-JUL-10 3NBT 1 JRNL REVDAT 2 21-JUL-10 3NBT 1 JRNL REVDAT 1 14-JUL-10 3NBT 0 JRNL AUTH S.HIROTA,Y.HATTORI,S.NAGAO,M.TAKETA,H.KOMORI,H.KAMIKUBO, JRNL AUTH 2 Z.WANG,I.TAKAHASHI,S.NEGI,Y.SUGIURA,M.KATAOKA,Y.HIGUCHI JRNL TITL CYTOCHROME C POLYMERIZATION BY SUCCESSIVE DOMAIN SWAPPING AT JRNL TITL 2 THE C-TERMINAL HELIX JRNL REF PROC.NATL.ACAD.SCI.USA V. 107 12854 2010 JRNL REFN ISSN 0027-8424 JRNL PMID 20615990 JRNL DOI 10.1073/PNAS.1001839107 REMARK 2 REMARK 2 RESOLUTION. 2.10 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : CNS 1.2 REMARK 3 AUTHORS : BRUNGER,ADAMS,CLORE,DELANO,GROS,GROSSE- REMARK 3 : KUNSTLEVE,JIANG,KUSZEWSKI,NILGES,PANNU, REMARK 3 : READ,RICE,SIMONSON,WARREN REMARK 3 REMARK 3 REFINEMENT TARGET : ENGH & HUBER REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 2.10 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 21.54 REMARK 3 DATA CUTOFF (SIGMA(F)) : 0.000 REMARK 3 DATA CUTOFF HIGH (ABS(F)) : 77168.570 REMARK 3 DATA CUTOFF LOW (ABS(F)) : 0.0000 REMARK 3 COMPLETENESS (WORKING+TEST) (%) : 94.4 REMARK 3 NUMBER OF REFLECTIONS : 40288 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) : 0.211 REMARK 3 FREE R VALUE : 0.254 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 10.100 REMARK 3 FREE R VALUE TEST SET COUNT : 4052 REMARK 3 ESTIMATED ERROR OF FREE R VALUE : 0.004 REMARK 3 REMARK 3 FIT IN THE HIGHEST RESOLUTION BIN. REMARK 3 TOTAL NUMBER OF BINS USED : 6 REMARK 3 BIN RESOLUTION RANGE HIGH (A) : 2.10 REMARK 3 BIN RESOLUTION RANGE LOW (A) : 2.23 REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : 91.20 REMARK 3 REFLECTIONS IN BIN (WORKING SET) : 5766 REMARK 3 BIN R VALUE (WORKING SET) : 0.2470 REMARK 3 BIN FREE R VALUE : 0.3050 REMARK 3 BIN FREE R VALUE TEST SET SIZE (%) : 10.10 REMARK 3 BIN FREE R VALUE TEST SET COUNT : 646 REMARK 3 ESTIMATED ERROR OF BIN FREE R VALUE : 0.012 REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 4938 REMARK 3 NUCLEIC ACID ATOMS : 0 REMARK 3 HETEROGEN ATOMS : 384 REMARK 3 SOLVENT ATOMS : 345 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : 18.00 REMARK 3 MEAN B VALUE (OVERALL, A**2) : 32.90 REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : -1.98000 REMARK 3 B22 (A**2) : -4.59000 REMARK 3 B33 (A**2) : 6.57000 REMARK 3 B12 (A**2) : 0.00000 REMARK 3 B13 (A**2) : 0.00000 REMARK 3 B23 (A**2) : 0.00000 REMARK 3 REMARK 3 ESTIMATED COORDINATE ERROR. REMARK 3 ESD FROM LUZZATI PLOT (A) : 0.26 REMARK 3 ESD FROM SIGMAA (A) : 0.16 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) : 0.33 REMARK 3 ESD FROM C-V SIGMAA (A) : 0.26 REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES. REMARK 3 BOND LENGTHS (A) : 0.007 REMARK 3 BOND ANGLES (DEGREES) : 2.20 REMARK 3 DIHEDRAL ANGLES (DEGREES) : 21.00 REMARK 3 IMPROPER ANGLES (DEGREES) : 0.77 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) : 1.320 ; 1.500 REMARK 3 MAIN-CHAIN ANGLE (A**2) : 1.980 ; 2.000 REMARK 3 SIDE-CHAIN BOND (A**2) : 2.020 ; 2.000 REMARK 3 SIDE-CHAIN ANGLE (A**2) : 2.900 ; 2.500 REMARK 3 REMARK 3 BULK SOLVENT MODELING. REMARK 3 METHOD USED : FLAT MODEL REMARK 3 KSOL : 0.35 REMARK 3 BSOL : 48.75 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 : PROTEIN_REP.PARAM REMARK 3 PARAMETER FILE 2 : PARAM19X_MOD.H REMARK 3 PARAMETER FILE 3 : WATER_REP.PARAM REMARK 3 PARAMETER FILE 4 : PEG.PARAM REMARK 3 PARAMETER FILE 5 : NULL REMARK 3 TOPOLOGY FILE 1 : PROTEIN.TOP REMARK 3 TOPOLOGY FILE 2 : TOPH19.HEM REMARK 3 TOPOLOGY FILE 3 : WATER.TOP REMARK 3 TOPOLOGY FILE 4 : PEG.TOP REMARK 3 TOPOLOGY FILE 5 : NULL REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: BULK SOLVENT MODEL USED REMARK 4 REMARK 4 3NBT COMPLIES WITH FORMAT V. 3.20, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY PDBJ ON 15-JUN-10. REMARK 100 THE RCSB ID CODE IS RCSB059632. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 13-JUL-09 REMARK 200 TEMPERATURE (KELVIN) : 100 REMARK 200 PH : 8.5 REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : Y REMARK 200 RADIATION SOURCE : SPRING-8 REMARK 200 BEAMLINE : BL26B2 REMARK 200 X-RAY GENERATOR MODEL : NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 0.8 REMARK 200 MONOCHROMATOR : SI DOUBLE CRYSTAL REMARK 200 OPTICS : NULL REMARK 200 REMARK 200 DETECTOR TYPE : CCD REMARK 200 DETECTOR MANUFACTURER : RAYONIX MX-225 REMARK 200 INTENSITY-INTEGRATION SOFTWARE : HKL-2000 REMARK 200 DATA SCALING SOFTWARE : HKL-2000 REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 43002 REMARK 200 RESOLUTION RANGE HIGH (A) : 2.100 REMARK 200 RESOLUTION RANGE LOW (A) : 50.000 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : 0.000 REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 99.8 REMARK 200 DATA REDUNDANCY : 7.300 REMARK 200 R MERGE (I) : 0.09600 REMARK 200 R SYM (I) : NULL REMARK 200 FOR THE DATA SET : 7.5000 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 2.10 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 2.18 REMARK 200 COMPLETENESS FOR SHELL (%) : 100.0 REMARK 200 DATA REDUNDANCY IN SHELL : 7.40 REMARK 200 R MERGE FOR SHELL (I) : 0.38000 REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200 FOR SHELL : 5.590 REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REPLACEMENT REMARK 200 SOFTWARE USED: MOLLEP REMARK 200 STARTING MODEL: PDB ENTRY 1CRC REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 51.69 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.55 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: 30% PEG 200, 0.1M TRIS-HCL, 0.2M REMARK 280 AMMONIUM PHOSPHATE, PH 8.5, VAPOR DIFFUSION, SITTING DROP, REMARK 280 TEMPERATURE 277K REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 21 21 21 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -X+1/2,-Y,Z+1/2 REMARK 290 3555 -X,Y+1/2,-Z+1/2 REMARK 290 4555 X+1/2,-Y+1/2,-Z REMARK 290 REMARK 290 WHERE NNN -> OPERATOR NUMBER REMARK 290 MMM -> TRANSLATION VECTOR REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY REMARK 290 RELATED MOLECULES. REMARK 290 SMTRY1 1 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 1 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 1 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 2 -1.000000 0.000000 0.000000 28.60200 REMARK 290 SMTRY2 2 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 65.46750 REMARK 290 SMTRY1 3 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 3 0.000000 1.000000 0.000000 47.83050 REMARK 290 SMTRY3 3 0.000000 0.000000 -1.000000 65.46750 REMARK 290 SMTRY1 4 1.000000 0.000000 0.000000 28.60200 REMARK 290 SMTRY2 4 0.000000 -1.000000 0.000000 47.83050 REMARK 290 SMTRY3 4 0.000000 0.000000 -1.000000 0.00000 REMARK 290 REMARK 290 REMARK: NULL REMARK 300 REMARK 300 BIOMOLECULE: 1, 2 REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON REMARK 300 BURIED SURFACE AREA. REMARK 350 REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. REMARK 350 REMARK 350 BIOMOLECULE: 1 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: TRIMERIC REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: TRIMERIC REMARK 350 SOFTWARE USED: PISA REMARK 350 TOTAL BURIED SURFACE AREA: 7750 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 17040 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -66.0 KCAL/MOL REMARK 350 APPLY THE FOLLOWING TO CHAINS: A, E, F REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 350 REMARK 350 BIOMOLECULE: 2 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: TRIMERIC REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: TRIMERIC REMARK 350 SOFTWARE USED: PISA REMARK 350 TOTAL BURIED SURFACE AREA: 7590 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 16930 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -64.0 KCAL/MOL REMARK 350 APPLY THE FOLLOWING TO CHAINS: B, C, D REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: CLOSE CONTACTS IN SAME ASYMMETRIC UNIT REMARK 500 REMARK 500 THE FOLLOWING ATOMS ARE IN CLOSE CONTACT. REMARK 500 REMARK 500 ATM1 RES C SSEQI ATM2 RES C SSEQI DISTANCE REMARK 500 SG CYS F 17 CBC HEM F 105 2.18 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: TORSION ANGLES REMARK 500 REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS: REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2) REMARK 500 REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI- REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400 REMARK 500 REMARK 500 M RES CSSEQI PSI PHI REMARK 500 LYS A 27 -134.88 -130.91 REMARK 500 ASN A 70 89.78 -162.46 REMARK 500 PHE A 82 125.55 -36.24 REMARK 500 LYS B 27 -138.00 -131.96 REMARK 500 ASN B 70 87.80 -161.33 REMARK 500 LYS C 27 -139.29 -129.23 REMARK 500 ASN C 70 88.11 -160.00 REMARK 500 LYS D 27 -129.83 -127.83 REMARK 500 ASN D 70 88.25 -166.84 REMARK 500 LYS E 27 -132.12 -124.38 REMARK 500 ASN E 70 87.67 -163.05 REMARK 500 PHE E 82 123.12 -36.72 REMARK 500 LYS F 27 -134.97 -131.82 REMARK 500 ASN F 70 92.01 -164.43 REMARK 500 PHE F 82 119.66 -38.65 REMARK 500 REMARK 500 REMARK: NULL REMARK 620 REMARK 620 METAL COORDINATION REMARK 620 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 620 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE): REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 HEM E 105 FE REMARK 620 N RES CSSEQI ATOM REMARK 620 1 HIS E 18 NE2 REMARK 620 2 HEM E 105 NA 95.2 REMARK 620 3 HEM E 105 NB 94.5 91.8 REMARK 620 4 HEM E 105 NC 87.4 177.1 89.4 REMARK 620 5 HEM E 105 ND 85.1 89.4 178.8 89.5 REMARK 620 6 HOH E 205 O 175.1 88.3 88.8 89.0 91.6 REMARK 620 N 1 2 3 4 5 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 HEM A 105 FE REMARK 620 N RES CSSEQI ATOM REMARK 620 1 HIS A 18 NE2 REMARK 620 2 HEM A 105 NA 89.9 REMARK 620 3 HEM A 105 NB 95.7 91.7 REMARK 620 4 HEM A 105 NC 93.0 175.5 91.3 REMARK 620 5 HEM A 105 ND 84.7 87.8 179.4 89.1 REMARK 620 6 HOH A 201 O 171.2 87.6 92.8 89.0 86.8 REMARK 620 N 1 2 3 4 5 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 HEM F 105 FE REMARK 620 N RES CSSEQI ATOM REMARK 620 1 HIS F 18 NE2 REMARK 620 2 HEM F 105 NA 93.7 REMARK 620 3 HEM F 105 NB 88.8 90.1 REMARK 620 4 HEM F 105 NC 88.4 177.9 89.7 REMARK 620 5 HEM F 105 ND 86.9 88.2 175.2 92.2 REMARK 620 6 HOH F 206 O 169.1 95.8 96.5 82.1 88.1 REMARK 620 N 1 2 3 4 5 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 HEM C 105 FE REMARK 620 N RES CSSEQI ATOM REMARK 620 1 HIS C 18 NE2 REMARK 620 2 HEM C 105 NA 95.0 REMARK 620 3 HEM C 105 NB 89.1 91.4 REMARK 620 4 HEM C 105 NC 87.3 177.7 88.3 REMARK 620 5 HEM C 105 ND 87.8 89.2 176.9 91.2 REMARK 620 6 HOH C 203 O 176.0 88.8 89.7 88.9 93.3 REMARK 620 N 1 2 3 4 5 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 HEM D 105 FE REMARK 620 N RES CSSEQI ATOM REMARK 620 1 HIS D 18 NE2 REMARK 620 2 HEM D 105 NA 89.9 REMARK 620 3 HEM D 105 NB 89.0 90.9 REMARK 620 4 HEM D 105 NC 90.4 179.7 89.2 REMARK 620 5 HEM D 105 ND 91.2 88.3 179.2 91.6 REMARK 620 6 HOH D 204 O 176.5 90.6 94.5 89.1 85.3 REMARK 620 N 1 2 3 4 5 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 HEM B 105 FE REMARK 620 N RES CSSEQI ATOM REMARK 620 1 HIS B 18 NE2 REMARK 620 2 HEM B 105 NA 95.8 REMARK 620 3 HEM B 105 NB 91.2 91.4 REMARK 620 4 HEM B 105 NC 87.7 176.1 90.1 REMARK 620 5 HEM B 105 ND 87.1 90.1 177.9 88.5 REMARK 620 6 HOH B 202 O 176.7 87.3 87.6 89.3 94.1 REMARK 620 N 1 2 3 4 5 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 HEM A 105 CAB REMARK 620 N RES CSSEQI ATOM REMARK 620 1 CYS A 14 SG REMARK 620 2 HEM A 105 C3B 116.2 REMARK 620 3 HEM A 105 CBB 98.0 118.5 REMARK 620 N 1 2 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 HEM A 105 CAC REMARK 620 N RES CSSEQI ATOM REMARK 620 1 CYS A 17 SG REMARK 620 2 HEM A 105 C3C 110.4 REMARK 620 3 HEM A 105 CBC 100.2 121.9 REMARK 620 N 1 2 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 HEM B 105 CAB REMARK 620 N RES CSSEQI ATOM REMARK 620 1 CYS B 14 SG REMARK 620 2 HEM B 105 C3B 115.2 REMARK 620 3 HEM B 105 CBB 92.5 120.9 REMARK 620 N 1 2 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 HEM B 105 CAC REMARK 620 N RES CSSEQI ATOM REMARK 620 1 CYS B 17 SG REMARK 620 2 HEM B 105 C3C 107.0 REMARK 620 3 HEM B 105 CBC 98.1 123.3 REMARK 620 N 1 2 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 HEM C 105 CAB REMARK 620 N RES CSSEQI ATOM REMARK 620 1 CYS C 14 SG REMARK 620 2 HEM C 105 C3B 114.6 REMARK 620 3 HEM C 105 CBB 93.8 122.5 REMARK 620 N 1 2 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 HEM C 105 CAC REMARK 620 N RES CSSEQI ATOM REMARK 620 1 CYS C 17 SG REMARK 620 2 HEM C 105 C3C 103.1 REMARK 620 3 HEM C 105 CBC 101.9 124.4 REMARK 620 N 1 2 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 HEM D 105 CAB REMARK 620 N RES CSSEQI ATOM REMARK 620 1 CYS D 14 SG REMARK 620 2 HEM D 105 C3B 121.0 REMARK 620 3 HEM D 105 CBB 86.6 121.8 REMARK 620 N 1 2 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 HEM D 105 CAC REMARK 620 N RES CSSEQI ATOM REMARK 620 1 CYS D 17 SG REMARK 620 2 HEM D 105 C3C 107.0 REMARK 620 3 HEM D 105 CBC 98.9 121.3 REMARK 620 N 1 2 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 HEM E 105 CAB REMARK 620 N RES CSSEQI ATOM REMARK 620 1 CYS E 14 SG REMARK 620 2 HEM E 105 C3B 112.2 REMARK 620 3 HEM E 105 CBB 94.0 120.8 REMARK 620 N 1 2 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 HEM E 105 CAC REMARK 620 N RES CSSEQI ATOM REMARK 620 1 CYS E 17 SG REMARK 620 2 HEM E 105 C3C 113.3 REMARK 620 3 HEM E 105 CBC 90.7 123.6 REMARK 620 N 1 2 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 HEM F 105 CAB REMARK 620 N RES CSSEQI ATOM REMARK 620 1 CYS F 14 SG REMARK 620 2 HEM F 105 C3B 120.2 REMARK 620 3 HEM F 105 CBB 105.1 121.0 REMARK 620 N 1 2 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 HEM F 105 CAC REMARK 620 N RES CSSEQI ATOM REMARK 620 1 CYS F 17 SG REMARK 620 2 HEM F 105 C3C 112.2 REMARK 620 3 HEM F 105 CBC 84.2 124.1 REMARK 620 N 1 2 REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE HEM A 105 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE PG4 A 1001 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC3 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE PEG A 1007 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC4 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE HEM B 105 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC5 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE PG4 B 1004 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC6 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE PEG B 1008 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC7 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE HEM C 105 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC8 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE PG4 C 1005 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC9 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE PEG C 1009 REMARK 800 REMARK 800 SITE_IDENTIFIER: BC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE HEM D 105 REMARK 800 REMARK 800 SITE_IDENTIFIER: BC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE PG4 D 1006 REMARK 800 REMARK 800 SITE_IDENTIFIER: BC3 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE PGE D 1010 REMARK 800 REMARK 800 SITE_IDENTIFIER: BC4 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE HEM E 105 REMARK 800 REMARK 800 SITE_IDENTIFIER: BC5 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE PG4 E 1002 REMARK 800 REMARK 800 SITE_IDENTIFIER: BC6 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE PEG E 1011 REMARK 800 REMARK 800 SITE_IDENTIFIER: BC7 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE HEM F 105 REMARK 800 REMARK 800 SITE_IDENTIFIER: BC8 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE PG4 F 1003 REMARK 800 REMARK 800 SITE_IDENTIFIER: BC9 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE PGE F 1012 REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 3NBS RELATED DB: PDB REMARK 900 DIMERIC STRUCTURE DBREF 3NBT A 1 104 UNP P00004 CYC_HORSE 2 105 DBREF 3NBT B 1 104 UNP P00004 CYC_HORSE 2 105 DBREF 3NBT C 1 104 UNP P00004 CYC_HORSE 2 105 DBREF 3NBT D 1 104 UNP P00004 CYC_HORSE 2 105 DBREF 3NBT E 1 104 UNP P00004 CYC_HORSE 2 105 DBREF 3NBT F 1 104 UNP P00004 CYC_HORSE 2 105 SEQRES 1 A 104 GLY ASP VAL GLU LYS GLY LYS LYS ILE PHE VAL GLN LYS SEQRES 2 A 104 CYS ALA GLN CYS HIS THR VAL GLU LYS GLY GLY LYS HIS SEQRES 3 A 104 LYS THR GLY PRO ASN LEU HIS GLY LEU PHE GLY ARG LYS SEQRES 4 A 104 THR GLY GLN ALA PRO GLY PHE THR TYR THR ASP ALA ASN SEQRES 5 A 104 LYS ASN LYS GLY ILE THR TRP LYS GLU GLU THR LEU MET SEQRES 6 A 104 GLU TYR LEU GLU ASN PRO LYS LYS TYR ILE PRO GLY THR SEQRES 7 A 104 LYS MET ILE PHE ALA GLY ILE LYS LYS LYS THR GLU ARG SEQRES 8 A 104 GLU ASP LEU ILE ALA TYR LEU LYS LYS ALA THR ASN GLU SEQRES 1 B 104 GLY ASP VAL GLU LYS GLY LYS LYS ILE PHE VAL GLN LYS SEQRES 2 B 104 CYS ALA GLN CYS HIS THR VAL GLU LYS GLY GLY LYS HIS SEQRES 3 B 104 LYS THR GLY PRO ASN LEU HIS GLY LEU PHE GLY ARG LYS SEQRES 4 B 104 THR GLY GLN ALA PRO GLY PHE THR TYR THR ASP ALA ASN SEQRES 5 B 104 LYS ASN LYS GLY ILE THR TRP LYS GLU GLU THR LEU MET SEQRES 6 B 104 GLU TYR LEU GLU ASN PRO LYS LYS TYR ILE PRO GLY THR SEQRES 7 B 104 LYS MET ILE PHE ALA GLY ILE LYS LYS LYS THR GLU ARG SEQRES 8 B 104 GLU ASP LEU ILE ALA TYR LEU LYS LYS ALA THR ASN GLU SEQRES 1 C 104 GLY ASP VAL GLU LYS GLY LYS LYS ILE PHE VAL GLN LYS SEQRES 2 C 104 CYS ALA GLN CYS HIS THR VAL GLU LYS GLY GLY LYS HIS SEQRES 3 C 104 LYS THR GLY PRO ASN LEU HIS GLY LEU PHE GLY ARG LYS SEQRES 4 C 104 THR GLY GLN ALA PRO GLY PHE THR TYR THR ASP ALA ASN SEQRES 5 C 104 LYS ASN LYS GLY ILE THR TRP LYS GLU GLU THR LEU MET SEQRES 6 C 104 GLU TYR LEU GLU ASN PRO LYS LYS TYR ILE PRO GLY THR SEQRES 7 C 104 LYS MET ILE PHE ALA GLY ILE LYS LYS LYS THR GLU ARG SEQRES 8 C 104 GLU ASP LEU ILE ALA TYR LEU LYS LYS ALA THR ASN GLU SEQRES 1 D 104 GLY ASP VAL GLU LYS GLY LYS LYS ILE PHE VAL GLN LYS SEQRES 2 D 104 CYS ALA GLN CYS HIS THR VAL GLU LYS GLY GLY LYS HIS SEQRES 3 D 104 LYS THR GLY PRO ASN LEU HIS GLY LEU PHE GLY ARG LYS SEQRES 4 D 104 THR GLY GLN ALA PRO GLY PHE THR TYR THR ASP ALA ASN SEQRES 5 D 104 LYS ASN LYS GLY ILE THR TRP LYS GLU GLU THR LEU MET SEQRES 6 D 104 GLU TYR LEU GLU ASN PRO LYS LYS TYR ILE PRO GLY THR SEQRES 7 D 104 LYS MET ILE PHE ALA GLY ILE LYS LYS LYS THR GLU ARG SEQRES 8 D 104 GLU ASP LEU ILE ALA TYR LEU LYS LYS ALA THR ASN GLU SEQRES 1 E 104 GLY ASP VAL GLU LYS GLY LYS LYS ILE PHE VAL GLN LYS SEQRES 2 E 104 CYS ALA GLN CYS HIS THR VAL GLU LYS GLY GLY LYS HIS SEQRES 3 E 104 LYS THR GLY PRO ASN LEU HIS GLY LEU PHE GLY ARG LYS SEQRES 4 E 104 THR GLY GLN ALA PRO GLY PHE THR TYR THR ASP ALA ASN SEQRES 5 E 104 LYS ASN LYS GLY ILE THR TRP LYS GLU GLU THR LEU MET SEQRES 6 E 104 GLU TYR LEU GLU ASN PRO LYS LYS TYR ILE PRO GLY THR SEQRES 7 E 104 LYS MET ILE PHE ALA GLY ILE LYS LYS LYS THR GLU ARG SEQRES 8 E 104 GLU ASP LEU ILE ALA TYR LEU LYS LYS ALA THR ASN GLU SEQRES 1 F 104 GLY ASP VAL GLU LYS GLY LYS LYS ILE PHE VAL GLN LYS SEQRES 2 F 104 CYS ALA GLN CYS HIS THR VAL GLU LYS GLY GLY LYS HIS SEQRES 3 F 104 LYS THR GLY PRO ASN LEU HIS GLY LEU PHE GLY ARG LYS SEQRES 4 F 104 THR GLY GLN ALA PRO GLY PHE THR TYR THR ASP ALA ASN SEQRES 5 F 104 LYS ASN LYS GLY ILE THR TRP LYS GLU GLU THR LEU MET SEQRES 6 F 104 GLU TYR LEU GLU ASN PRO LYS LYS TYR ILE PRO GLY THR SEQRES 7 F 104 LYS MET ILE PHE ALA GLY ILE LYS LYS LYS THR GLU ARG SEQRES 8 F 104 GLU ASP LEU ILE ALA TYR LEU LYS LYS ALA THR ASN GLU HET HEM A 105 43 HET PG4 A1001 13 HET PEG A1007 7 HET HEM B 105 43 HET PG4 B1004 13 HET PEG B1008 7 HET HEM C 105 43 HET PG4 C1005 13 HET PEG C1009 7 HET HEM D 105 43 HET PG4 D1006 13 HET PGE D1010 10 HET HEM E 105 43 HET PG4 E1002 13 HET PEG E1011 7 HET HEM F 105 43 HET PG4 F1003 13 HET PGE F1012 10 HETNAM HEM PROTOPORPHYRIN IX CONTAINING FE HETNAM PG4 TETRAETHYLENE GLYCOL HETNAM PEG DI(HYDROXYETHYL)ETHER HETNAM PGE TRIETHYLENE GLYCOL HETSYN HEM HEME FORMUL 7 HEM 6(C34 H32 FE N4 O4) FORMUL 8 PG4 6(C8 H18 O5) FORMUL 9 PEG 4(C4 H10 O3) FORMUL 18 PGE 2(C6 H14 O4) FORMUL 25 HOH *345(H2 O) HELIX 1 1 ASP A 2 CYS A 14 1 13 HELIX 2 2 THR A 49 LYS A 55 1 7 HELIX 3 3 LYS A 60 LEU A 68 1 9 HELIX 4 4 ASN A 70 ILE A 75 1 6 HELIX 5 5 LYS A 87 THR A 102 1 16 HELIX 6 6 ASP B 2 CYS B 14 1 13 HELIX 7 7 THR B 49 LYS B 55 1 7 HELIX 8 8 LYS B 60 ASN B 70 1 11 HELIX 9 9 ASN B 70 ILE B 75 1 6 HELIX 10 10 LYS B 87 THR B 102 1 16 HELIX 11 11 ASP C 2 CYS C 14 1 13 HELIX 12 12 THR C 49 ASN C 54 1 6 HELIX 13 13 LYS C 60 ASN C 70 1 11 HELIX 14 14 ASN C 70 ILE C 75 1 6 HELIX 15 15 LYS C 87 THR C 102 1 16 HELIX 16 16 ASP D 2 CYS D 14 1 13 HELIX 17 17 THR D 49 ASN D 54 1 6 HELIX 18 18 LYS D 60 ASN D 70 1 11 HELIX 19 19 ASN D 70 ILE D 75 1 6 HELIX 20 20 LYS D 87 THR D 102 1 16 HELIX 21 21 ASP E 2 CYS E 14 1 13 HELIX 22 22 THR E 49 LYS E 55 1 7 HELIX 23 23 LYS E 60 ASN E 70 1 11 HELIX 24 24 ASN E 70 ILE E 75 1 6 HELIX 25 25 LYS E 87 THR E 102 1 16 HELIX 26 26 ASP F 2 CYS F 14 1 13 HELIX 27 27 THR F 49 ASN F 54 1 6 HELIX 28 28 LYS F 60 ASN F 70 1 11 HELIX 29 29 ASN F 70 ILE F 75 1 6 HELIX 30 30 LYS F 87 THR F 102 1 16 LINK NE2 HIS E 18 FE HEM E 105 1555 1555 1.96 LINK NE2 HIS A 18 FE HEM A 105 1555 1555 1.96 LINK NE2 HIS F 18 FE HEM F 105 1555 1555 1.98 LINK NE2 HIS C 18 FE HEM C 105 1555 1555 1.99 LINK NE2 HIS D 18 FE HEM D 105 1555 1555 1.99 LINK NE2 HIS B 18 FE HEM B 105 1555 1555 2.00 LINK SG CYS A 14 CAB HEM A 105 1555 1555 1.85 LINK SG CYS A 17 CAC HEM A 105 1555 1555 1.85 LINK SG CYS B 14 CAB HEM B 105 1555 1555 1.85 LINK SG CYS B 17 CAC HEM B 105 1555 1555 1.84 LINK SG CYS C 14 CAB HEM C 105 1555 1555 1.85 LINK SG CYS C 17 CAC HEM C 105 1555 1555 1.86 LINK SG CYS D 14 CAB HEM D 105 1555 1555 1.85 LINK SG CYS D 17 CAC HEM D 105 1555 1555 1.84 LINK SG CYS E 14 CAB HEM E 105 1555 1555 1.85 LINK SG CYS E 17 CAC HEM E 105 1555 1555 1.86 LINK SG CYS F 14 CAB HEM F 105 1555 1555 1.84 LINK SG CYS F 17 CAC HEM F 105 1555 1555 1.83 LINK FE HEM C 105 O HOH C 203 1555 1555 2.09 LINK FE HEM D 105 O HOH D 204 1555 1555 2.11 LINK FE HEM F 105 O HOH F 206 1555 1555 2.11 LINK FE HEM A 105 O HOH A 201 1555 1555 2.11 LINK FE HEM E 105 O HOH E 205 1555 1555 2.11 LINK FE HEM B 105 O HOH B 202 1555 1555 2.12 SITE *** AC1 24 LYS A 13 CYS A 14 CYS A 17 HIS A 18 SITE *** AC1 24 THR A 28 GLY A 29 PRO A 30 THR A 40 SITE *** AC1 24 GLY A 41 TYR A 48 THR A 49 ASN A 52 SITE *** AC1 24 TRP A 59 TYR A 67 LEU A 68 THR A 78 SITE *** AC1 24 LYS A 79 MET A 80 HOH A 201 HOH A 243 SITE *** AC1 24 HOH A 437 PEG A1007 PHE E 82 LEU E 94 SITE *** AC2 7 LYS A 55 ILE A 57 GLU A 66 LYS A 73 SITE *** AC2 7 TYR A 74 PRO A 76 HOH A 305 SITE *** AC3 7 THR A 28 THR A 47 LYS A 79 GLY A 84 SITE *** AC3 7 HEM A 105 HOH A 238 HOH A 496 SITE *** AC4 21 LYS B 13 CYS B 14 CYS B 17 HIS B 18 SITE *** AC4 21 THR B 28 GLY B 29 ARG B 38 THR B 40 SITE *** AC4 21 GLY B 41 TYR B 48 THR B 49 ASN B 52 SITE *** AC4 21 TRP B 59 TYR B 67 THR B 78 LYS B 79 SITE *** AC4 21 MET B 80 HOH B 202 HOH B 495 PEG B1008 SITE *** AC4 21 PHE C 82 SITE *** AC5 6 LYS B 55 ILE B 57 GLU B 66 LYS B 73 SITE *** AC5 6 TYR B 74 ASP E 50 SITE *** AC6 8 THR B 47 TYR B 48 THR B 49 LYS B 79 SITE *** AC6 8 ILE B 81 GLY B 84 HEM B 105 HOH B 407 SITE *** AC7 23 LYS C 13 CYS C 14 CYS C 17 HIS C 18 SITE *** AC7 23 THR C 28 GLY C 29 PRO C 30 THR C 40 SITE *** AC7 23 GLY C 41 TYR C 48 THR C 49 ASN C 52 SITE *** AC7 23 TRP C 59 TYR C 67 LEU C 68 THR C 78 SITE *** AC7 23 LYS C 79 MET C 80 HOH C 203 HOH C 227 SITE *** AC7 23 HOH C 265 PHE D 82 LEU D 94 SITE *** AC8 7 ASP A 50 LYS C 55 ILE C 57 LYS C 73 SITE *** AC8 7 TYR C 74 PRO C 76 HOH C 545 SITE *** AC9 7 THR C 28 THR C 47 THR C 49 ILE C 81 SITE *** AC9 7 GLY C 84 HOH C 419 HOH C 433 SITE *** BC1 21 PHE B 82 LEU B 94 LYS D 13 CYS D 14 SITE *** BC1 21 CYS D 17 HIS D 18 THR D 28 GLY D 29 SITE *** BC1 21 THR D 40 GLY D 41 TYR D 48 THR D 49 SITE *** BC1 21 ASN D 52 TRP D 59 TYR D 67 THR D 78 SITE *** BC1 21 LYS D 79 MET D 80 HOH D 204 HOH D 247 SITE *** BC1 21 PGE D1010 SITE *** BC2 6 LYS D 55 GLU D 66 LYS D 73 TYR D 74 SITE *** BC2 6 PRO D 76 HOH F 411 SITE *** BC3 11 THR D 28 THR D 47 TYR D 48 THR D 49 SITE *** BC3 11 LYS D 79 ILE D 81 PHE D 82 GLY D 84 SITE *** BC3 11 HEM D 105 HOH D 234 HOH D 516 SITE *** BC4 21 LYS E 13 CYS E 14 CYS E 17 HIS E 18 SITE *** BC4 21 THR E 28 GLY E 29 THR E 40 GLY E 41 SITE *** BC4 21 TYR E 48 THR E 49 ASN E 52 TRP E 59 SITE *** BC4 21 LEU E 64 TYR E 67 THR E 78 LYS E 79 SITE *** BC4 21 MET E 80 HOH E 205 PEG E1011 PHE F 82 SITE *** BC4 21 LEU F 94 SITE *** BC5 7 ASP B 50 LYS E 55 GLU E 66 LYS E 73 SITE *** BC5 7 TYR E 74 PRO E 76 HOH E 279 SITE *** BC6 7 THR E 28 THR E 47 THR E 49 LYS E 79 SITE *** BC6 7 ILE E 81 HEM E 105 HOH E 288 SITE *** BC7 21 PHE A 82 LEU A 94 LYS F 13 CYS F 14 SITE *** BC7 21 CYS F 17 HIS F 18 THR F 28 GLY F 29 SITE *** BC7 21 THR F 40 GLY F 41 TYR F 48 THR F 49 SITE *** BC7 21 ASN F 52 TRP F 59 TYR F 67 THR F 78 SITE *** BC7 21 LYS F 79 MET F 80 HOH F 206 HOH F 289 SITE *** BC7 21 PGE F1012 SITE *** BC8 5 HOH D 325 LYS F 55 LYS F 73 TYR F 74 SITE *** BC8 5 PRO F 76 SITE *** BC9 9 THR F 47 THR F 49 ILE F 81 PHE F 82 SITE *** BC9 9 GLY F 84 HEM F 105 HOH F 253 HOH F 374 SITE *** BC9 9 HOH F 392 CRYST1 57.204 95.661 130.935 90.00 90.00 90.00 P 21 21 21 24 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 0.017481 0.000000 0.000000 0.00000 SCALE2 0.000000 0.010454 0.000000 0.00000 SCALE3 0.000000 0.000000 0.007637 0.00000 USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD NoAdj-H: A 18 HIS HE2 : A 18 HIS NE2 : A 105 HEMFE :(H bumps) USER MOD NoAdj-H: B 18 HIS HE2 : B 18 HIS NE2 : B 105 HEMFE :(H bumps) USER MOD NoAdj-H: C 18 HIS HE2 : C 18 HIS NE2 : C 105 HEMFE :(H bumps) USER MOD NoAdj-H: D 18 HIS HE2 : D 18 HIS NE2 : D 105 HEMFE :(H bumps) USER MOD NoAdj-H: E 18 HIS HE2 : E 18 HIS NE2 : E 105 HEMFE :(H bumps) USER MOD NoAdj-H: F 18 HIS HE2 : F 18 HIS NE2 : F 105 HEMFE :(H bumps) USER MOD Set 1.1: F 78 THR OG1 : rot 70:sc= 2.11 USER MOD Set 1.2: F 80 MET CE :methyl -155:sc= -1.71 (180deg=-3.56) USER MOD Set 2.1: F 55 LYS NZ :NH3+ -163:sc= 1.97 (180deg=1.27) USER MOD Set 2.2: F1003 PG4 O1 : rot 180:sc= 0.558 USER MOD Set 2.3: F1003 PG4 O5 : rot -28:sc= 0.0284 USER MOD Set 3.1: F 19 THR OG1 : rot -145:sc= 2.73 USER MOD Set 3.2: F 31 ASN : amide:sc= 1.78 K(o=4.5,f=-4.9!) USER MOD Set 4.1: E 55 LYS NZ :NH3+ -166:sc= 1.43 (180deg=0.752) USER MOD Set 4.2: E1002 PG4 O1 : rot 180:sc= 0 USER MOD Set 4.3: E1002 PG4 O5 : rot 180:sc= 0.48 USER MOD Set 5.1: E 78 THR OG1 : rot 54:sc= 2.26 USER MOD Set 5.2: E 80 MET CE :methyl -149:sc= -0.157 (180deg=-1.26) USER MOD Set 6.1: E 19 THR OG1 : rot -119:sc= 1.36 USER MOD Set 6.2: E 31 ASN : amide:sc= -0.236! C(o=1.1!,f=-5.3!) USER MOD Set 7.1: D 55 LYS NZ :NH3+ -164:sc= 1.29 (180deg=1.06) USER MOD Set 7.2: D1006 PG4 O1 : rot -30:sc= 0.0438 USER MOD Set 7.3: D1006 PG4 O5 : rot 180:sc= 0.0102 USER MOD Set 8.1: D 19 THR OG1 : rot -123:sc= 2.19 USER MOD Set 8.2: D 31 ASN : amide:sc= 1.56! K(o=3.7!,f=-0.74) USER MOD Set 9.1: C 55 LYS NZ :NH3+ -162:sc= 0.993 (180deg=0.72) USER MOD Set 9.2: C1005 PG4 O1 : rot 180:sc= 0 USER MOD Set 9.3: C1005 PG4 O5 : rot 180:sc= 0 USER MOD Set10.1: C 78 THR OG1 : rot 69:sc= 2.19 USER MOD Set10.2: C 80 MET CE :methyl -154:sc= -2.05 (180deg=-3.95!) USER MOD Set11.1: C 22 LYS NZ :NH3+ -151:sc= 0.567 (180deg=-0.0047) USER MOD Set11.2: C 33 HIS : no HE2:sc= 0.354 K(o=0.92,f=-1.8) USER MOD Set12.1: C 19 THR OG1 : rot -134:sc= 1.72 USER MOD Set12.2: C 31 ASN : amide:sc= 1.29 K(o=3,f=-1!) USER MOD Set13.1: B 78 THR OG1 : rot 61:sc= 2.35 USER MOD Set13.2: B 80 MET CE :methyl 143:sc= -0.0975 (180deg=-1.11) USER MOD Set14.1: B 39 LYS NZ :NH3+ -116:sc= 0.248 (180deg=-1.33) USER MOD Set14.2: B 58 THR OG1 : rot 180:sc= 0.413 USER MOD Set15.1: B 55 LYS NZ :NH3+ -161:sc= 1.37 (180deg=0.988) USER MOD Set15.2: B1004 PG4 O1 : rot 180:sc= 0 USER MOD Set15.3: B1004 PG4 O5 : rot 180:sc= 0.177 USER MOD Set16.1: B 19 THR OG1 : rot -120:sc= 1.71 USER MOD Set16.2: B 31 ASN : amide:sc= 0.498! K(o=2.2!,f=-2.1) USER MOD Set17.1: B 28 THR OG1 : rot 108:sc= 1.41 USER MOD Set17.2: D 16 GLN : amide:sc= 0.987 K(o=2.4,f=-4.5!) USER MOD Set18.1: A 55 LYS NZ :NH3+ -167:sc= 2.16 (180deg=1.1) USER MOD Set18.2: A1001 PG4 O1 : rot 180:sc= 0 USER MOD Set18.3: A1001 PG4 O5 : rot 180:sc= 0.877 USER MOD Set19.1: A 53 LYS NZ :NH3+ 166:sc= 0.839 (180deg=-0.268) USER MOD Set19.2: A 54 ASN : amide:sc= 0.792 K(o=1.6,f=-8.6!) USER MOD Set20.1: A 19 THR OG1 : rot -131:sc= 2 USER MOD Set20.2: A 31 ASN : amide:sc= 0.0967 K(o=2.1,f=-1.8!) USER MOD Set21.1: A 16 GLN : amide:sc= 0 X(o=1.4,f=1.4) USER MOD Set21.2: E 28 THR OG1 : rot 80:sc= 1.4 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 LYS NZ :NH3+ -138:sc= -0.0652 (180deg=-0.347) USER MOD Single : A 7 LYS NZ :NH3+ 168:sc= 0.0224 (180deg=0.0169) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 GLN : amide:sc= 0 X(o=0,f=-0.029) USER MOD Single : A 13 LYS NZ :NH3+ -166:sc= 0.62 (180deg=0.53) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 LYS NZ :NH3+ 163:sc= -0.13 (180deg=-0.378) USER MOD Single : A 26 HIS : no HD1:sc= 1.59 K(o=1.6,f=-7.3!) USER MOD Single : A 27 LYS NZ :NH3+ -174:sc= 1.21 (180deg=1.18) USER MOD Single : A 28 THR OG1 : rot 79:sc= 1.36 USER MOD Single : A 33 HIS : no HE2:sc= -4.23! C(o=-4.2!,f=-7.7!) USER MOD Single : A 39 LYS NZ :NH3+ -169:sc= -0.0145 (180deg=-0.125) USER MOD Single : A 40 THR OG1 : rot 108:sc= 0.0313 USER MOD Single : A 42 GLN : amide:sc= 0.057 X(o=0.057,f=-0.12) USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 TYR OH : rot -64:sc= 0.544 USER MOD Single : A 49 THR OG1 : rot -120:sc= 1.49 USER MOD Single : A 52 ASN : amide:sc= 0.728! K(o=0.73!,f=-1.7) USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ -163:sc= -0.772 (180deg=-1.65) USER MOD Single : A 63 THR OG1 : rot -158:sc= 1.29 USER MOD Single : A 65 MET CE :methyl 179:sc= -0.761 (180deg=-0.769) USER MOD Single : A 67 TYR OH : rot 132:sc= 2.11 USER MOD Single : A 70 ASN : amide:sc= -0.201 K(o=-0.2,f=-2.9!) USER MOD Single : A 72 LYS NZ :NH3+ 166:sc= -0.0627 (180deg=-0.219) USER MOD Single : A 73 LYS NZ :NH3+ -144:sc= 0.0529 (180deg=-0.279) USER MOD Single : A 74 TYR OH : rot 150:sc= -0.0213 USER MOD Single : A 78 THR OG1 : rot 68:sc= 2.18 USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 MET CE :methyl -159:sc= -0.636 (180deg=-0.829) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 LYS NZ :NH3+ -159:sc= 0.362 (180deg=0.226) USER MOD Single : A 89 THR OG1 : rot 77:sc= 1.4 USER MOD Single : A 97 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 THR OG1 : rot -78:sc= 2.32 USER MOD Single : A 103 ASN : amide:sc= -1.15! C(o=-1.1!,f=-1.1!) USER MOD Single : A 105 HEM CMA :methyl 150:sc= -0.214 (180deg=-0.214) USER MOD Single : A 105 HEM CMB :methyl -30:sc= -1.08 (180deg=-1.75) USER MOD Single : A 105 HEM CMC :methyl -30:sc= -1.16 (180deg=-2.49!) USER MOD Single : A 105 HEM CMD :methyl -30:sc= -0.485 (180deg=-3.58) USER MOD Single : A1007 PEG O1 : rot 33:sc= 0.015 USER MOD Single : A1007 PEG O4 : rot -61:sc= 0 USER MOD Single : B 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 5 LYS NZ :NH3+ 172:sc=-0.00966 (180deg=-0.0916) USER MOD Single : B 7 LYS NZ :NH3+ -161:sc= -0.0354 (180deg=-0.307) USER MOD Single : B 8 LYS NZ :NH3+ -167:sc= -0.0441 (180deg=-0.165) USER MOD Single : B 12 GLN : amide:sc= 0.424 X(o=0.42,f=0.63) USER MOD Single : B 13 LYS NZ :NH3+ 170:sc= 2.54 (180deg=2.37) USER MOD Single : B 16 GLN : amide:sc= -0.795! C(o=-0.79!,f=-3.7!) USER MOD Single : B 22 LYS NZ :NH3+ -173:sc=-0.00975 (180deg=-0.14) USER MOD Single : B 25 LYS NZ :NH3+ -177:sc=-0.00142 (180deg=-0.0163) USER MOD Single : B 26 HIS : no HD1:sc= 1.21 K(o=1.2,f=-6.1!) USER MOD Single : B 27 LYS NZ :NH3+ -176:sc= 0.276 (180deg=0.271) USER MOD Single : B 33 HIS : no HD1:sc= -1.27 K(o=-1.3,f=-2) USER MOD Single : B 40 THR OG1 : rot 63:sc= 0.639 USER MOD Single : B 42 GLN : amide:sc= 0.0191 X(o=0.019,f=-0.17) USER MOD Single : B 47 THR OG1 : rot 180:sc= 0 USER MOD Single : B 48 TYR OH : rot -33:sc= 0.232 USER MOD Single : B 49 THR OG1 : rot -111:sc= 1.49 USER MOD Single : B 52 ASN : amide:sc= -0.932! K(o=-0.93!,f=-1.5) USER MOD Single : B 53 LYS NZ :NH3+ -120:sc= 0.781 (180deg=-0.462) USER MOD Single : B 54 ASN : amide:sc= -0.179 K(o=-0.18,f=-1.3) USER MOD Single : B 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 63 THR OG1 : rot -161:sc= 1.03 USER MOD Single : B 65 MET CE :methyl -116:sc= -0.102 (180deg=-0.527) USER MOD Single : B 67 TYR OH : rot 142:sc= 1.96 USER MOD Single : B 70 ASN : amide:sc= -0.446 K(o=-0.45,f=-4.6!) USER MOD Single : B 72 LYS NZ :NH3+ -169:sc= 0.196 (180deg=0.179) USER MOD Single : B 73 LYS NZ :NH3+ 161:sc= 0.112 (180deg=0.0474) USER MOD Single : B 74 TYR OH : rot 2:sc= 0 USER MOD Single : B 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 86 LYS NZ :NH3+ 179:sc= 0 (180deg=-2.31e-06) USER MOD Single : B 87 LYS NZ :NH3+ 162:sc= -0.0907 (180deg=-0.312) USER MOD Single : B 88 LYS NZ :NH3+ -166:sc= 0.922 (180deg=0.762) USER MOD Single : B 89 THR OG1 : rot 180:sc= 0 USER MOD Single : B 97 TYR OH : rot 180:sc= 0 USER MOD Single : B 99 LYS NZ :NH3+ -159:sc= 0.0678 (180deg=0.0101) USER MOD Single : B 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 102 THR OG1 : rot -103:sc= 2.42 USER MOD Single : B 103 ASN : amide:sc= -0.374 X(o=-0.37,f=-0.38) USER MOD Single : B 105 HEM CMA :methyl 150:sc= -0.227 (180deg=-0.227) USER MOD Single : B 105 HEM CMB :methyl 150:sc= -1.11 (180deg=-1.11) USER MOD Single : B 105 HEM CMC :methyl -30:sc= -2.39 (180deg=-3.71!) USER MOD Single : B 105 HEM CMD :methyl -30:sc= -0.246 (180deg=-4.92!) USER MOD Single : B1008 PEG O1 : rot 180:sc= 0 USER MOD Single : B1008 PEG O4 : rot -57:sc= 0.0673 USER MOD Single : C 1 GLY N :NH3+ 134:sc= 0.0292 (180deg=0) USER MOD Single : C 5 LYS NZ :NH3+ 173:sc= -0.851 (180deg=-1.1) USER MOD Single : C 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 8 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0225) USER MOD Single : C 12 GLN : amide:sc= 0 X(o=0,f=0.12) USER MOD Single : C 13 LYS NZ :NH3+ 162:sc= 1.06 (180deg=0.894) USER MOD Single : C 16 GLN : amide:sc= 0.972 K(o=0.97,f=-5.7!) USER MOD Single : C 25 LYS NZ :NH3+ 169:sc= -2.89! (180deg=-3.45!) USER MOD Single : C 26 HIS : no HD1:sc= 0.9 K(o=0.9,f=-4.8!) USER MOD Single : C 27 LYS NZ :NH3+ 176:sc= 0.0178 (180deg=0.0166) USER MOD Single : C 28 THR OG1 : rot 180:sc= 0 USER MOD Single : C 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 40 THR OG1 : rot -110:sc= -0.669 USER MOD Single : C 42 GLN : amide:sc= 1.05 X(o=1.1,f=0.95) USER MOD Single : C 47 THR OG1 : rot 180:sc= 0 USER MOD Single : C 48 TYR OH : rot -32:sc= 0.947 USER MOD Single : C 49 THR OG1 : rot -101:sc= 1.61 USER MOD Single : C 52 ASN : amide:sc= 0.527! K(o=0.53!,f=-1.6) USER MOD Single : C 53 LYS NZ :NH3+ 166:sc= 0.334 (180deg=0.261) USER MOD Single : C 54 ASN : amide:sc= 0 X(o=0,f=-0.35) USER MOD Single : C 58 THR OG1 : rot 64:sc= 2.36 USER MOD Single : C 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 63 THR OG1 : rot -156:sc= 0.688 USER MOD Single : C 65 MET CE :methyl 156:sc= -1.69 (180deg=-3.5!) USER MOD Single : C 67 TYR OH : rot 136:sc= 1.81 USER MOD Single : C 70 ASN : amide:sc= -0.292 K(o=-0.29,f=-3.1!) USER MOD Single : C 72 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0357) USER MOD Single : C 73 LYS NZ :NH3+ -167:sc= -0.0358 (180deg=-0.204) USER MOD Single : C 74 TYR OH : rot 4:sc= 0.947 USER MOD Single : C 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 86 LYS NZ :NH3+ 167:sc= -0.0124 (180deg=-0.214) USER MOD Single : C 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 89 THR OG1 : rot 180:sc= 0 USER MOD Single : C 97 TYR OH : rot 180:sc= 0 USER MOD Single : C 99 LYS NZ :NH3+ -156:sc= 1.14 (180deg=-0.129) USER MOD Single : C 100 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.00798) USER MOD Single : C 102 THR OG1 : rot -83:sc= 2.31 USER MOD Single : C 103 ASN : amide:sc= 0.0771 X(o=0.077,f=-0.27) USER MOD Single : C 105 HEM CMA :methyl 150:sc= -0.0579 (180deg=-0.0579) USER MOD Single : C 105 HEM CMB :methyl 150:sc= -1.02 (180deg=-1.02) USER MOD Single : C 105 HEM CMC :methyl 150:sc= -1.11 (180deg=-1.11) USER MOD Single : C 105 HEM CMD :methyl -30:sc= -0.171 (180deg=-2.14!) USER MOD Single : C1009 PEG O1 : rot 83:sc= 0.0431 USER MOD Single : C1009 PEG O4 : rot 38:sc= 0.0153 USER MOD Single : D 1 GLY N :NH3+ -110:sc= 0.0215 (180deg=0) USER MOD Single : D 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : D 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : D 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : D 12 GLN : amide:sc= 0 X(o=0,f=-0.03) USER MOD Single : D 13 LYS NZ :NH3+ 179:sc= 0.844 (180deg=0.843) USER MOD Single : D 22 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.00982) USER MOD Single : D 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : D 26 HIS : no HD1:sc= 1.48 K(o=1.5,f=-10!) USER MOD Single : D 27 LYS NZ :NH3+ 172:sc= 0.336 (180deg=0.309) USER MOD Single : D 28 THR OG1 : rot 70:sc= 1.3 USER MOD Single : D 33 HIS : no HE2:sc= -1.03 X(o=-1,f=-1) USER MOD Single : D 39 LYS NZ :NH3+ 179:sc= 0.262 (180deg=0.261) USER MOD Single : D 40 THR OG1 : rot 32:sc= 0.135 USER MOD Single : D 42 GLN : amide:sc= -0.0918 X(o=-0.092,f=-0.091) USER MOD Single : D 47 THR OG1 : rot 180:sc= 0 USER MOD Single : D 48 TYR OH : rot -47:sc= 0.539 USER MOD Single : D 49 THR OG1 : rot -101:sc= 1.57 USER MOD Single : D 52 ASN : amide:sc= 0.0183! K(o=0.018!,f=-1.6) USER MOD Single : D 53 LYS NZ :NH3+ -156:sc= -0.661 (180deg=-1.46!) USER MOD Single : D 54 ASN : amide:sc= 0.258 X(o=0.26,f=0.48) USER MOD Single : D 58 THR OG1 : rot 77:sc= 1.44 USER MOD Single : D 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : D 63 THR OG1 : rot -165:sc= 0.969 USER MOD Single : D 65 MET CE :methyl 161:sc= -1.37 (180deg=-2.35!) USER MOD Single : D 67 TYR OH : rot 134:sc= 1.78 USER MOD Single : D 70 ASN : amide:sc= -0.578 K(o=-0.58,f=-3.8!) USER MOD Single : D 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : D 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : D 74 TYR OH : rot 180:sc= -0.537 USER MOD Single : D 78 THR OG1 : rot 27:sc= 2.22 USER MOD Single : D 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : D 80 MET CE :methyl 144:sc= -1.31 (180deg=-3.88!) USER MOD Single : D 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : D 87 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00473) USER MOD Single : D 88 LYS NZ :NH3+ -136:sc= 0.871 (180deg=-0.185) USER MOD Single : D 89 THR OG1 : rot 180:sc= 0 USER MOD Single : D 97 TYR OH : rot 180:sc= 0 USER MOD Single : D 99 LYS NZ :NH3+ 180:sc= 1.28 (180deg=1.28) USER MOD Single : D 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : D 102 THR OG1 : rot -83:sc= 2.29 USER MOD Single : D 103 ASN : amide:sc= -0.09 X(o=-0.09,f=-0.1) USER MOD Single : D 105 HEM CMA :methyl 150:sc= -0.235 (180deg=-0.235) USER MOD Single : D 105 HEM CMB :methyl -30:sc= -0.661 (180deg=-1.28) USER MOD Single : D 105 HEM CMC :methyl -30:sc= -1.96 (180deg=-3.19!) USER MOD Single : D 105 HEM CMD :methyl -30:sc= -1.88 (180deg=-4.49!) USER MOD Single : D1010 PGE O1 : rot 85:sc= 0.637 USER MOD Single : D1010 PGE O4 : rot -22:sc= 0.00176 USER MOD Single : E 1 GLY N :NH3+ -107:sc= 0.0439 (180deg=0) USER MOD Single : E 5 LYS NZ :NH3+ -147:sc= 0.829 (180deg=0.339) USER MOD Single : E 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : E 8 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.0131) USER MOD Single : E 12 GLN : amide:sc= 0 X(o=0,f=-0.073) USER MOD Single : E 13 LYS NZ :NH3+ 169:sc= 1.91 (180deg=1.76) USER MOD Single : E 16 GLN : amide:sc= 0.53 K(o=0.53,f=-3.7!) USER MOD Single : E 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : E 25 LYS NZ :NH3+ 160:sc= -0.045 (180deg=-0.221) USER MOD Single : E 26 HIS : no HD1:sc= 1.48 K(o=1.5,f=-6.7!) USER MOD Single : E 27 LYS NZ :NH3+ -162:sc= 1.08 (180deg=0.914) USER MOD Single : E 33 HIS : no HD1:sc= -0.999 K(o=-1,f=-1.8) USER MOD Single : E 39 LYS NZ :NH3+ 133:sc= -0.121 (180deg=-0.71) USER MOD Single : E 40 THR OG1 : rot 36:sc= -0.0229 USER MOD Single : E 42 GLN : amide:sc= -0.0724 K(o=-0.072,f=-0.92) USER MOD Single : E 47 THR OG1 : rot 180:sc= 0 USER MOD Single : E 48 TYR OH : rot -26:sc= -0.988! USER MOD Single : E 49 THR OG1 : rot -112:sc= 1.78 USER MOD Single : E 52 ASN : amide:sc= 0.384! K(o=0.38!,f=-1.2) USER MOD Single : E 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : E 54 ASN : amide:sc=-0.000936 X(o=-0.00094,f=0) USER MOD Single : E 58 THR OG1 : rot 180:sc= -0.0254 USER MOD Single : E 60 LYS NZ :NH3+ -113:sc= -1.51 (180deg=-3.36!) USER MOD Single : E 63 THR OG1 : rot -164:sc= 0.978 USER MOD Single : E 65 MET CE :methyl 170:sc=-0.000333 (180deg=-0.0782) USER MOD Single : E 67 TYR OH : rot 138:sc= 2.27 USER MOD Single : E 70 ASN : amide:sc= -0.283 K(o=-0.28,f=-3.7!) USER MOD Single : E 72 LYS NZ :NH3+ 173:sc= 0.412 (180deg=0.392) USER MOD Single : E 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : E 74 TYR OH : rot 180:sc= -0.497 USER MOD Single : E 79 LYS NZ :NH3+ 139:sc= 0.0889 (180deg=0.0603) USER MOD Single : E 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : E 87 LYS NZ :NH3+ -164:sc= -0.0585 (180deg=-0.211) USER MOD Single : E 88 LYS NZ :NH3+ -112:sc= 0.847 (180deg=-0.535) USER MOD Single : E 89 THR OG1 : rot 180:sc= 0 USER MOD Single : E 97 TYR OH : rot 26:sc= 1.4 USER MOD Single : E 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : E 100 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.0161) USER MOD Single : E 102 THR OG1 : rot -71:sc= 1.18 USER MOD Single : E 103 ASN : amide:sc= -0.361 X(o=-0.36,f=-0.35) USER MOD Single : E 105 HEM CMA :methyl 150:sc= -0.537 (180deg=-0.537) USER MOD Single : E 105 HEM CMB :methyl 150:sc= -2.09 (180deg=-2.09) USER MOD Single : E 105 HEM CMC :methyl -30:sc= -0.943 (180deg=-1.89!) USER MOD Single : E 105 HEM CMD :methyl -30:sc= -0.316 (180deg=-2.1) USER MOD Single : E1011 PEG O1 : rot 101:sc= 0.231 USER MOD Single : E1011 PEG O4 : rot -26:sc= 0.0145 USER MOD Single : F 1 GLY N :NH3+ -114:sc= 0.0431 (180deg=0) USER MOD Single : F 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : F 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : F 8 LYS NZ :NH3+ 141:sc= -0.0156 (180deg=-0.171) USER MOD Single : F 12 GLN : amide:sc= 0.0803 X(o=0.08,f=0.2) USER MOD Single : F 13 LYS NZ :NH3+ 179:sc= 1.99 (180deg=1.96) USER MOD Single : F 16 GLN : amide:sc= 0.443 K(o=0.44,f=-4.2!) USER MOD Single : F 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : F 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : F 26 HIS : no HD1:sc= 1.49 K(o=1.5,f=-7.1!) USER MOD Single : F 27 LYS NZ :NH3+ 170:sc= 1.03 (180deg=0.982) USER MOD Single : F 28 THR OG1 : rot -140:sc= 0.848 USER MOD Single : F 33 HIS : no HD1:sc= -0.757 K(o=-0.76,f=-1.3) USER MOD Single : F 39 LYS NZ :NH3+ -164:sc= -0.0347 (180deg=-0.173) USER MOD Single : F 40 THR OG1 : rot 90:sc= -0.499 USER MOD Single : F 42 GLN : amide:sc= 0.355 X(o=0.36,f=-0.081) USER MOD Single : F 47 THR OG1 : rot 180:sc= 0 USER MOD Single : F 48 TYR OH : rot -45:sc= 0.798 USER MOD Single : F 49 THR OG1 : rot -99:sc= 1.7 USER MOD Single : F 52 ASN : amide:sc= -0.144! K(o=-0.14!,f=-1.4) USER MOD Single : F 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : F 54 ASN : amide:sc= -0.194 X(o=-0.19,f=0) USER MOD Single : F 58 THR OG1 : rot 180:sc= -0.844 USER MOD Single : F 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : F 63 THR OG1 : rot -155:sc= 0.767 USER MOD Single : F 65 MET CE :methyl -157:sc= -0.477 (180deg=-0.634) USER MOD Single : F 67 TYR OH : rot 138:sc= 1.66 USER MOD Single : F 70 ASN : amide:sc= -0.24 K(o=-0.24,f=-2.4!) USER MOD Single : F 72 LYS NZ :NH3+ 176:sc= 0.0955 (180deg=0.0911) USER MOD Single : F 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : F 74 TYR OH : rot 165:sc= 0 USER MOD Single : F 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : F 86 LYS NZ :NH3+ 169:sc=-0.00446 (180deg=-0.0912) USER MOD Single : F 87 LYS NZ :NH3+ 160:sc= -0.163 (180deg=-0.556) USER MOD Single : F 88 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0166) USER MOD Single : F 89 THR OG1 : rot 105:sc=0.000722 USER MOD Single : F 97 TYR OH : rot 180:sc= 0 USER MOD Single : F 99 LYS NZ :NH3+ -135:sc= 0.948 (180deg=0.0937) USER MOD Single : F 100 LYS NZ :NH3+ 157:sc= 0 (180deg=-0.409) USER MOD Single : F 102 THR OG1 : rot -78:sc= 2.32 USER MOD Single : F 103 ASN : amide:sc= 1.37 K(o=1.4,f=-1.1) USER MOD Single : F 105 HEM CMA :methyl 150:sc= -0.306 (180deg=-0.306) USER MOD Single : F 105 HEM CMB :methyl -30:sc= -0.417 (180deg=-0.765) USER MOD Single : F 105 HEM CMC :methyl 150:sc= -0.714 (180deg=-0.714) USER MOD Single : F 105 HEM CMD :methyl -30:sc= -0.289 (180deg=-1.49) USER MOD Single : F1012 PGE O1 : rot -36:sc= 0 USER MOD Single : F1012 PGE O4 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 11.985 -29.008 -1.860 1.00 40.93 N ATOM 2 CA GLY A 1 11.621 -27.563 -1.970 1.00 39.79 C ATOM 3 C GLY A 1 11.291 -27.141 -3.389 1.00 38.59 C ATOM 4 O GLY A 1 11.941 -27.585 -4.337 1.00 38.74 O ATOM 0 H1 GLY A 1 12.169 -29.204 -1.012 1.00 40.93 H new ATOM 0 H2 GLY A 1 11.304 -29.508 -2.139 1.00 40.93 H new ATOM 0 H3 GLY A 1 12.700 -29.174 -2.364 1.00 40.93 H new ATOM 0 HA2 GLY A 1 10.858 -27.382 -1.399 1.00 39.79 H new ATOM 0 HA3 GLY A 1 12.357 -27.023 -1.640 1.00 39.79 H new ATOM 5 N ASP A 2 10.290 -26.272 -3.534 1.00 37.92 N ATOM 6 CA ASP A 2 9.858 -25.789 -4.848 1.00 38.14 C ATOM 7 C ASP A 2 10.698 -24.618 -5.354 1.00 37.98 C ATOM 8 O ASP A 2 10.428 -23.464 -5.016 1.00 37.28 O ATOM 9 CB ASP A 2 8.396 -25.348 -4.792 1.00 39.05 C ATOM 10 CG ASP A 2 7.823 -25.045 -6.170 1.00 41.74 C ATOM 11 OD1 ASP A 2 8.560 -24.512 -7.033 1.00 41.17 O ATOM 12 OD2 ASP A 2 6.628 -25.335 -6.387 1.00 44.10 O ATOM 0 H ASP A 2 9.843 -25.946 -2.876 1.00 37.92 H new ATOM 0 HA ASP A 2 9.972 -26.530 -5.463 1.00 38.14 H new ATOM 0 HB2 ASP A 2 7.867 -26.044 -4.372 1.00 39.05 H new ATOM 0 HB3 ASP A 2 8.321 -24.559 -4.233 1.00 39.05 H new ATOM 13 N VAL A 3 11.696 -24.921 -6.179 1.00 37.96 N ATOM 14 CA VAL A 3 12.582 -23.908 -6.735 1.00 40.09 C ATOM 15 C VAL A 3 11.819 -22.784 -7.432 1.00 42.47 C ATOM 16 O VAL A 3 12.116 -21.606 -7.226 1.00 41.79 O ATOM 17 CB VAL A 3 13.584 -24.541 -7.729 1.00 40.35 C ATOM 18 CG1 VAL A 3 14.450 -23.467 -8.364 1.00 40.10 C ATOM 19 CG2 VAL A 3 14.458 -25.555 -7.004 1.00 39.42 C ATOM 0 H VAL A 3 11.877 -25.723 -6.432 1.00 37.96 H new ATOM 0 HA VAL A 3 13.063 -23.523 -5.986 1.00 40.09 H new ATOM 0 HB VAL A 3 13.087 -24.991 -8.430 1.00 40.35 H new ATOM 0 HG11 VAL A 3 15.073 -23.878 -8.984 1.00 40.10 H new ATOM 0 HG12 VAL A 3 13.887 -22.837 -8.841 1.00 40.10 H new ATOM 0 HG13 VAL A 3 14.944 -22.999 -7.673 1.00 40.10 H new ATOM 0 HG21 VAL A 3 15.085 -25.949 -7.631 1.00 39.42 H new ATOM 0 HG22 VAL A 3 14.948 -25.111 -6.294 1.00 39.42 H new ATOM 0 HG23 VAL A 3 13.899 -26.251 -6.625 1.00 39.42 H new ATOM 20 N GLU A 4 10.834 -23.148 -8.249 1.00 44.29 N ATOM 21 CA GLU A 4 10.029 -22.166 -8.973 1.00 45.91 C ATOM 22 C GLU A 4 9.456 -21.103 -8.037 1.00 44.59 C ATOM 23 O GLU A 4 9.608 -19.903 -8.278 1.00 43.61 O ATOM 24 CB GLU A 4 8.880 -22.862 -9.709 1.00 50.39 C ATOM 25 CG GLU A 4 7.938 -21.897 -10.417 1.00 57.15 C ATOM 26 CD GLU A 4 6.717 -22.587 -11.002 1.00 62.24 C ATOM 27 OE1 GLU A 4 6.882 -23.439 -11.905 1.00 64.00 O ATOM 28 OE2 GLU A 4 5.591 -22.274 -10.553 1.00 64.59 O ATOM 0 H GLU A 4 10.614 -23.966 -8.399 1.00 44.29 H new ATOM 0 HA GLU A 4 10.613 -21.728 -9.611 1.00 45.91 H new ATOM 0 HB2 GLU A 4 9.249 -23.479 -10.360 1.00 50.39 H new ATOM 0 HB3 GLU A 4 8.372 -23.391 -9.074 1.00 50.39 H new ATOM 0 HG2 GLU A 4 7.650 -21.215 -9.790 1.00 57.15 H new ATOM 0 HG3 GLU A 4 8.419 -21.444 -11.127 1.00 57.15 H new ATOM 29 N LYS A 5 8.784 -21.549 -6.979 1.00 42.60 N ATOM 30 CA LYS A 5 8.200 -20.634 -6.005 1.00 41.61 C ATOM 31 C LYS A 5 9.294 -19.875 -5.263 1.00 40.59 C ATOM 32 O LYS A 5 9.102 -18.725 -4.866 1.00 38.98 O ATOM 33 CB LYS A 5 7.337 -21.401 -5.002 1.00 42.00 C ATOM 34 CG LYS A 5 6.143 -22.102 -5.632 1.00 44.72 C ATOM 35 CD LYS A 5 5.218 -22.691 -4.573 1.00 47.85 C ATOM 36 CE LYS A 5 4.072 -23.464 -5.212 1.00 47.15 C ATOM 37 NZ LYS A 5 3.326 -22.627 -6.191 1.00 45.71 N ATOM 0 H LYS A 5 8.655 -22.382 -6.807 1.00 42.60 H new ATOM 0 HA LYS A 5 7.643 -19.999 -6.482 1.00 41.61 H new ATOM 0 HB2 LYS A 5 7.888 -22.060 -4.551 1.00 42.00 H new ATOM 0 HB3 LYS A 5 7.019 -20.785 -4.324 1.00 42.00 H new ATOM 0 HG2 LYS A 5 5.649 -21.473 -6.181 1.00 44.72 H new ATOM 0 HG3 LYS A 5 6.454 -22.808 -6.220 1.00 44.72 H new ATOM 0 HD2 LYS A 5 5.723 -23.279 -3.990 1.00 47.85 H new ATOM 0 HD3 LYS A 5 4.862 -21.979 -4.019 1.00 47.85 H new ATOM 0 HE2 LYS A 5 4.421 -24.252 -5.658 1.00 47.15 H new ATOM 0 HE3 LYS A 5 3.465 -23.774 -4.522 1.00 47.15 H new ATOM 0 HZ1 LYS A 5 2.452 -22.767 -6.097 1.00 45.71 H new ATOM 0 HZ2 LYS A 5 3.506 -21.768 -6.045 1.00 45.71 H new ATOM 0 HZ3 LYS A 5 3.573 -22.845 -7.018 1.00 45.71 H new ATOM 38 N GLY A 6 10.440 -20.528 -5.079 1.00 40.11 N ATOM 39 CA GLY A 6 11.551 -19.895 -4.397 1.00 40.42 C ATOM 40 C GLY A 6 11.978 -18.628 -5.115 1.00 40.91 C ATOM 41 O GLY A 6 12.144 -17.577 -4.490 1.00 40.93 O ATOM 0 H GLY A 6 10.589 -21.333 -5.342 1.00 40.11 H new ATOM 0 HA2 GLY A 6 11.297 -19.684 -3.485 1.00 40.42 H new ATOM 0 HA3 GLY A 6 12.299 -20.511 -4.348 1.00 40.42 H new ATOM 42 N LYS A 7 12.148 -18.736 -6.432 1.00 39.31 N ATOM 43 CA LYS A 7 12.555 -17.618 -7.277 1.00 39.55 C ATOM 44 C LYS A 7 11.659 -16.415 -7.022 1.00 38.16 C ATOM 45 O LYS A 7 12.134 -15.328 -6.694 1.00 37.92 O ATOM 46 CB LYS A 7 12.460 -18.018 -8.752 1.00 40.26 C ATOM 47 CG LYS A 7 13.021 -16.996 -9.731 1.00 43.15 C ATOM 48 CD LYS A 7 12.631 -17.362 -11.164 1.00 46.72 C ATOM 49 CE LYS A 7 13.355 -16.515 -12.202 1.00 48.24 C ATOM 50 NZ LYS A 7 14.797 -16.886 -12.332 1.00 48.61 N ATOM 0 H LYS A 7 12.028 -19.470 -6.864 1.00 39.31 H new ATOM 0 HA LYS A 7 13.472 -17.385 -7.063 1.00 39.55 H new ATOM 0 HB2 LYS A 7 12.930 -18.858 -8.877 1.00 40.26 H new ATOM 0 HB3 LYS A 7 11.529 -18.179 -8.971 1.00 40.26 H new ATOM 0 HG2 LYS A 7 12.685 -16.112 -9.514 1.00 43.15 H new ATOM 0 HG3 LYS A 7 13.987 -16.959 -9.652 1.00 43.15 H new ATOM 0 HD2 LYS A 7 12.829 -18.299 -11.320 1.00 46.72 H new ATOM 0 HD3 LYS A 7 11.673 -17.253 -11.273 1.00 46.72 H new ATOM 0 HE2 LYS A 7 12.918 -16.618 -13.062 1.00 48.24 H new ATOM 0 HE3 LYS A 7 13.285 -15.579 -11.958 1.00 48.24 H new ATOM 0 HZ1 LYS A 7 15.139 -16.499 -13.057 1.00 48.61 H new ATOM 0 HZ2 LYS A 7 15.241 -16.611 -11.611 1.00 48.61 H new ATOM 0 HZ3 LYS A 7 14.871 -17.770 -12.405 1.00 48.61 H new ATOM 51 N LYS A 8 10.356 -16.622 -7.169 1.00 36.19 N ATOM 52 CA LYS A 8 9.386 -15.561 -6.958 1.00 36.73 C ATOM 53 C LYS A 8 9.548 -14.918 -5.585 1.00 35.30 C ATOM 54 O LYS A 8 9.523 -13.697 -5.464 1.00 35.21 O ATOM 55 CB LYS A 8 7.965 -16.114 -7.122 1.00 38.68 C ATOM 56 CG LYS A 8 7.673 -16.650 -8.521 1.00 39.69 C ATOM 57 CD LYS A 8 6.495 -17.619 -8.526 1.00 41.13 C ATOM 58 CE LYS A 8 5.221 -16.964 -8.025 1.00 41.57 C ATOM 59 NZ LYS A 8 4.120 -17.949 -7.847 1.00 43.31 N ATOM 0 H LYS A 8 10.012 -17.378 -7.393 1.00 36.19 H new ATOM 0 HA LYS A 8 9.543 -14.874 -7.624 1.00 36.73 H new ATOM 0 HB2 LYS A 8 7.827 -16.825 -6.477 1.00 38.68 H new ATOM 0 HB3 LYS A 8 7.328 -15.413 -6.913 1.00 38.68 H new ATOM 0 HG2 LYS A 8 7.484 -15.909 -9.118 1.00 39.69 H new ATOM 0 HG3 LYS A 8 8.461 -17.098 -8.866 1.00 39.69 H new ATOM 0 HD2 LYS A 8 6.355 -17.952 -9.426 1.00 41.13 H new ATOM 0 HD3 LYS A 8 6.705 -18.385 -7.969 1.00 41.13 H new ATOM 0 HE2 LYS A 8 5.397 -16.521 -7.180 1.00 41.57 H new ATOM 0 HE3 LYS A 8 4.942 -16.279 -8.652 1.00 41.57 H new ATOM 0 HZ1 LYS A 8 3.392 -17.530 -7.553 1.00 43.31 H new ATOM 0 HZ2 LYS A 8 3.943 -18.341 -8.626 1.00 43.31 H new ATOM 0 HZ3 LYS A 8 4.366 -18.566 -7.255 1.00 43.31 H new ATOM 60 N ILE A 9 9.714 -15.735 -4.549 1.00 36.08 N ATOM 61 CA ILE A 9 9.881 -15.198 -3.202 1.00 33.71 C ATOM 62 C ILE A 9 11.079 -14.260 -3.179 1.00 33.11 C ATOM 63 O ILE A 9 11.006 -13.145 -2.654 1.00 32.87 O ATOM 64 CB ILE A 9 10.123 -16.312 -2.160 1.00 35.10 C ATOM 65 CG1 ILE A 9 8.944 -17.285 -2.147 1.00 33.71 C ATOM 66 CG2 ILE A 9 10.319 -15.695 -0.776 1.00 33.85 C ATOM 67 CD1 ILE A 9 7.611 -16.614 -1.952 1.00 35.02 C ATOM 0 H ILE A 9 9.733 -16.593 -4.603 1.00 36.08 H new ATOM 0 HA ILE A 9 9.062 -14.731 -2.972 1.00 33.71 H new ATOM 0 HB ILE A 9 10.925 -16.802 -2.400 1.00 35.10 H new ATOM 0 HG12 ILE A 9 8.931 -17.777 -2.983 1.00 33.71 H new ATOM 0 HG13 ILE A 9 9.078 -17.934 -1.438 1.00 33.71 H new ATOM 0 HG21 ILE A 9 10.470 -16.399 -0.126 1.00 33.85 H new ATOM 0 HG22 ILE A 9 11.085 -15.100 -0.792 1.00 33.85 H new ATOM 0 HG23 ILE A 9 9.526 -15.194 -0.530 1.00 33.85 H new ATOM 0 HD11 ILE A 9 6.909 -17.283 -1.953 1.00 35.02 H new ATOM 0 HD12 ILE A 9 7.607 -16.143 -1.104 1.00 35.02 H new ATOM 0 HD13 ILE A 9 7.458 -15.983 -2.673 1.00 35.02 H new ATOM 68 N PHE A 10 12.181 -14.725 -3.754 1.00 32.50 N ATOM 69 CA PHE A 10 13.415 -13.948 -3.812 1.00 32.61 C ATOM 70 C PHE A 10 13.222 -12.602 -4.526 1.00 32.80 C ATOM 71 O PHE A 10 13.696 -11.563 -4.059 1.00 32.51 O ATOM 72 CB PHE A 10 14.497 -14.754 -4.527 1.00 30.13 C ATOM 73 CG PHE A 10 15.848 -14.101 -4.504 1.00 33.21 C ATOM 74 CD1 PHE A 10 16.676 -14.224 -3.389 1.00 30.88 C ATOM 75 CD2 PHE A 10 16.286 -13.338 -5.588 1.00 31.41 C ATOM 76 CE1 PHE A 10 17.919 -13.597 -3.351 1.00 30.53 C ATOM 77 CE2 PHE A 10 17.528 -12.707 -5.561 1.00 30.46 C ATOM 78 CZ PHE A 10 18.345 -12.837 -4.440 1.00 30.37 C ATOM 0 H PHE A 10 12.236 -15.500 -4.122 1.00 32.50 H new ATOM 0 HA PHE A 10 13.683 -13.760 -2.899 1.00 32.61 H new ATOM 0 HB2 PHE A 10 14.563 -15.630 -4.115 1.00 30.13 H new ATOM 0 HB3 PHE A 10 14.229 -14.894 -5.449 1.00 30.13 H new ATOM 0 HD1 PHE A 10 16.395 -14.731 -2.662 1.00 30.88 H new ATOM 0 HD2 PHE A 10 15.742 -13.250 -6.337 1.00 31.41 H new ATOM 0 HE1 PHE A 10 18.463 -13.685 -2.602 1.00 30.53 H new ATOM 0 HE2 PHE A 10 17.810 -12.201 -6.288 1.00 30.46 H new ATOM 0 HZ PHE A 10 19.174 -12.417 -4.418 1.00 30.37 H new ATOM 79 N VAL A 11 12.534 -12.624 -5.664 1.00 33.15 N ATOM 80 CA VAL A 11 12.290 -11.402 -6.418 1.00 32.00 C ATOM 81 C VAL A 11 11.509 -10.371 -5.602 1.00 30.93 C ATOM 82 O VAL A 11 11.835 -9.191 -5.613 1.00 30.18 O ATOM 83 CB VAL A 11 11.498 -11.684 -7.712 1.00 31.98 C ATOM 84 CG1 VAL A 11 11.201 -10.376 -8.432 1.00 31.48 C ATOM 85 CG2 VAL A 11 12.292 -12.609 -8.616 1.00 33.12 C ATOM 0 H VAL A 11 12.201 -13.335 -6.015 1.00 33.15 H new ATOM 0 HA VAL A 11 13.166 -11.046 -6.636 1.00 32.00 H new ATOM 0 HB VAL A 11 10.660 -12.115 -7.483 1.00 31.98 H new ATOM 0 HG11 VAL A 11 10.703 -10.559 -9.244 1.00 31.48 H new ATOM 0 HG12 VAL A 11 10.676 -9.800 -7.854 1.00 31.48 H new ATOM 0 HG13 VAL A 11 12.034 -9.934 -8.657 1.00 31.48 H new ATOM 0 HG21 VAL A 11 11.788 -12.781 -9.426 1.00 33.12 H new ATOM 0 HG22 VAL A 11 13.137 -12.192 -8.844 1.00 33.12 H new ATOM 0 HG23 VAL A 11 12.459 -13.446 -8.156 1.00 33.12 H new ATOM 86 N GLN A 12 10.479 -10.812 -4.895 1.00 30.39 N ATOM 87 CA GLN A 12 9.683 -9.883 -4.111 1.00 32.75 C ATOM 88 C GLN A 12 10.305 -9.438 -2.787 1.00 33.00 C ATOM 89 O GLN A 12 10.117 -8.298 -2.364 1.00 35.08 O ATOM 90 CB GLN A 12 8.305 -10.475 -3.806 1.00 35.10 C ATOM 91 CG GLN A 12 7.417 -9.529 -2.982 1.00 37.52 C ATOM 92 CD GLN A 12 6.223 -10.221 -2.348 1.00 38.83 C ATOM 93 OE1 GLN A 12 5.585 -11.069 -2.971 1.00 41.46 O ATOM 94 NE2 GLN A 12 5.904 -9.850 -1.109 1.00 36.45 N ATOM 0 H GLN A 12 10.227 -11.633 -4.855 1.00 30.39 H new ATOM 0 HA GLN A 12 9.625 -9.095 -4.674 1.00 32.75 H new ATOM 0 HB2 GLN A 12 7.857 -10.687 -4.640 1.00 35.10 H new ATOM 0 HB3 GLN A 12 8.416 -11.309 -3.324 1.00 35.10 H new ATOM 0 HG2 GLN A 12 7.953 -9.119 -2.285 1.00 37.52 H new ATOM 0 HG3 GLN A 12 7.101 -8.813 -3.555 1.00 37.52 H new ATOM 0 HE21 GLN A 12 6.373 -9.254 -0.704 1.00 36.45 H new ATOM 0 HE22 GLN A 12 5.229 -10.207 -0.714 1.00 36.45 H new ATOM 95 N LYS A 13 11.057 -10.319 -2.139 1.00 31.90 N ATOM 96 CA LYS A 13 11.604 -9.981 -0.831 1.00 31.24 C ATOM 97 C LYS A 13 13.119 -9.868 -0.676 1.00 30.92 C ATOM 98 O LYS A 13 13.590 -9.399 0.361 1.00 31.86 O ATOM 99 CB LYS A 13 11.089 -10.995 0.197 1.00 29.30 C ATOM 100 CG LYS A 13 9.572 -11.131 0.247 1.00 30.98 C ATOM 101 CD LYS A 13 9.143 -12.134 1.313 1.00 31.63 C ATOM 102 CE LYS A 13 7.626 -12.261 1.372 1.00 35.44 C ATOM 103 NZ LYS A 13 7.163 -13.087 2.523 1.00 33.68 N ATOM 0 H LYS A 13 11.260 -11.102 -2.431 1.00 31.90 H new ATOM 0 HA LYS A 13 11.293 -9.073 -0.692 1.00 31.24 H new ATOM 0 HB2 LYS A 13 11.474 -11.863 -0.001 1.00 29.30 H new ATOM 0 HB3 LYS A 13 11.408 -10.738 1.076 1.00 29.30 H new ATOM 0 HG2 LYS A 13 9.173 -10.267 0.433 1.00 30.98 H new ATOM 0 HG3 LYS A 13 9.241 -11.415 -0.620 1.00 30.98 H new ATOM 0 HD2 LYS A 13 9.535 -13.000 1.122 1.00 31.63 H new ATOM 0 HD3 LYS A 13 9.481 -11.854 2.178 1.00 31.63 H new ATOM 0 HE2 LYS A 13 7.233 -11.376 1.435 1.00 35.44 H new ATOM 0 HE3 LYS A 13 7.306 -12.656 0.546 1.00 35.44 H new ATOM 0 HZ1 LYS A 13 6.307 -13.303 2.408 1.00 33.68 H new ATOM 0 HZ2 LYS A 13 7.652 -13.829 2.572 1.00 33.68 H new ATOM 0 HZ3 LYS A 13 7.253 -12.623 3.277 1.00 33.68 H new ATOM 104 N CYS A 14 13.883 -10.273 -1.685 1.00 30.40 N ATOM 105 CA CYS A 14 15.340 -10.249 -1.558 1.00 29.81 C ATOM 106 C CYS A 14 16.125 -9.470 -2.603 1.00 29.31 C ATOM 107 O CYS A 14 17.101 -8.790 -2.267 1.00 28.75 O ATOM 108 CB CYS A 14 15.877 -11.686 -1.548 1.00 28.07 C ATOM 109 SG CYS A 14 14.947 -12.889 -0.543 1.00 25.72 S ATOM 0 H CYS A 14 13.587 -10.561 -2.439 1.00 30.40 H new ATOM 0 HA CYS A 14 15.481 -9.771 -0.726 1.00 29.81 H new ATOM 0 HB2 CYS A 14 15.902 -12.008 -2.463 1.00 28.07 H new ATOM 0 HB3 CYS A 14 16.793 -11.667 -1.229 1.00 28.07 H new ATOM 110 N ALA A 15 15.716 -9.597 -3.864 1.00 29.05 N ATOM 111 CA ALA A 15 16.392 -8.952 -4.986 1.00 28.28 C ATOM 112 C ALA A 15 16.751 -7.475 -4.800 1.00 27.90 C ATOM 113 O ALA A 15 17.725 -6.994 -5.376 1.00 26.93 O ATOM 114 CB ALA A 15 15.561 -9.135 -6.262 1.00 30.57 C ATOM 0 H ALA A 15 15.032 -10.065 -4.093 1.00 29.05 H new ATOM 0 HA ALA A 15 17.249 -9.401 -5.050 1.00 28.28 H new ATOM 0 HB1 ALA A 15 16.012 -8.706 -7.006 1.00 30.57 H new ATOM 0 HB2 ALA A 15 15.459 -10.081 -6.449 1.00 30.57 H new ATOM 0 HB3 ALA A 15 14.687 -8.734 -6.139 1.00 30.57 H new ATOM 115 N GLN A 16 15.963 -6.746 -4.020 1.00 27.79 N ATOM 116 CA GLN A 16 16.258 -5.339 -3.782 1.00 30.97 C ATOM 117 C GLN A 16 17.639 -5.136 -3.132 1.00 29.36 C ATOM 118 O GLN A 16 18.257 -4.091 -3.308 1.00 31.35 O ATOM 119 CB GLN A 16 15.164 -4.714 -2.907 1.00 34.53 C ATOM 120 CG GLN A 16 14.864 -5.506 -1.639 1.00 42.70 C ATOM 121 CD GLN A 16 13.533 -5.130 -1.001 1.00 46.37 C ATOM 122 OE1 GLN A 16 13.370 -4.028 -0.471 1.00 50.04 O ATOM 123 NE2 GLN A 16 12.573 -6.050 -1.055 1.00 46.64 N ATOM 0 H GLN A 16 15.260 -7.042 -3.623 1.00 27.79 H new ATOM 0 HA GLN A 16 16.277 -4.896 -4.645 1.00 30.97 H new ATOM 0 HB2 GLN A 16 15.432 -3.815 -2.661 1.00 34.53 H new ATOM 0 HB3 GLN A 16 14.350 -4.634 -3.429 1.00 34.53 H new ATOM 0 HG2 GLN A 16 14.860 -6.453 -1.849 1.00 42.70 H new ATOM 0 HG3 GLN A 16 15.577 -5.361 -0.997 1.00 42.70 H new ATOM 0 HE21 GLN A 16 12.724 -6.807 -1.433 1.00 46.64 H new ATOM 0 HE22 GLN A 16 11.801 -5.887 -0.712 1.00 46.64 H new ATOM 124 N CYS A 17 18.132 -6.133 -2.401 1.00 28.43 N ATOM 125 CA CYS A 17 19.436 -6.001 -1.746 1.00 26.87 C ATOM 126 C CYS A 17 20.461 -7.063 -2.109 1.00 27.39 C ATOM 127 O CYS A 17 21.636 -6.915 -1.783 1.00 29.16 O ATOM 128 CB CYS A 17 19.270 -6.034 -0.231 1.00 25.85 C ATOM 129 SG CYS A 17 18.155 -4.776 0.434 1.00 25.46 S ATOM 0 H CYS A 17 17.735 -6.885 -2.272 1.00 28.43 H new ATOM 0 HA CYS A 17 19.776 -5.152 -2.069 1.00 26.87 H new ATOM 0 HB2 CYS A 17 18.941 -6.909 0.027 1.00 25.85 H new ATOM 0 HB3 CYS A 17 20.142 -5.926 0.180 1.00 25.85 H new ATOM 130 N HIS A 18 20.027 -8.123 -2.782 1.00 27.65 N ATOM 131 CA HIS A 18 20.920 -9.230 -3.126 1.00 27.97 C ATOM 132 C HIS A 18 20.881 -9.665 -4.595 1.00 28.95 C ATOM 133 O HIS A 18 19.860 -9.537 -5.264 1.00 27.15 O ATOM 134 CB HIS A 18 20.562 -10.459 -2.268 1.00 27.16 C ATOM 135 CG HIS A 18 20.871 -10.314 -0.807 1.00 27.63 C ATOM 136 ND1 HIS A 18 22.151 -10.403 -0.301 1.00 28.63 N ATOM 137 CD2 HIS A 18 20.057 -10.147 0.263 1.00 24.14 C ATOM 138 CE1 HIS A 18 22.112 -10.301 1.016 1.00 26.90 C ATOM 139 NE2 HIS A 18 20.853 -10.146 1.383 1.00 25.74 N ATOM 0 H HIS A 18 19.216 -8.223 -3.051 1.00 27.65 H new ATOM 0 HA HIS A 18 21.814 -8.895 -2.954 1.00 27.97 H new ATOM 0 HB2 HIS A 18 19.615 -10.644 -2.369 1.00 27.16 H new ATOM 0 HB3 HIS A 18 21.040 -11.229 -2.613 1.00 27.16 H new ATOM 0 HD1 HIS A 18 22.864 -10.509 -0.770 1.00 28.63 H new ATOM 0 HD2 HIS A 18 19.132 -10.051 0.243 1.00 24.14 H new ATOM 0 HE1 HIS A 18 22.846 -10.333 1.587 1.00 26.90 H new ATOM 140 N THR A 19 22.009 -10.186 -5.073 1.00 31.32 N ATOM 141 CA THR A 19 22.130 -10.731 -6.425 1.00 33.36 C ATOM 142 C THR A 19 22.656 -12.147 -6.183 1.00 35.59 C ATOM 143 O THR A 19 23.348 -12.380 -5.189 1.00 35.92 O ATOM 144 CB THR A 19 23.148 -9.966 -7.292 1.00 32.66 C ATOM 145 OG1 THR A 19 24.434 -9.990 -6.663 1.00 33.78 O ATOM 146 CG2 THR A 19 22.702 -8.529 -7.497 1.00 33.63 C ATOM 0 H THR A 19 22.736 -10.234 -4.615 1.00 31.32 H new ATOM 0 HA THR A 19 21.286 -10.679 -6.901 1.00 33.36 H new ATOM 0 HB THR A 19 23.204 -10.399 -8.158 1.00 32.66 H new ATOM 0 HG1 THR A 19 24.752 -9.213 -6.645 1.00 33.78 H new ATOM 0 HG21 THR A 19 23.353 -8.063 -8.044 1.00 33.63 H new ATOM 0 HG22 THR A 19 21.840 -8.518 -7.941 1.00 33.63 H new ATOM 0 HG23 THR A 19 22.628 -8.087 -6.637 1.00 33.63 H new ATOM 147 N VAL A 20 22.334 -13.088 -7.070 1.00 36.10 N ATOM 148 CA VAL A 20 22.776 -14.475 -6.892 1.00 38.04 C ATOM 149 C VAL A 20 23.738 -15.015 -7.955 1.00 39.10 C ATOM 150 O VAL A 20 24.427 -16.008 -7.721 1.00 38.73 O ATOM 151 CB VAL A 20 21.568 -15.442 -6.831 1.00 37.71 C ATOM 152 CG1 VAL A 20 20.676 -15.096 -5.650 1.00 39.88 C ATOM 153 CG2 VAL A 20 20.781 -15.370 -8.129 1.00 39.44 C ATOM 0 H VAL A 20 21.864 -12.948 -7.777 1.00 36.10 H new ATOM 0 HA VAL A 20 23.265 -14.441 -6.055 1.00 38.04 H new ATOM 0 HB VAL A 20 21.895 -16.348 -6.714 1.00 37.71 H new ATOM 0 HG11 VAL A 20 19.924 -15.708 -5.622 1.00 39.88 H new ATOM 0 HG12 VAL A 20 21.184 -15.172 -4.827 1.00 39.88 H new ATOM 0 HG13 VAL A 20 20.350 -14.187 -5.746 1.00 39.88 H new ATOM 0 HG21 VAL A 20 20.026 -15.978 -8.084 1.00 39.44 H new ATOM 0 HG22 VAL A 20 20.459 -14.465 -8.263 1.00 39.44 H new ATOM 0 HG23 VAL A 20 21.355 -15.622 -8.870 1.00 39.44 H new ATOM 154 N GLU A 21 23.779 -14.370 -9.117 1.00 40.30 N ATOM 155 CA GLU A 21 24.644 -14.810 -10.211 1.00 42.46 C ATOM 156 C GLU A 21 26.131 -14.714 -9.889 1.00 42.16 C ATOM 157 O GLU A 21 26.556 -13.867 -9.099 1.00 40.66 O ATOM 158 CB GLU A 21 24.363 -13.990 -11.476 1.00 43.60 C ATOM 159 CG GLU A 21 24.571 -12.493 -11.303 1.00 47.46 C ATOM 160 CD GLU A 21 23.286 -11.752 -10.982 1.00 50.63 C ATOM 161 OE1 GLU A 21 22.500 -12.245 -10.146 1.00 51.24 O ATOM 162 OE2 GLU A 21 23.066 -10.667 -11.566 1.00 53.01 O ATOM 0 H GLU A 21 23.311 -13.671 -9.294 1.00 40.30 H new ATOM 0 HA GLU A 21 24.435 -15.747 -10.351 1.00 42.46 H new ATOM 0 HB2 GLU A 21 24.938 -14.307 -12.190 1.00 43.60 H new ATOM 0 HB3 GLU A 21 23.448 -14.150 -11.757 1.00 43.60 H new ATOM 0 HG2 GLU A 21 25.213 -12.340 -10.592 1.00 47.46 H new ATOM 0 HG3 GLU A 21 24.955 -12.128 -12.116 1.00 47.46 H new ATOM 163 N LYS A 22 26.917 -15.589 -10.511 1.00 43.62 N ATOM 164 CA LYS A 22 28.361 -15.591 -10.314 1.00 44.67 C ATOM 165 C LYS A 22 28.858 -14.295 -10.922 1.00 44.12 C ATOM 166 O LYS A 22 28.545 -13.983 -12.071 1.00 44.39 O ATOM 167 CB LYS A 22 29.004 -16.789 -11.024 1.00 47.36 C ATOM 168 CG LYS A 22 30.410 -17.136 -10.520 1.00 50.85 C ATOM 169 CD LYS A 22 30.832 -18.541 -10.960 1.00 52.57 C ATOM 170 CE LYS A 22 32.005 -19.077 -10.139 1.00 54.07 C ATOM 171 NZ LYS A 22 32.262 -20.534 -10.384 1.00 52.40 N ATOM 0 H LYS A 22 26.631 -16.192 -11.053 1.00 43.62 H new ATOM 0 HA LYS A 22 28.590 -15.662 -9.374 1.00 44.67 H new ATOM 0 HB2 LYS A 22 28.431 -17.564 -10.913 1.00 47.36 H new ATOM 0 HB3 LYS A 22 29.049 -16.603 -11.975 1.00 47.36 H new ATOM 0 HG2 LYS A 22 31.046 -16.485 -10.857 1.00 50.85 H new ATOM 0 HG3 LYS A 22 30.432 -17.079 -9.552 1.00 50.85 H new ATOM 0 HD2 LYS A 22 30.078 -19.145 -10.875 1.00 52.57 H new ATOM 0 HD3 LYS A 22 31.077 -18.524 -11.898 1.00 52.57 H new ATOM 0 HE2 LYS A 22 32.804 -18.571 -10.354 1.00 54.07 H new ATOM 0 HE3 LYS A 22 31.826 -18.938 -9.196 1.00 54.07 H new ATOM 0 HZ1 LYS A 22 32.950 -20.802 -9.887 1.00 52.40 H new ATOM 0 HZ2 LYS A 22 31.538 -21.004 -10.166 1.00 52.40 H new ATOM 0 HZ3 LYS A 22 32.450 -20.662 -11.244 1.00 52.40 H new ATOM 172 N GLY A 23 29.623 -13.536 -10.148 1.00 43.50 N ATOM 173 CA GLY A 23 30.119 -12.263 -10.634 1.00 42.72 C ATOM 174 C GLY A 23 29.092 -11.175 -10.362 1.00 42.30 C ATOM 175 O GLY A 23 29.295 -10.010 -10.708 1.00 41.67 O ATOM 0 H GLY A 23 29.863 -13.739 -9.347 1.00 43.50 H new ATOM 0 HA2 GLY A 23 30.957 -12.045 -10.198 1.00 42.72 H new ATOM 0 HA3 GLY A 23 30.300 -12.318 -11.585 1.00 42.72 H new ATOM 176 N GLY A 24 27.979 -11.564 -9.744 1.00 40.59 N ATOM 177 CA GLY A 24 26.939 -10.608 -9.425 1.00 39.90 C ATOM 178 C GLY A 24 27.504 -9.457 -8.616 1.00 39.64 C ATOM 179 O GLY A 24 28.505 -9.608 -7.914 1.00 37.72 O ATOM 0 H GLY A 24 27.813 -12.373 -9.505 1.00 40.59 H new ATOM 0 HA2 GLY A 24 26.541 -10.271 -10.243 1.00 39.90 H new ATOM 0 HA3 GLY A 24 26.232 -11.046 -8.925 1.00 39.90 H new ATOM 180 N LYS A 25 26.861 -8.302 -8.711 1.00 39.16 N ATOM 181 CA LYS A 25 27.320 -7.125 -7.996 1.00 39.41 C ATOM 182 C LYS A 25 26.773 -7.039 -6.575 1.00 37.41 C ATOM 183 O LYS A 25 25.748 -7.634 -6.246 1.00 34.82 O ATOM 184 CB LYS A 25 26.924 -5.863 -8.763 1.00 42.32 C ATOM 185 CG LYS A 25 27.418 -4.583 -8.116 1.00 50.30 C ATOM 186 CD LYS A 25 27.053 -3.346 -8.921 1.00 54.79 C ATOM 187 CE LYS A 25 27.583 -2.079 -8.243 1.00 57.58 C ATOM 188 NZ LYS A 25 29.060 -2.139 -8.027 1.00 58.28 N ATOM 0 H LYS A 25 26.155 -8.180 -9.186 1.00 39.16 H new ATOM 0 HA LYS A 25 28.285 -7.198 -7.931 1.00 39.41 H new ATOM 0 HB2 LYS A 25 27.276 -5.918 -9.665 1.00 42.32 H new ATOM 0 HB3 LYS A 25 25.957 -5.828 -8.837 1.00 42.32 H new ATOM 0 HG2 LYS A 25 27.042 -4.508 -7.225 1.00 50.30 H new ATOM 0 HG3 LYS A 25 28.382 -4.626 -8.014 1.00 50.30 H new ATOM 0 HD2 LYS A 25 27.421 -3.417 -9.816 1.00 54.79 H new ATOM 0 HD3 LYS A 25 26.089 -3.289 -9.015 1.00 54.79 H new ATOM 0 HE2 LYS A 25 27.367 -1.306 -8.788 1.00 57.58 H new ATOM 0 HE3 LYS A 25 27.136 -1.958 -7.390 1.00 57.58 H new ATOM 0 HZ1 LYS A 25 29.370 -1.320 -7.868 1.00 58.28 H new ATOM 0 HZ2 LYS A 25 29.237 -2.664 -7.330 1.00 58.28 H new ATOM 0 HZ3 LYS A 25 29.453 -2.469 -8.754 1.00 58.28 H new ATOM 189 N HIS A 26 27.483 -6.303 -5.731 1.00 36.10 N ATOM 190 CA HIS A 26 27.044 -6.098 -4.365 1.00 35.52 C ATOM 191 C HIS A 26 26.093 -4.918 -4.430 1.00 33.69 C ATOM 192 O HIS A 26 26.258 -4.038 -5.273 1.00 34.72 O ATOM 193 CB HIS A 26 28.223 -5.747 -3.462 1.00 32.81 C ATOM 194 CG HIS A 26 29.183 -6.874 -3.261 1.00 32.32 C ATOM 195 ND1 HIS A 26 28.770 -8.168 -3.034 1.00 31.14 N ATOM 196 CD2 HIS A 26 30.536 -6.895 -3.207 1.00 31.29 C ATOM 197 CE1 HIS A 26 29.826 -8.939 -2.847 1.00 30.08 C ATOM 198 NE2 HIS A 26 30.909 -8.190 -2.945 1.00 30.55 N ATOM 0 H HIS A 26 28.223 -5.914 -5.933 1.00 36.10 H new ATOM 0 HA HIS A 26 26.630 -6.897 -4.002 1.00 35.52 H new ATOM 0 HB2 HIS A 26 28.698 -4.992 -3.843 1.00 32.81 H new ATOM 0 HB3 HIS A 26 27.885 -5.463 -2.598 1.00 32.81 H new ATOM 0 HD2 HIS A 26 31.105 -6.169 -3.325 1.00 31.29 H new ATOM 0 HE1 HIS A 26 29.810 -9.853 -2.676 1.00 30.08 H new ATOM 0 HE2 HIS A 26 31.718 -8.469 -2.859 1.00 30.55 H new ATOM 199 N LYS A 27 25.093 -4.920 -3.558 1.00 31.66 N ATOM 200 CA LYS A 27 24.108 -3.845 -3.484 1.00 30.91 C ATOM 201 C LYS A 27 24.058 -3.498 -1.996 1.00 29.46 C ATOM 202 O LYS A 27 25.106 -3.381 -1.362 1.00 27.13 O ATOM 203 CB LYS A 27 22.747 -4.355 -3.988 1.00 30.67 C ATOM 204 CG LYS A 27 22.818 -4.947 -5.400 1.00 34.69 C ATOM 205 CD LYS A 27 21.502 -5.590 -5.870 1.00 34.88 C ATOM 206 CE LYS A 27 20.396 -4.565 -6.094 1.00 36.27 C ATOM 207 NZ LYS A 27 19.205 -5.171 -6.760 1.00 35.91 N ATOM 0 H LYS A 27 24.964 -5.550 -2.987 1.00 31.66 H new ATOM 0 HA LYS A 27 24.330 -3.074 -4.029 1.00 30.91 H new ATOM 0 HB2 LYS A 27 22.413 -5.029 -3.376 1.00 30.67 H new ATOM 0 HB3 LYS A 27 22.110 -3.624 -3.980 1.00 30.67 H new ATOM 0 HG2 LYS A 27 23.067 -4.247 -6.023 1.00 34.69 H new ATOM 0 HG3 LYS A 27 23.522 -5.614 -5.427 1.00 34.69 H new ATOM 0 HD2 LYS A 27 21.660 -6.076 -6.695 1.00 34.88 H new ATOM 0 HD3 LYS A 27 21.209 -6.238 -5.210 1.00 34.88 H new ATOM 0 HE2 LYS A 27 20.131 -4.184 -5.242 1.00 36.27 H new ATOM 0 HE3 LYS A 27 20.735 -3.837 -6.638 1.00 36.27 H new ATOM 0 HZ1 LYS A 27 18.616 -4.532 -6.954 1.00 35.91 H new ATOM 0 HZ2 LYS A 27 19.459 -5.578 -7.510 1.00 35.91 H new ATOM 0 HZ3 LYS A 27 18.829 -5.764 -6.214 1.00 35.91 H new ATOM 208 N THR A 28 22.867 -3.335 -1.430 1.00 27.86 N ATOM 209 CA THR A 28 22.778 -3.044 -0.005 1.00 28.71 C ATOM 210 C THR A 28 23.351 -4.266 0.719 1.00 27.32 C ATOM 211 O THR A 28 24.060 -4.148 1.723 1.00 26.53 O ATOM 212 CB THR A 28 21.319 -2.823 0.447 1.00 29.42 C ATOM 213 OG1 THR A 28 20.751 -1.733 -0.289 1.00 32.10 O ATOM 214 CG2 THR A 28 21.268 -2.482 1.934 1.00 28.66 C ATOM 0 H THR A 28 22.114 -3.387 -1.843 1.00 27.86 H new ATOM 0 HA THR A 28 23.264 -2.230 0.197 1.00 28.71 H new ATOM 0 HB THR A 28 20.819 -3.638 0.285 1.00 29.42 H new ATOM 0 HG1 THR A 28 20.526 -1.998 -1.054 1.00 32.10 H new ATOM 0 HG21 THR A 28 20.346 -2.346 2.204 1.00 28.66 H new ATOM 0 HG22 THR A 28 21.650 -3.211 2.447 1.00 28.66 H new ATOM 0 HG23 THR A 28 21.775 -1.672 2.098 1.00 28.66 H new ATOM 215 N GLY A 29 23.042 -5.439 0.179 1.00 25.41 N ATOM 216 CA GLY A 29 23.529 -6.681 0.742 1.00 26.47 C ATOM 217 C GLY A 29 24.552 -7.332 -0.175 1.00 27.79 C ATOM 218 O GLY A 29 24.667 -6.964 -1.350 1.00 27.71 O ATOM 0 H GLY A 29 22.548 -5.533 -0.519 1.00 25.41 H new ATOM 0 HA2 GLY A 29 23.929 -6.512 1.609 1.00 26.47 H new ATOM 0 HA3 GLY A 29 22.786 -7.288 0.886 1.00 26.47 H new ATOM 219 N PRO A 30 25.305 -8.320 0.325 1.00 27.78 N ATOM 220 CA PRO A 30 26.323 -9.008 -0.475 1.00 27.79 C ATOM 221 C PRO A 30 25.764 -9.896 -1.578 1.00 29.16 C ATOM 222 O PRO A 30 24.619 -10.336 -1.508 1.00 30.16 O ATOM 223 CB PRO A 30 27.064 -9.832 0.570 1.00 30.43 C ATOM 224 CG PRO A 30 25.946 -10.212 1.519 1.00 28.88 C ATOM 225 CD PRO A 30 25.243 -8.882 1.688 1.00 26.98 C ATOM 0 HA PRO A 30 26.876 -8.378 -0.963 1.00 27.79 H new ATOM 0 HB2 PRO A 30 27.492 -10.611 0.182 1.00 30.43 H new ATOM 0 HB3 PRO A 30 27.758 -9.319 1.013 1.00 30.43 H new ATOM 0 HG2 PRO A 30 25.362 -10.890 1.145 1.00 28.88 H new ATOM 0 HG3 PRO A 30 26.281 -10.559 2.360 1.00 28.88 H new ATOM 0 HD2 PRO A 30 24.329 -8.992 1.993 1.00 26.98 H new ATOM 0 HD3 PRO A 30 25.692 -8.315 2.334 1.00 26.98 H new ATOM 226 N ASN A 31 26.581 -10.158 -2.596 1.00 28.84 N ATOM 227 CA ASN A 31 26.178 -11.048 -3.679 1.00 28.57 C ATOM 228 C ASN A 31 26.186 -12.436 -3.042 1.00 28.41 C ATOM 229 O ASN A 31 27.115 -12.774 -2.311 1.00 27.71 O ATOM 230 CB ASN A 31 27.177 -10.985 -4.835 1.00 27.63 C ATOM 231 CG ASN A 31 27.110 -12.213 -5.720 1.00 28.87 C ATOM 232 OD1 ASN A 31 27.770 -13.216 -5.452 1.00 25.31 O ATOM 233 ND2 ASN A 31 26.288 -12.151 -6.765 1.00 24.74 N ATOM 0 H ASN A 31 27.372 -9.830 -2.677 1.00 28.84 H new ATOM 0 HA ASN A 31 25.315 -10.810 -4.052 1.00 28.57 H new ATOM 0 HB2 ASN A 31 27.002 -10.194 -5.369 1.00 27.63 H new ATOM 0 HB3 ASN A 31 28.075 -10.894 -4.479 1.00 27.63 H new ATOM 0 HD21 ASN A 31 26.202 -12.830 -7.285 1.00 24.74 H new ATOM 0 HD22 ASN A 31 25.843 -11.432 -6.920 1.00 24.74 H new ATOM 234 N LEU A 32 25.164 -13.238 -3.317 1.00 27.73 N ATOM 235 CA LEU A 32 25.053 -14.554 -2.694 1.00 30.36 C ATOM 236 C LEU A 32 25.667 -15.765 -3.391 1.00 30.55 C ATOM 237 O LEU A 32 25.567 -16.875 -2.880 1.00 30.66 O ATOM 238 CB LEU A 32 23.576 -14.849 -2.403 1.00 26.78 C ATOM 239 CG LEU A 32 22.869 -13.842 -1.485 1.00 27.32 C ATOM 240 CD1 LEU A 32 21.424 -14.247 -1.278 1.00 24.95 C ATOM 241 CD2 LEU A 32 23.595 -13.766 -0.155 1.00 27.02 C ATOM 0 H LEU A 32 24.526 -13.041 -3.859 1.00 27.73 H new ATOM 0 HA LEU A 32 25.606 -14.458 -1.903 1.00 30.36 H new ATOM 0 HB2 LEU A 32 23.098 -14.886 -3.246 1.00 26.78 H new ATOM 0 HB3 LEU A 32 23.511 -15.730 -2.002 1.00 26.78 H new ATOM 0 HG LEU A 32 22.884 -12.966 -1.902 1.00 27.32 H new ATOM 0 HD11 LEU A 32 20.988 -13.604 -0.697 1.00 24.95 H new ATOM 0 HD12 LEU A 32 20.968 -14.270 -2.134 1.00 24.95 H new ATOM 0 HD13 LEU A 32 21.389 -15.126 -0.870 1.00 24.95 H new ATOM 0 HD21 LEU A 32 23.146 -13.129 0.423 1.00 27.02 H new ATOM 0 HD22 LEU A 32 23.593 -14.640 0.265 1.00 27.02 H new ATOM 0 HD23 LEU A 32 24.510 -13.480 -0.302 1.00 27.02 H new ATOM 242 N HIS A 33 26.313 -15.576 -4.533 1.00 33.14 N ATOM 243 CA HIS A 33 26.866 -16.732 -5.230 1.00 35.78 C ATOM 244 C HIS A 33 27.906 -17.518 -4.430 1.00 35.39 C ATOM 245 O HIS A 33 28.831 -16.944 -3.856 1.00 34.67 O ATOM 246 CB HIS A 33 27.453 -16.318 -6.574 1.00 37.56 C ATOM 247 CG HIS A 33 27.833 -17.480 -7.433 1.00 41.95 C ATOM 248 ND1 HIS A 33 28.958 -18.241 -7.198 1.00 44.10 N ATOM 249 CD2 HIS A 33 27.212 -18.043 -8.496 1.00 43.45 C ATOM 250 CE1 HIS A 33 29.015 -19.223 -8.081 1.00 45.62 C ATOM 251 NE2 HIS A 33 27.967 -19.125 -8.880 1.00 45.84 N ATOM 0 H HIS A 33 26.441 -14.815 -4.913 1.00 33.14 H new ATOM 0 HA HIS A 33 26.116 -17.333 -5.360 1.00 35.78 H new ATOM 0 HB2 HIS A 33 26.807 -15.771 -7.048 1.00 37.56 H new ATOM 0 HB3 HIS A 33 28.236 -15.766 -6.422 1.00 37.56 H new ATOM 0 HD1 HIS A 33 29.533 -18.099 -6.574 1.00 44.10 H new ATOM 0 HD2 HIS A 33 26.422 -17.752 -8.892 1.00 43.45 H new ATOM 0 HE1 HIS A 33 29.679 -19.872 -8.131 1.00 45.62 H new ATOM 252 N GLY A 34 27.735 -18.838 -4.398 1.00 35.17 N ATOM 253 CA GLY A 34 28.651 -19.700 -3.669 1.00 37.34 C ATOM 254 C GLY A 34 28.328 -19.731 -2.187 1.00 37.98 C ATOM 255 O GLY A 34 29.177 -20.075 -1.364 1.00 39.48 O ATOM 0 H GLY A 34 27.093 -19.251 -4.794 1.00 35.17 H new ATOM 0 HA2 GLY A 34 28.606 -20.599 -4.030 1.00 37.34 H new ATOM 0 HA3 GLY A 34 29.561 -19.388 -3.796 1.00 37.34 H new ATOM 256 N LEU A 35 27.085 -19.385 -1.861 1.00 37.32 N ATOM 257 CA LEU A 35 26.609 -19.328 -0.483 1.00 37.68 C ATOM 258 C LEU A 35 26.676 -20.631 0.306 1.00 37.32 C ATOM 259 O LEU A 35 27.215 -20.664 1.409 1.00 37.60 O ATOM 260 CB LEU A 35 25.166 -18.808 -0.453 1.00 36.30 C ATOM 261 CG LEU A 35 24.553 -18.581 0.934 1.00 36.37 C ATOM 262 CD1 LEU A 35 25.264 -17.423 1.633 1.00 33.23 C ATOM 263 CD2 LEU A 35 23.070 -18.290 0.796 1.00 35.34 C ATOM 0 H LEU A 35 26.487 -19.174 -2.442 1.00 37.32 H new ATOM 0 HA LEU A 35 27.228 -18.726 -0.041 1.00 37.68 H new ATOM 0 HB2 LEU A 35 25.134 -17.970 -0.940 1.00 36.30 H new ATOM 0 HB3 LEU A 35 24.606 -19.437 -0.934 1.00 36.30 H new ATOM 0 HG LEU A 35 24.665 -19.381 1.471 1.00 36.37 H new ATOM 0 HD11 LEU A 35 24.872 -17.284 2.509 1.00 33.23 H new ATOM 0 HD12 LEU A 35 26.206 -17.633 1.730 1.00 33.23 H new ATOM 0 HD13 LEU A 35 25.166 -16.616 1.104 1.00 33.23 H new ATOM 0 HD21 LEU A 35 22.685 -18.147 1.675 1.00 35.34 H new ATOM 0 HD22 LEU A 35 22.945 -17.494 0.255 1.00 35.34 H new ATOM 0 HD23 LEU A 35 22.631 -19.042 0.370 1.00 35.34 H new ATOM 264 N PHE A 36 26.120 -21.700 -0.253 1.00 37.56 N ATOM 265 CA PHE A 36 26.094 -22.983 0.437 1.00 37.93 C ATOM 266 C PHE A 36 27.460 -23.605 0.697 1.00 37.61 C ATOM 267 O PHE A 36 28.387 -23.468 -0.102 1.00 38.58 O ATOM 268 CB PHE A 36 25.208 -23.971 -0.326 1.00 38.29 C ATOM 269 CG PHE A 36 23.742 -23.635 -0.272 1.00 38.26 C ATOM 270 CD1 PHE A 36 23.271 -22.421 -0.768 1.00 38.45 C ATOM 271 CD2 PHE A 36 22.831 -24.528 0.283 1.00 36.78 C ATOM 272 CE1 PHE A 36 21.912 -22.103 -0.709 1.00 36.87 C ATOM 273 CE2 PHE A 36 21.468 -24.218 0.347 1.00 38.01 C ATOM 274 CZ PHE A 36 21.010 -23.003 -0.150 1.00 36.40 C ATOM 0 H PHE A 36 25.753 -21.703 -1.031 1.00 37.56 H new ATOM 0 HA PHE A 36 25.726 -22.793 1.314 1.00 37.93 H new ATOM 0 HB2 PHE A 36 25.492 -23.998 -1.253 1.00 38.29 H new ATOM 0 HB3 PHE A 36 25.341 -24.860 0.038 1.00 38.29 H new ATOM 0 HD1 PHE A 36 23.869 -21.815 -1.143 1.00 38.45 H new ATOM 0 HD2 PHE A 36 23.132 -25.342 0.616 1.00 36.78 H new ATOM 0 HE1 PHE A 36 21.610 -21.289 -1.043 1.00 36.87 H new ATOM 0 HE2 PHE A 36 20.870 -24.824 0.721 1.00 38.01 H new ATOM 0 HZ PHE A 36 20.105 -22.793 -0.109 1.00 36.40 H new ATOM 275 N GLY A 37 27.571 -24.279 1.840 1.00 38.14 N ATOM 276 CA GLY A 37 28.810 -24.937 2.213 1.00 36.23 C ATOM 277 C GLY A 37 29.921 -23.969 2.561 1.00 37.12 C ATOM 278 O GLY A 37 31.089 -24.357 2.634 1.00 38.05 O ATOM 0 H GLY A 37 26.935 -24.365 2.412 1.00 38.14 H new ATOM 0 HA2 GLY A 37 28.645 -25.517 2.973 1.00 36.23 H new ATOM 0 HA3 GLY A 37 29.101 -25.504 1.482 1.00 36.23 H new ATOM 279 N ARG A 38 29.559 -22.707 2.775 1.00 36.71 N ATOM 280 CA ARG A 38 30.527 -21.672 3.121 1.00 35.94 C ATOM 281 C ARG A 38 30.122 -20.959 4.410 1.00 35.76 C ATOM 282 O ARG A 38 28.935 -20.860 4.725 1.00 36.72 O ATOM 283 CB ARG A 38 30.621 -20.654 1.991 1.00 36.03 C ATOM 284 CG ARG A 38 31.682 -19.596 2.207 1.00 37.21 C ATOM 285 CD ARG A 38 31.701 -18.612 1.046 1.00 38.76 C ATOM 286 NE ARG A 38 30.492 -17.791 1.005 1.00 39.93 N ATOM 287 CZ ARG A 38 30.167 -16.990 -0.006 1.00 38.74 C ATOM 288 NH1 ARG A 38 29.050 -16.275 0.040 1.00 37.17 N ATOM 289 NH2 ARG A 38 30.955 -16.918 -1.070 1.00 38.84 N ATOM 0 H ARG A 38 28.747 -22.428 2.724 1.00 36.71 H new ATOM 0 HA ARG A 38 31.389 -22.095 3.255 1.00 35.94 H new ATOM 0 HB2 ARG A 38 30.806 -21.121 1.161 1.00 36.03 H new ATOM 0 HB3 ARG A 38 29.760 -20.220 1.886 1.00 36.03 H new ATOM 0 HG2 ARG A 38 31.510 -19.123 3.036 1.00 37.21 H new ATOM 0 HG3 ARG A 38 32.552 -20.016 2.296 1.00 37.21 H new ATOM 0 HD2 ARG A 38 32.479 -18.037 1.123 1.00 38.76 H new ATOM 0 HD3 ARG A 38 31.789 -19.099 0.212 1.00 38.76 H new ATOM 0 HE ARG A 38 29.957 -17.828 1.677 1.00 39.93 H new ATOM 0 HH11 ARG A 38 28.533 -16.328 0.725 1.00 37.17 H new ATOM 0 HH12 ARG A 38 28.843 -15.758 -0.615 1.00 37.17 H new ATOM 0 HH21 ARG A 38 31.674 -17.388 -1.105 1.00 38.84 H new ATOM 0 HH22 ARG A 38 30.747 -16.401 -1.725 1.00 38.84 H new ATOM 290 N LYS A 39 31.111 -20.459 5.145 1.00 35.10 N ATOM 291 CA LYS A 39 30.860 -19.754 6.397 1.00 36.05 C ATOM 292 C LYS A 39 30.286 -18.357 6.167 1.00 35.88 C ATOM 293 O LYS A 39 30.470 -17.760 5.100 1.00 34.59 O ATOM 294 CB LYS A 39 32.148 -19.639 7.210 1.00 37.39 C ATOM 295 CG LYS A 39 32.704 -20.966 7.687 1.00 41.19 C ATOM 296 CD LYS A 39 33.765 -20.762 8.763 1.00 40.28 C ATOM 297 CE LYS A 39 34.458 -22.071 9.114 1.00 40.44 C ATOM 298 NZ LYS A 39 33.497 -23.117 9.539 1.00 40.49 N ATOM 0 H LYS A 39 31.942 -20.519 4.933 1.00 35.10 H new ATOM 0 HA LYS A 39 30.203 -20.274 6.886 1.00 36.05 H new ATOM 0 HB2 LYS A 39 32.820 -19.194 6.671 1.00 37.39 H new ATOM 0 HB3 LYS A 39 31.982 -19.074 7.981 1.00 37.39 H new ATOM 0 HG2 LYS A 39 31.985 -21.514 8.038 1.00 41.19 H new ATOM 0 HG3 LYS A 39 33.088 -21.447 6.937 1.00 41.19 H new ATOM 0 HD2 LYS A 39 34.422 -20.119 8.454 1.00 40.28 H new ATOM 0 HD3 LYS A 39 33.354 -20.388 9.558 1.00 40.28 H new ATOM 0 HE2 LYS A 39 34.958 -22.387 8.345 1.00 40.44 H new ATOM 0 HE3 LYS A 39 35.099 -21.915 9.825 1.00 40.44 H new ATOM 0 HZ1 LYS A 39 33.942 -23.806 9.885 1.00 40.49 H new ATOM 0 HZ2 LYS A 39 32.946 -22.782 10.152 1.00 40.49 H new ATOM 0 HZ3 LYS A 39 33.026 -23.391 8.835 1.00 40.49 H new ATOM 299 N THR A 40 29.601 -17.836 7.182 1.00 34.82 N ATOM 300 CA THR A 40 28.987 -16.513 7.095 1.00 32.86 C ATOM 301 C THR A 40 29.996 -15.416 6.803 1.00 32.45 C ATOM 302 O THR A 40 31.182 -15.546 7.099 1.00 33.00 O ATOM 303 CB THR A 40 28.280 -16.122 8.404 1.00 32.19 C ATOM 304 OG1 THR A 40 29.248 -16.060 9.458 1.00 35.02 O ATOM 305 CG2 THR A 40 27.192 -17.126 8.764 1.00 28.93 C ATOM 0 H THR A 40 29.480 -18.235 7.934 1.00 34.82 H new ATOM 0 HA THR A 40 28.352 -16.585 6.365 1.00 32.86 H new ATOM 0 HB THR A 40 27.860 -15.256 8.283 1.00 32.19 H new ATOM 0 HG1 THR A 40 29.386 -15.258 9.665 1.00 35.02 H new ATOM 0 HG21 THR A 40 26.763 -16.856 9.591 1.00 28.93 H new ATOM 0 HG22 THR A 40 26.532 -17.157 8.054 1.00 28.93 H new ATOM 0 HG23 THR A 40 27.587 -18.005 8.877 1.00 28.93 H new ATOM 306 N GLY A 41 29.498 -14.329 6.228 1.00 32.02 N ATOM 307 CA GLY A 41 30.321 -13.178 5.919 1.00 32.37 C ATOM 308 C GLY A 41 31.605 -13.372 5.138 1.00 32.82 C ATOM 309 O GLY A 41 32.614 -12.738 5.453 1.00 32.65 O ATOM 0 H GLY A 41 28.672 -14.241 6.007 1.00 32.02 H new ATOM 0 HA2 GLY A 41 29.771 -12.551 5.424 1.00 32.37 H new ATOM 0 HA3 GLY A 41 30.552 -12.751 6.759 1.00 32.37 H new ATOM 310 N GLN A 42 31.584 -14.208 4.106 1.00 34.08 N ATOM 311 CA GLN A 42 32.799 -14.429 3.330 1.00 35.89 C ATOM 312 C GLN A 42 32.721 -13.991 1.866 1.00 36.17 C ATOM 313 O GLN A 42 33.666 -14.215 1.106 1.00 35.53 O ATOM 314 CB GLN A 42 33.214 -15.900 3.412 1.00 36.66 C ATOM 315 CG GLN A 42 33.472 -16.389 4.831 1.00 38.76 C ATOM 316 CD GLN A 42 34.528 -15.566 5.543 1.00 42.27 C ATOM 317 OE1 GLN A 42 35.663 -15.455 5.076 1.00 43.73 O ATOM 318 NE2 GLN A 42 34.159 -14.983 6.680 1.00 41.90 N ATOM 0 H GLN A 42 30.894 -14.648 3.843 1.00 34.08 H new ATOM 0 HA GLN A 42 33.469 -13.857 3.736 1.00 35.89 H new ATOM 0 HB2 GLN A 42 32.519 -16.446 3.012 1.00 36.66 H new ATOM 0 HB3 GLN A 42 34.017 -16.031 2.883 1.00 36.66 H new ATOM 0 HG2 GLN A 42 32.645 -16.357 5.337 1.00 38.76 H new ATOM 0 HG3 GLN A 42 33.752 -17.317 4.805 1.00 38.76 H new ATOM 0 HE21 GLN A 42 33.357 -15.084 6.974 1.00 41.90 H new ATOM 0 HE22 GLN A 42 34.722 -14.505 7.121 1.00 41.90 H new ATOM 319 N ALA A 43 31.610 -13.370 1.469 1.00 34.68 N ATOM 320 CA ALA A 43 31.469 -12.901 0.090 1.00 34.59 C ATOM 321 C ALA A 43 32.557 -11.861 -0.154 1.00 34.50 C ATOM 322 O ALA A 43 32.579 -10.820 0.492 1.00 34.76 O ATOM 323 CB ALA A 43 30.093 -12.281 -0.127 1.00 32.99 C ATOM 0 H ALA A 43 30.934 -13.212 1.976 1.00 34.68 H new ATOM 0 HA ALA A 43 31.558 -13.643 -0.528 1.00 34.59 H new ATOM 0 HB1 ALA A 43 30.016 -11.976 -1.045 1.00 32.99 H new ATOM 0 HB2 ALA A 43 29.407 -12.944 0.051 1.00 32.99 H new ATOM 0 HB3 ALA A 43 29.979 -11.528 0.474 1.00 32.99 H new ATOM 324 N PRO A 44 33.480 -12.132 -1.090 1.00 36.04 N ATOM 325 CA PRO A 44 34.565 -11.186 -1.381 1.00 35.86 C ATOM 326 C PRO A 44 34.057 -9.810 -1.797 1.00 34.62 C ATOM 327 O PRO A 44 33.040 -9.699 -2.473 1.00 33.86 O ATOM 328 CB PRO A 44 35.334 -11.872 -2.513 1.00 36.86 C ATOM 329 CG PRO A 44 35.039 -13.334 -2.299 1.00 37.15 C ATOM 330 CD PRO A 44 33.576 -13.320 -1.953 1.00 35.71 C ATOM 0 HA PRO A 44 35.111 -11.004 -0.600 1.00 35.86 H new ATOM 0 HB2 PRO A 44 35.033 -11.570 -3.384 1.00 36.86 H new ATOM 0 HB3 PRO A 44 36.285 -11.688 -2.462 1.00 36.86 H new ATOM 0 HG2 PRO A 44 35.217 -13.859 -3.095 1.00 37.15 H new ATOM 0 HG3 PRO A 44 35.576 -13.710 -1.584 1.00 37.15 H new ATOM 0 HD2 PRO A 44 33.017 -13.243 -2.742 1.00 35.71 H new ATOM 0 HD3 PRO A 44 33.304 -14.128 -1.491 1.00 35.71 H new ATOM 331 N GLY A 45 34.771 -8.770 -1.380 1.00 33.48 N ATOM 332 CA GLY A 45 34.396 -7.414 -1.736 1.00 33.17 C ATOM 333 C GLY A 45 33.297 -6.746 -0.928 1.00 33.06 C ATOM 334 O GLY A 45 33.009 -5.564 -1.135 1.00 33.21 O ATOM 0 H GLY A 45 35.475 -8.831 -0.890 1.00 33.48 H new ATOM 0 HA2 GLY A 45 35.190 -6.860 -1.674 1.00 33.17 H new ATOM 0 HA3 GLY A 45 34.122 -7.415 -2.667 1.00 33.17 H new ATOM 335 N PHE A 46 32.677 -7.472 -0.006 1.00 31.48 N ATOM 336 CA PHE A 46 31.610 -6.872 0.787 1.00 31.19 C ATOM 337 C PHE A 46 32.010 -6.700 2.250 1.00 30.74 C ATOM 338 O PHE A 46 32.646 -7.574 2.838 1.00 31.25 O ATOM 339 CB PHE A 46 30.343 -7.727 0.703 1.00 30.08 C ATOM 340 CG PHE A 46 29.141 -7.088 1.342 1.00 31.16 C ATOM 341 CD1 PHE A 46 28.330 -6.221 0.617 1.00 29.58 C ATOM 342 CD2 PHE A 46 28.841 -7.326 2.682 1.00 29.67 C ATOM 343 CE1 PHE A 46 27.238 -5.598 1.216 1.00 30.69 C ATOM 344 CE2 PHE A 46 27.753 -6.709 3.292 1.00 28.75 C ATOM 345 CZ PHE A 46 26.950 -5.846 2.567 1.00 29.93 C ATOM 0 H PHE A 46 32.852 -8.294 0.174 1.00 31.48 H new ATOM 0 HA PHE A 46 31.440 -5.992 0.417 1.00 31.19 H new ATOM 0 HB2 PHE A 46 30.146 -7.909 -0.229 1.00 30.08 H new ATOM 0 HB3 PHE A 46 30.510 -8.582 1.129 1.00 30.08 H new ATOM 0 HD1 PHE A 46 28.519 -6.055 -0.278 1.00 29.58 H new ATOM 0 HD2 PHE A 46 29.375 -7.905 3.176 1.00 29.67 H new ATOM 0 HE1 PHE A 46 26.702 -5.020 0.723 1.00 30.69 H new ATOM 0 HE2 PHE A 46 27.565 -6.877 4.187 1.00 28.75 H new ATOM 0 HZ PHE A 46 26.223 -5.432 2.973 1.00 29.93 H new ATOM 346 N THR A 47 31.634 -5.570 2.835 1.00 30.48 N ATOM 347 CA THR A 47 31.946 -5.315 4.233 1.00 30.78 C ATOM 348 C THR A 47 30.743 -5.614 5.110 1.00 28.78 C ATOM 349 O THR A 47 29.759 -4.879 5.107 1.00 28.72 O ATOM 350 CB THR A 47 32.367 -3.863 4.468 1.00 30.76 C ATOM 351 OG1 THR A 47 33.603 -3.613 3.791 1.00 30.45 O ATOM 352 CG2 THR A 47 32.561 -3.608 5.966 1.00 33.40 C ATOM 0 H THR A 47 31.199 -4.941 2.442 1.00 30.48 H new ATOM 0 HA THR A 47 32.686 -5.898 4.465 1.00 30.78 H new ATOM 0 HB THR A 47 31.675 -3.275 4.128 1.00 30.76 H new ATOM 0 HG1 THR A 47 33.836 -2.816 3.917 1.00 30.45 H new ATOM 0 HG21 THR A 47 32.828 -2.686 6.106 1.00 33.40 H new ATOM 0 HG22 THR A 47 31.728 -3.778 6.434 1.00 33.40 H new ATOM 0 HG23 THR A 47 33.250 -4.199 6.308 1.00 33.40 H new ATOM 353 N TYR A 48 30.840 -6.703 5.858 1.00 26.14 N ATOM 354 CA TYR A 48 29.778 -7.145 6.752 1.00 26.57 C ATOM 355 C TYR A 48 29.892 -6.479 8.118 1.00 26.30 C ATOM 356 O TYR A 48 30.889 -5.830 8.423 1.00 25.87 O ATOM 357 CB TYR A 48 29.892 -8.651 6.976 1.00 28.12 C ATOM 358 CG TYR A 48 29.631 -9.512 5.763 1.00 28.40 C ATOM 359 CD1 TYR A 48 28.352 -9.969 5.477 1.00 27.52 C ATOM 360 CD2 TYR A 48 30.677 -9.906 4.923 1.00 31.43 C ATOM 361 CE1 TYR A 48 28.111 -10.810 4.387 1.00 27.71 C ATOM 362 CE2 TYR A 48 30.446 -10.750 3.822 1.00 29.28 C ATOM 363 CZ TYR A 48 29.163 -11.199 3.569 1.00 27.70 C ATOM 364 OH TYR A 48 28.933 -12.080 2.534 1.00 25.94 O ATOM 0 H TYR A 48 31.532 -7.213 5.862 1.00 26.14 H new ATOM 0 HA TYR A 48 28.933 -6.908 6.339 1.00 26.57 H new ATOM 0 HB2 TYR A 48 30.783 -8.846 7.306 1.00 28.12 H new ATOM 0 HB3 TYR A 48 29.269 -8.906 7.674 1.00 28.12 H new ATOM 0 HD1 TYR A 48 27.643 -9.711 6.020 1.00 27.52 H new ATOM 0 HD2 TYR A 48 31.540 -9.605 5.095 1.00 31.43 H new ATOM 0 HE1 TYR A 48 27.248 -11.108 4.210 1.00 27.71 H new ATOM 0 HE2 TYR A 48 31.150 -11.004 3.269 1.00 29.28 H new ATOM 0 HH TYR A 48 28.692 -12.822 2.846 1.00 25.94 H new ATOM 365 N THR A 49 28.862 -6.639 8.940 1.00 25.61 N ATOM 366 CA THR A 49 28.934 -6.127 10.299 1.00 22.99 C ATOM 367 C THR A 49 29.885 -7.121 10.965 1.00 23.41 C ATOM 368 O THR A 49 30.124 -8.213 10.441 1.00 21.43 O ATOM 369 CB THR A 49 27.581 -6.211 11.053 1.00 20.31 C ATOM 370 OG1 THR A 49 27.020 -7.517 10.882 1.00 20.86 O ATOM 371 CG2 THR A 49 26.602 -5.149 10.555 1.00 21.20 C ATOM 0 H THR A 49 28.126 -7.034 8.735 1.00 25.61 H new ATOM 0 HA THR A 49 29.199 -5.194 10.310 1.00 22.99 H new ATOM 0 HB THR A 49 27.743 -6.046 11.995 1.00 20.31 H new ATOM 0 HG1 THR A 49 26.272 -7.454 10.506 1.00 20.86 H new ATOM 0 HG21 THR A 49 25.767 -5.225 11.042 1.00 21.20 H new ATOM 0 HG22 THR A 49 26.981 -4.267 10.698 1.00 21.20 H new ATOM 0 HG23 THR A 49 26.436 -5.280 9.608 1.00 21.20 H new ATOM 372 N ASP A 50 30.436 -6.751 12.111 1.00 23.69 N ATOM 373 CA ASP A 50 31.322 -7.656 12.817 1.00 23.97 C ATOM 374 C ASP A 50 30.534 -8.904 13.184 1.00 23.50 C ATOM 375 O ASP A 50 31.068 -10.011 13.177 1.00 23.20 O ATOM 376 CB ASP A 50 31.866 -6.987 14.079 1.00 26.17 C ATOM 377 CG ASP A 50 33.068 -6.116 13.797 1.00 26.36 C ATOM 378 OD1 ASP A 50 33.376 -5.243 14.629 1.00 32.63 O ATOM 379 OD2 ASP A 50 33.711 -6.312 12.750 1.00 30.19 O ATOM 0 H ASP A 50 30.311 -5.990 12.492 1.00 23.69 H new ATOM 0 HA ASP A 50 32.075 -7.891 12.252 1.00 23.97 H new ATOM 0 HB2 ASP A 50 31.168 -6.449 14.483 1.00 26.17 H new ATOM 0 HB3 ASP A 50 32.108 -7.669 14.725 1.00 26.17 H new ATOM 380 N ALA A 51 29.252 -8.726 13.483 1.00 22.24 N ATOM 381 CA ALA A 51 28.414 -9.861 13.853 1.00 23.60 C ATOM 382 C ALA A 51 28.259 -10.874 12.713 1.00 24.94 C ATOM 383 O ALA A 51 28.456 -12.077 12.904 1.00 23.59 O ATOM 384 CB ALA A 51 27.049 -9.371 14.311 1.00 20.37 C ATOM 0 H ALA A 51 28.851 -7.965 13.478 1.00 22.24 H new ATOM 0 HA ALA A 51 28.858 -10.321 14.582 1.00 23.60 H new ATOM 0 HB1 ALA A 51 26.497 -10.131 14.555 1.00 20.37 H new ATOM 0 HB2 ALA A 51 27.155 -8.789 15.079 1.00 20.37 H new ATOM 0 HB3 ALA A 51 26.623 -8.881 13.591 1.00 20.37 H new ATOM 385 N ASN A 52 27.906 -10.394 11.524 1.00 24.85 N ATOM 386 CA ASN A 52 27.726 -11.293 10.388 1.00 25.55 C ATOM 387 C ASN A 52 29.090 -11.850 10.004 1.00 27.00 C ATOM 388 O ASN A 52 29.204 -12.996 9.558 1.00 27.83 O ATOM 389 CB ASN A 52 27.095 -10.533 9.211 1.00 24.93 C ATOM 390 CG ASN A 52 26.485 -11.458 8.157 1.00 27.50 C ATOM 391 OD1 ASN A 52 25.550 -11.068 7.449 1.00 23.93 O ATOM 392 ND2 ASN A 52 27.015 -12.678 8.041 1.00 24.98 N ATOM 0 H ASN A 52 27.767 -9.562 11.355 1.00 24.85 H new ATOM 0 HA ASN A 52 27.130 -12.022 10.623 1.00 25.55 H new ATOM 0 HB2 ASN A 52 26.407 -9.938 9.549 1.00 24.93 H new ATOM 0 HB3 ASN A 52 27.771 -9.977 8.793 1.00 24.93 H new ATOM 0 HD21 ASN A 52 26.706 -13.227 7.456 1.00 24.98 H new ATOM 0 HD22 ASN A 52 27.665 -12.915 8.551 1.00 24.98 H new ATOM 393 N LYS A 53 30.131 -11.045 10.202 1.00 27.97 N ATOM 394 CA LYS A 53 31.479 -11.476 9.864 1.00 29.76 C ATOM 395 C LYS A 53 31.990 -12.565 10.796 1.00 31.27 C ATOM 396 O LYS A 53 32.808 -13.386 10.393 1.00 33.97 O ATOM 397 CB LYS A 53 32.457 -10.297 9.885 0.50 28.39 C ATOM 398 CG LYS A 53 33.876 -10.698 9.500 0.50 28.85 C ATOM 399 CD LYS A 53 34.838 -9.522 9.488 0.50 30.24 C ATOM 400 CE LYS A 53 35.063 -8.962 10.882 0.50 30.22 C ATOM 401 NZ LYS A 53 35.674 -9.972 11.791 0.50 30.62 N ATOM 0 H LYS A 53 30.077 -10.251 10.529 1.00 27.97 H new ATOM 0 HA LYS A 53 31.429 -11.842 8.967 1.00 29.76 H new ATOM 0 HB2 LYS A 53 32.143 -9.611 9.275 0.50 28.39 H new ATOM 0 HB3 LYS A 53 32.466 -9.906 10.772 0.50 28.39 H new ATOM 0 HG2 LYS A 53 34.199 -11.368 10.123 0.50 28.85 H new ATOM 0 HG3 LYS A 53 33.864 -11.110 8.622 0.50 28.85 H new ATOM 0 HD2 LYS A 53 35.687 -9.802 9.111 0.50 30.24 H new ATOM 0 HD3 LYS A 53 34.489 -8.824 8.912 0.50 30.24 H new ATOM 0 HE2 LYS A 53 35.639 -8.184 10.829 0.50 30.22 H new ATOM 0 HE3 LYS A 53 34.217 -8.664 11.251 0.50 30.22 H new ATOM 0 HZ1 LYS A 53 35.978 -9.567 12.523 0.50 30.62 H new ATOM 0 HZ2 LYS A 53 35.061 -10.576 12.019 0.50 30.62 H new ATOM 0 HZ3 LYS A 53 36.349 -10.377 11.375 0.50 30.62 H new ATOM 402 N ASN A 54 31.494 -12.588 12.030 1.00 31.96 N ATOM 403 CA ASN A 54 31.944 -13.580 13.004 1.00 32.57 C ATOM 404 C ASN A 54 30.936 -14.615 13.484 1.00 31.01 C ATOM 405 O ASN A 54 31.240 -15.357 14.413 1.00 29.71 O ATOM 406 CB ASN A 54 32.516 -12.881 14.236 1.00 35.91 C ATOM 407 CG ASN A 54 33.591 -11.884 13.887 1.00 38.73 C ATOM 408 OD1 ASN A 54 34.393 -12.119 12.984 1.00 40.26 O ATOM 409 ND2 ASN A 54 33.624 -10.768 14.609 1.00 40.45 N ATOM 0 H ASN A 54 30.899 -12.041 12.323 1.00 31.96 H new ATOM 0 HA ASN A 54 32.602 -14.085 12.501 1.00 32.57 H new ATOM 0 HB2 ASN A 54 31.800 -12.428 14.709 1.00 35.91 H new ATOM 0 HB3 ASN A 54 32.880 -13.546 14.842 1.00 35.91 H new ATOM 0 HD21 ASN A 54 34.225 -10.173 14.453 1.00 40.45 H new ATOM 0 HD22 ASN A 54 33.045 -10.642 15.232 1.00 40.45 H new ATOM 410 N LYS A 55 29.752 -14.686 12.880 1.00 29.67 N ATOM 411 CA LYS A 55 28.771 -15.669 13.333 1.00 29.09 C ATOM 412 C LYS A 55 29.431 -17.043 13.337 1.00 31.09 C ATOM 413 O LYS A 55 29.151 -17.878 14.197 1.00 29.91 O ATOM 414 CB LYS A 55 27.529 -15.669 12.436 1.00 27.17 C ATOM 415 CG LYS A 55 26.481 -16.709 12.837 1.00 26.04 C ATOM 416 CD LYS A 55 25.994 -16.527 14.277 1.00 26.10 C ATOM 417 CE LYS A 55 25.026 -17.647 14.674 1.00 25.19 C ATOM 418 NZ LYS A 55 24.462 -17.493 16.050 1.00 23.53 N ATOM 0 H LYS A 55 29.501 -14.189 12.224 1.00 29.67 H new ATOM 0 HA LYS A 55 28.476 -15.440 14.228 1.00 29.09 H new ATOM 0 HB2 LYS A 55 27.124 -14.788 12.458 1.00 27.17 H new ATOM 0 HB3 LYS A 55 27.802 -15.833 11.520 1.00 27.17 H new ATOM 0 HG2 LYS A 55 25.724 -16.650 12.233 1.00 26.04 H new ATOM 0 HG3 LYS A 55 26.856 -17.598 12.736 1.00 26.04 H new ATOM 0 HD2 LYS A 55 26.753 -16.522 14.881 1.00 26.10 H new ATOM 0 HD3 LYS A 55 25.554 -15.667 14.367 1.00 26.10 H new ATOM 0 HE2 LYS A 55 24.297 -17.675 14.035 1.00 25.19 H new ATOM 0 HE3 LYS A 55 25.487 -18.498 14.615 1.00 25.19 H new ATOM 0 HZ1 LYS A 55 24.066 -18.251 16.295 1.00 23.53 H new ATOM 0 HZ2 LYS A 55 25.118 -17.304 16.621 1.00 23.53 H new ATOM 0 HZ3 LYS A 55 23.866 -16.832 16.055 1.00 23.53 H new ATOM 419 N GLY A 56 30.309 -17.263 12.363 1.00 32.72 N ATOM 420 CA GLY A 56 31.051 -18.506 12.284 1.00 35.07 C ATOM 421 C GLY A 56 30.409 -19.764 11.731 1.00 35.97 C ATOM 422 O GLY A 56 31.124 -20.708 11.407 1.00 37.28 O ATOM 0 H GLY A 56 30.487 -16.700 11.738 1.00 32.72 H new ATOM 0 HA2 GLY A 56 31.842 -18.332 11.750 1.00 35.07 H new ATOM 0 HA3 GLY A 56 31.355 -18.713 13.181 1.00 35.07 H new ATOM 423 N ILE A 57 29.086 -19.803 11.617 1.00 36.54 N ATOM 424 CA ILE A 57 28.429 -21.000 11.102 1.00 35.56 C ATOM 425 C ILE A 57 28.541 -21.128 9.584 1.00 36.43 C ATOM 426 O ILE A 57 28.931 -20.182 8.898 1.00 36.10 O ATOM 427 CB ILE A 57 26.930 -21.045 11.512 1.00 35.24 C ATOM 428 CG1 ILE A 57 26.156 -19.878 10.890 1.00 36.34 C ATOM 429 CG2 ILE A 57 26.810 -20.997 13.025 1.00 37.37 C ATOM 430 CD1 ILE A 57 25.753 -20.083 9.429 1.00 32.60 C ATOM 0 H ILE A 57 28.557 -19.159 11.828 1.00 36.54 H new ATOM 0 HA ILE A 57 28.896 -21.750 11.502 1.00 35.56 H new ATOM 0 HB ILE A 57 26.547 -21.873 11.183 1.00 35.24 H new ATOM 0 HG12 ILE A 57 25.355 -19.721 11.414 1.00 36.34 H new ATOM 0 HG13 ILE A 57 26.698 -19.076 10.954 1.00 36.34 H new ATOM 0 HG21 ILE A 57 25.874 -21.025 13.277 1.00 37.37 H new ATOM 0 HG22 ILE A 57 27.271 -21.758 13.411 1.00 37.37 H new ATOM 0 HG23 ILE A 57 27.209 -20.177 13.356 1.00 37.37 H new ATOM 0 HD11 ILE A 57 25.270 -19.303 9.114 1.00 32.60 H new ATOM 0 HD12 ILE A 57 26.548 -20.211 8.889 1.00 32.60 H new ATOM 0 HD13 ILE A 57 25.185 -20.866 9.357 1.00 32.60 H new ATOM 431 N THR A 58 28.196 -22.311 9.076 1.00 36.74 N ATOM 432 CA THR A 58 28.226 -22.607 7.645 1.00 36.22 C ATOM 433 C THR A 58 26.804 -22.564 7.084 1.00 34.62 C ATOM 434 O THR A 58 25.897 -23.185 7.630 1.00 34.10 O ATOM 435 CB THR A 58 28.803 -24.015 7.385 1.00 38.06 C ATOM 436 OG1 THR A 58 30.120 -24.104 7.941 1.00 39.76 O ATOM 437 CG2 THR A 58 28.860 -24.299 5.887 1.00 36.99 C ATOM 0 H THR A 58 27.935 -22.972 9.560 1.00 36.74 H new ATOM 0 HA THR A 58 28.787 -21.944 7.213 1.00 36.22 H new ATOM 0 HB THR A 58 28.226 -24.672 7.806 1.00 38.06 H new ATOM 0 HG1 THR A 58 30.433 -24.871 7.800 1.00 39.76 H new ATOM 0 HG21 THR A 58 29.224 -25.186 5.739 1.00 36.99 H new ATOM 0 HG22 THR A 58 27.966 -24.251 5.514 1.00 36.99 H new ATOM 0 HG23 THR A 58 29.426 -23.641 5.454 1.00 36.99 H new ATOM 438 N TRP A 59 26.612 -21.831 5.993 1.00 34.40 N ATOM 439 CA TRP A 59 25.296 -21.716 5.378 1.00 33.53 C ATOM 440 C TRP A 59 24.870 -23.008 4.694 1.00 33.81 C ATOM 441 O TRP A 59 25.565 -23.521 3.819 1.00 32.87 O ATOM 442 CB TRP A 59 25.279 -20.571 4.358 1.00 32.00 C ATOM 443 CG TRP A 59 25.299 -19.220 4.988 1.00 29.35 C ATOM 444 CD1 TRP A 59 26.155 -18.199 4.708 1.00 29.58 C ATOM 445 CD2 TRP A 59 24.425 -18.743 6.020 1.00 28.06 C ATOM 446 NE1 TRP A 59 25.871 -17.110 5.503 1.00 32.18 N ATOM 447 CE2 TRP A 59 24.813 -17.418 6.317 1.00 28.48 C ATOM 448 CE3 TRP A 59 23.351 -19.308 6.722 1.00 25.17 C ATOM 449 CZ2 TRP A 59 24.164 -16.645 7.289 1.00 27.82 C ATOM 450 CZ3 TRP A 59 22.704 -18.540 7.689 1.00 28.60 C ATOM 451 CH2 TRP A 59 23.115 -17.220 7.963 1.00 25.40 C ATOM 0 H TRP A 59 27.233 -21.391 5.592 1.00 34.40 H new ATOM 0 HA TRP A 59 24.665 -21.530 6.091 1.00 33.53 H new ATOM 0 HB2 TRP A 59 26.046 -20.658 3.770 1.00 32.00 H new ATOM 0 HB3 TRP A 59 24.487 -20.651 3.804 1.00 32.00 H new ATOM 0 HD1 TRP A 59 26.833 -18.232 4.072 1.00 29.58 H new ATOM 0 HE1 TRP A 59 26.290 -16.359 5.490 1.00 32.18 H new ATOM 0 HE3 TRP A 59 23.075 -20.179 6.546 1.00 25.17 H new ATOM 0 HZ2 TRP A 59 24.434 -15.774 7.471 1.00 27.82 H new ATOM 0 HZ3 TRP A 59 21.990 -18.904 8.161 1.00 28.60 H new ATOM 0 HH2 TRP A 59 22.667 -16.729 8.613 1.00 25.40 H new ATOM 452 N LYS A 60 23.719 -23.520 5.114 1.00 33.41 N ATOM 453 CA LYS A 60 23.146 -24.740 4.566 1.00 36.20 C ATOM 454 C LYS A 60 21.670 -24.712 4.904 1.00 35.32 C ATOM 455 O LYS A 60 21.216 -23.808 5.597 1.00 35.64 O ATOM 456 CB LYS A 60 23.817 -25.986 5.164 1.00 37.74 C ATOM 457 CG LYS A 60 23.953 -25.992 6.683 1.00 41.48 C ATOM 458 CD LYS A 60 24.700 -27.247 7.153 1.00 45.48 C ATOM 459 CE LYS A 60 25.246 -27.106 8.571 1.00 46.90 C ATOM 460 NZ LYS A 60 24.176 -26.907 9.591 1.00 50.33 N ATOM 0 H LYS A 60 23.243 -23.162 5.734 1.00 33.41 H new ATOM 0 HA LYS A 60 23.286 -24.785 3.607 1.00 36.20 H new ATOM 0 HB2 LYS A 60 23.308 -26.768 4.897 1.00 37.74 H new ATOM 0 HB3 LYS A 60 24.701 -26.076 4.775 1.00 37.74 H new ATOM 0 HG2 LYS A 60 24.429 -25.198 6.973 1.00 41.48 H new ATOM 0 HG3 LYS A 60 23.074 -25.961 7.092 1.00 41.48 H new ATOM 0 HD2 LYS A 60 24.101 -28.009 7.114 1.00 45.48 H new ATOM 0 HD3 LYS A 60 25.433 -27.431 6.544 1.00 45.48 H new ATOM 0 HE2 LYS A 60 25.757 -27.899 8.796 1.00 46.90 H new ATOM 0 HE3 LYS A 60 25.860 -26.355 8.603 1.00 46.90 H new ATOM 0 HZ1 LYS A 60 24.536 -26.589 10.341 1.00 50.33 H new ATOM 0 HZ2 LYS A 60 23.575 -26.328 9.282 1.00 50.33 H new ATOM 0 HZ3 LYS A 60 23.778 -27.685 9.760 1.00 50.33 H new ATOM 461 N GLU A 61 20.917 -25.697 4.427 1.00 36.11 N ATOM 462 CA GLU A 61 19.484 -25.721 4.688 1.00 37.46 C ATOM 463 C GLU A 61 19.085 -25.468 6.139 1.00 37.92 C ATOM 464 O GLU A 61 18.222 -24.628 6.400 1.00 39.22 O ATOM 465 CB GLU A 61 18.866 -27.037 4.212 1.00 37.53 C ATOM 466 CG GLU A 61 18.847 -27.187 2.700 1.00 40.31 C ATOM 467 CD GLU A 61 20.122 -27.798 2.157 1.00 42.01 C ATOM 468 OE1 GLU A 61 21.206 -27.540 2.728 1.00 43.17 O ATOM 469 OE2 GLU A 61 20.037 -28.531 1.148 1.00 42.64 O ATOM 0 H GLU A 61 21.212 -26.353 3.956 1.00 36.11 H new ATOM 0 HA GLU A 61 19.133 -24.973 4.180 1.00 37.46 H new ATOM 0 HB2 GLU A 61 19.362 -27.777 4.597 1.00 37.53 H new ATOM 0 HB3 GLU A 61 17.958 -27.099 4.547 1.00 37.53 H new ATOM 0 HG2 GLU A 61 18.093 -27.740 2.443 1.00 40.31 H new ATOM 0 HG3 GLU A 61 18.712 -26.316 2.294 1.00 40.31 H new ATOM 470 N GLU A 62 19.700 -26.178 7.083 1.00 36.14 N ATOM 471 CA GLU A 62 19.334 -25.989 8.485 1.00 36.99 C ATOM 472 C GLU A 62 19.635 -24.585 9.008 1.00 33.73 C ATOM 473 O GLU A 62 18.779 -23.956 9.619 1.00 32.86 O ATOM 474 CB GLU A 62 20.004 -27.042 9.387 1.00 39.99 C ATOM 475 CG GLU A 62 21.209 -27.766 8.806 1.00 45.08 C ATOM 476 CD GLU A 62 20.844 -28.718 7.670 1.00 48.94 C ATOM 477 OE1 GLU A 62 19.833 -29.447 7.804 1.00 50.95 O ATOM 478 OE2 GLU A 62 21.575 -28.743 6.652 1.00 46.78 O ATOM 0 H GLU A 62 20.316 -26.760 6.939 1.00 36.14 H new ATOM 0 HA GLU A 62 18.371 -26.104 8.519 1.00 36.99 H new ATOM 0 HB2 GLU A 62 20.279 -26.607 10.209 1.00 39.99 H new ATOM 0 HB3 GLU A 62 19.338 -27.705 9.626 1.00 39.99 H new ATOM 0 HG2 GLU A 62 21.847 -27.112 8.480 1.00 45.08 H new ATOM 0 HG3 GLU A 62 21.650 -28.266 9.511 1.00 45.08 H new ATOM 479 N THR A 63 20.841 -24.090 8.760 1.00 31.27 N ATOM 480 CA THR A 63 21.208 -22.760 9.223 1.00 30.73 C ATOM 481 C THR A 63 20.391 -21.680 8.515 1.00 30.65 C ATOM 482 O THR A 63 19.927 -20.730 9.144 1.00 30.14 O ATOM 483 CB THR A 63 22.708 -22.500 9.002 1.00 32.27 C ATOM 484 OG1 THR A 63 23.055 -22.835 7.654 1.00 28.30 O ATOM 485 CG2 THR A 63 23.538 -23.343 9.960 1.00 30.07 C ATOM 0 H THR A 63 21.458 -24.505 8.328 1.00 31.27 H new ATOM 0 HA THR A 63 21.015 -22.721 10.173 1.00 30.73 H new ATOM 0 HB THR A 63 22.892 -21.562 9.167 1.00 32.27 H new ATOM 0 HG1 THR A 63 23.880 -22.987 7.606 1.00 28.30 H new ATOM 0 HG21 THR A 63 24.481 -23.170 9.810 1.00 30.07 H new ATOM 0 HG22 THR A 63 23.309 -23.114 10.874 1.00 30.07 H new ATOM 0 HG23 THR A 63 23.354 -24.283 9.807 1.00 30.07 H new ATOM 486 N LEU A 64 20.214 -21.818 7.206 1.00 29.98 N ATOM 487 CA LEU A 64 19.427 -20.842 6.461 1.00 29.51 C ATOM 488 C LEU A 64 17.977 -20.843 6.941 1.00 29.12 C ATOM 489 O LEU A 64 17.364 -19.784 7.075 1.00 27.70 O ATOM 490 CB LEU A 64 19.492 -21.131 4.955 1.00 26.36 C ATOM 491 CG LEU A 64 20.808 -20.703 4.290 1.00 27.31 C ATOM 492 CD1 LEU A 64 20.958 -21.351 2.933 1.00 27.12 C ATOM 493 CD2 LEU A 64 20.843 -19.184 4.164 1.00 26.64 C ATOM 0 H LEU A 64 20.536 -22.461 6.735 1.00 29.98 H new ATOM 0 HA LEU A 64 19.803 -19.962 6.621 1.00 29.51 H new ATOM 0 HB2 LEU A 64 19.363 -22.082 4.812 1.00 26.36 H new ATOM 0 HB3 LEU A 64 18.756 -20.676 4.516 1.00 26.36 H new ATOM 0 HG LEU A 64 21.550 -20.995 4.843 1.00 27.31 H new ATOM 0 HD11 LEU A 64 21.794 -21.069 2.530 1.00 27.12 H new ATOM 0 HD12 LEU A 64 20.957 -22.316 3.033 1.00 27.12 H new ATOM 0 HD13 LEU A 64 20.219 -21.085 2.364 1.00 27.12 H new ATOM 0 HD21 LEU A 64 21.674 -18.913 3.744 1.00 26.64 H new ATOM 0 HD22 LEU A 64 20.095 -18.887 3.622 1.00 26.64 H new ATOM 0 HD23 LEU A 64 20.782 -18.784 5.046 1.00 26.64 H new ATOM 494 N MET A 65 17.430 -22.026 7.211 1.00 29.06 N ATOM 495 CA MET A 65 16.052 -22.110 7.683 1.00 30.01 C ATOM 496 C MET A 65 15.877 -21.308 8.973 1.00 28.93 C ATOM 497 O MET A 65 14.877 -20.610 9.150 1.00 28.72 O ATOM 498 CB MET A 65 15.643 -23.572 7.917 1.00 31.43 C ATOM 499 CG MET A 65 15.309 -24.369 6.642 1.00 33.32 C ATOM 500 SD MET A 65 13.792 -23.822 5.783 1.00 33.62 S ATOM 501 CE MET A 65 12.542 -24.391 6.891 1.00 31.93 C ATOM 0 H MET A 65 17.833 -22.781 7.129 1.00 29.06 H new ATOM 0 HA MET A 65 15.478 -21.733 6.998 1.00 30.01 H new ATOM 0 HB2 MET A 65 16.363 -24.024 8.385 1.00 31.43 H new ATOM 0 HB3 MET A 65 14.870 -23.587 8.503 1.00 31.43 H new ATOM 0 HG2 MET A 65 16.057 -24.303 6.028 1.00 33.32 H new ATOM 0 HG3 MET A 65 15.215 -25.306 6.875 1.00 33.32 H new ATOM 0 HE1 MET A 65 11.669 -24.143 6.549 1.00 31.93 H new ATOM 0 HE2 MET A 65 12.595 -25.356 6.971 1.00 31.93 H new ATOM 0 HE3 MET A 65 12.674 -23.987 7.763 1.00 31.93 H new ATOM 502 N GLU A 66 16.850 -21.396 9.873 1.00 28.95 N ATOM 503 CA GLU A 66 16.751 -20.661 11.131 1.00 29.58 C ATOM 504 C GLU A 66 17.018 -19.168 10.960 1.00 26.66 C ATOM 505 O GLU A 66 16.337 -18.350 11.555 1.00 26.18 O ATOM 506 CB GLU A 66 17.712 -21.231 12.183 1.00 29.38 C ATOM 507 CG GLU A 66 17.654 -20.467 13.496 1.00 28.92 C ATOM 508 CD GLU A 66 18.385 -21.158 14.636 1.00 33.10 C ATOM 509 OE1 GLU A 66 18.559 -20.518 15.700 1.00 32.13 O ATOM 510 OE2 GLU A 66 18.780 -22.334 14.474 1.00 31.85 O ATOM 0 H GLU A 66 17.564 -21.866 9.779 1.00 28.95 H new ATOM 0 HA GLU A 66 15.836 -20.770 11.434 1.00 29.58 H new ATOM 0 HB2 GLU A 66 17.495 -22.163 12.344 1.00 29.38 H new ATOM 0 HB3 GLU A 66 18.618 -21.206 11.837 1.00 29.38 H new ATOM 0 HG2 GLU A 66 18.035 -19.585 13.365 1.00 28.92 H new ATOM 0 HG3 GLU A 66 16.726 -20.340 13.747 1.00 28.92 H new ATOM 511 N TYR A 67 18.013 -18.820 10.151 1.00 26.25 N ATOM 512 CA TYR A 67 18.352 -17.411 9.920 1.00 25.28 C ATOM 513 C TYR A 67 17.225 -16.641 9.243 1.00 25.81 C ATOM 514 O TYR A 67 16.801 -15.593 9.729 1.00 24.22 O ATOM 515 CB TYR A 67 19.607 -17.300 9.048 1.00 23.54 C ATOM 516 CG TYR A 67 19.899 -15.902 8.530 1.00 26.25 C ATOM 517 CD1 TYR A 67 20.440 -14.913 9.368 1.00 23.48 C ATOM 518 CD2 TYR A 67 19.658 -15.572 7.190 1.00 24.01 C ATOM 519 CE1 TYR A 67 20.740 -13.635 8.879 1.00 22.05 C ATOM 520 CE2 TYR A 67 19.953 -14.299 6.693 1.00 24.14 C ATOM 521 CZ TYR A 67 20.493 -13.340 7.537 1.00 24.18 C ATOM 522 OH TYR A 67 20.785 -12.095 7.033 1.00 22.79 O ATOM 0 H TYR A 67 18.506 -19.381 9.725 1.00 26.25 H new ATOM 0 HA TYR A 67 18.507 -17.021 10.794 1.00 25.28 H new ATOM 0 HB2 TYR A 67 20.371 -17.608 9.561 1.00 23.54 H new ATOM 0 HB3 TYR A 67 19.514 -17.899 8.291 1.00 23.54 H new ATOM 0 HD1 TYR A 67 20.602 -15.110 10.262 1.00 23.48 H new ATOM 0 HD2 TYR A 67 19.295 -16.212 6.621 1.00 24.01 H new ATOM 0 HE1 TYR A 67 21.100 -12.989 9.443 1.00 22.05 H new ATOM 0 HE2 TYR A 67 19.788 -14.096 5.801 1.00 24.14 H new ATOM 0 HH TYR A 67 21.209 -12.177 6.312 1.00 22.79 H new ATOM 523 N LEU A 68 16.743 -17.166 8.118 1.00 25.21 N ATOM 524 CA LEU A 68 15.693 -16.492 7.365 1.00 26.32 C ATOM 525 C LEU A 68 14.393 -16.359 8.130 1.00 26.86 C ATOM 526 O LEU A 68 13.516 -15.607 7.723 1.00 28.02 O ATOM 527 CB LEU A 68 15.455 -17.202 6.029 1.00 25.20 C ATOM 528 CG LEU A 68 16.667 -17.083 5.105 1.00 27.43 C ATOM 529 CD1 LEU A 68 16.544 -18.072 3.950 1.00 30.41 C ATOM 530 CD2 LEU A 68 16.784 -15.644 4.604 1.00 25.89 C ATOM 0 H LEU A 68 17.010 -17.909 7.776 1.00 25.21 H new ATOM 0 HA LEU A 68 16.009 -15.589 7.204 1.00 26.32 H new ATOM 0 HB2 LEU A 68 15.260 -18.139 6.190 1.00 25.20 H new ATOM 0 HB3 LEU A 68 14.676 -16.821 5.593 1.00 25.20 H new ATOM 0 HG LEU A 68 17.476 -17.302 5.593 1.00 27.43 H new ATOM 0 HD11 LEU A 68 17.317 -17.989 3.369 1.00 30.41 H new ATOM 0 HD12 LEU A 68 16.499 -18.975 4.301 1.00 30.41 H new ATOM 0 HD13 LEU A 68 15.738 -17.881 3.445 1.00 30.41 H new ATOM 0 HD21 LEU A 68 17.553 -15.567 4.017 1.00 25.89 H new ATOM 0 HD22 LEU A 68 15.980 -15.405 4.116 1.00 25.89 H new ATOM 0 HD23 LEU A 68 16.893 -15.046 5.360 1.00 25.89 H new ATOM 531 N GLU A 69 14.261 -17.082 9.240 1.00 28.78 N ATOM 532 CA GLU A 69 13.043 -16.978 10.037 1.00 29.84 C ATOM 533 C GLU A 69 13.103 -15.695 10.860 1.00 30.05 C ATOM 534 O GLU A 69 12.090 -15.023 11.056 1.00 29.21 O ATOM 535 CB GLU A 69 12.899 -18.167 10.987 1.00 31.89 C ATOM 536 CG GLU A 69 11.591 -18.143 11.775 1.00 37.23 C ATOM 537 CD GLU A 69 11.477 -19.283 12.770 1.00 39.06 C ATOM 538 OE1 GLU A 69 10.388 -19.451 13.353 1.00 39.89 O ATOM 539 OE2 GLU A 69 12.476 -20.005 12.972 1.00 40.81 O ATOM 0 H GLU A 69 14.852 -17.628 9.544 1.00 28.78 H new ATOM 0 HA GLU A 69 12.281 -16.970 9.436 1.00 29.84 H new ATOM 0 HB2 GLU A 69 12.949 -18.991 10.477 1.00 31.89 H new ATOM 0 HB3 GLU A 69 13.645 -18.172 11.607 1.00 31.89 H new ATOM 0 HG2 GLU A 69 11.520 -17.299 12.248 1.00 37.23 H new ATOM 0 HG3 GLU A 69 10.845 -18.185 11.156 1.00 37.23 H new ATOM 540 N ASN A 70 14.302 -15.366 11.336 1.00 29.73 N ATOM 541 CA ASN A 70 14.524 -14.170 12.150 1.00 28.08 C ATOM 542 C ASN A 70 16.022 -13.895 12.127 1.00 28.30 C ATOM 543 O ASN A 70 16.773 -14.388 12.976 1.00 28.39 O ATOM 544 CB ASN A 70 14.064 -14.414 13.589 1.00 28.05 C ATOM 545 CG ASN A 70 13.978 -13.135 14.404 1.00 30.95 C ATOM 546 OD1 ASN A 70 14.760 -12.203 14.211 1.00 27.99 O ATOM 547 ND2 ASN A 70 13.029 -13.094 15.337 1.00 29.91 N ATOM 0 H ASN A 70 15.012 -15.831 11.196 1.00 29.73 H new ATOM 0 HA ASN A 70 14.022 -13.417 11.801 1.00 28.08 H new ATOM 0 HB2 ASN A 70 13.195 -14.845 13.578 1.00 28.05 H new ATOM 0 HB3 ASN A 70 14.679 -15.027 14.021 1.00 28.05 H new ATOM 0 HD21 ASN A 70 12.944 -12.397 15.834 1.00 29.91 H new ATOM 0 HD22 ASN A 70 12.501 -13.764 15.443 1.00 29.91 H new ATOM 548 N PRO A 71 16.478 -13.102 11.144 1.00 26.91 N ATOM 549 CA PRO A 71 17.883 -12.738 10.964 1.00 25.40 C ATOM 550 C PRO A 71 18.520 -12.081 12.183 1.00 25.07 C ATOM 551 O PRO A 71 19.609 -12.477 12.602 1.00 24.53 O ATOM 552 CB PRO A 71 17.843 -11.800 9.756 1.00 25.04 C ATOM 553 CG PRO A 71 16.647 -12.272 8.999 1.00 26.98 C ATOM 554 CD PRO A 71 15.647 -12.491 10.094 1.00 27.68 C ATOM 0 HA PRO A 71 18.442 -13.520 10.833 1.00 25.40 H new ATOM 0 HB2 PRO A 71 17.754 -10.872 10.025 1.00 25.04 H new ATOM 0 HB3 PRO A 71 18.652 -11.865 9.225 1.00 25.04 H new ATOM 0 HG2 PRO A 71 16.342 -11.613 8.356 1.00 26.98 H new ATOM 0 HG3 PRO A 71 16.829 -13.087 8.506 1.00 26.98 H new ATOM 0 HD2 PRO A 71 15.242 -11.660 10.388 1.00 27.68 H new ATOM 0 HD3 PRO A 71 14.925 -13.076 9.815 1.00 27.68 H new ATOM 555 N LYS A 72 17.845 -11.081 12.745 1.00 23.05 N ATOM 556 CA LYS A 72 18.365 -10.367 13.909 1.00 24.42 C ATOM 557 C LYS A 72 18.530 -11.290 15.118 1.00 25.39 C ATOM 558 O LYS A 72 19.444 -11.106 15.927 1.00 27.83 O ATOM 559 CB LYS A 72 17.447 -9.199 14.286 0.50 21.30 C ATOM 560 CG LYS A 72 17.278 -8.134 13.207 0.50 23.51 C ATOM 561 CD LYS A 72 18.584 -7.451 12.870 0.50 23.03 C ATOM 562 CE LYS A 72 18.366 -6.253 11.955 0.50 23.43 C ATOM 563 NZ LYS A 72 17.622 -5.156 12.630 0.50 24.75 N ATOM 0 H LYS A 72 17.082 -10.800 12.466 1.00 23.05 H new ATOM 0 HA LYS A 72 19.239 -10.027 13.662 1.00 24.42 H new ATOM 0 HB2 LYS A 72 16.572 -9.553 14.511 0.50 21.30 H new ATOM 0 HB3 LYS A 72 17.797 -8.776 15.086 0.50 21.30 H new ATOM 0 HG2 LYS A 72 16.912 -8.542 12.407 0.50 23.51 H new ATOM 0 HG3 LYS A 72 16.636 -7.471 13.506 0.50 23.51 H new ATOM 0 HD2 LYS A 72 19.019 -7.161 13.687 0.50 23.03 H new ATOM 0 HD3 LYS A 72 19.180 -8.084 12.440 0.50 23.03 H new ATOM 0 HE2 LYS A 72 19.225 -5.920 11.652 0.50 23.43 H new ATOM 0 HE3 LYS A 72 17.877 -6.536 11.166 0.50 23.43 H new ATOM 0 HZ1 LYS A 72 17.690 -4.411 12.148 0.50 24.75 H new ATOM 0 HZ2 LYS A 72 16.765 -5.382 12.707 0.50 24.75 H new ATOM 0 HZ3 LYS A 72 17.966 -5.018 13.439 0.50 24.75 H new ATOM 564 N LYS A 73 17.644 -12.272 15.247 1.00 24.49 N ATOM 565 CA LYS A 73 17.722 -13.215 16.358 1.00 23.52 C ATOM 566 C LYS A 73 18.882 -14.186 16.135 1.00 25.49 C ATOM 567 O LYS A 73 19.626 -14.498 17.065 1.00 25.91 O ATOM 568 CB LYS A 73 16.420 -14.014 16.491 0.50 21.33 C ATOM 569 CG LYS A 73 16.445 -15.018 17.638 0.50 19.54 C ATOM 570 CD LYS A 73 15.181 -15.859 17.695 0.50 22.20 C ATOM 571 CE LYS A 73 15.221 -16.826 18.876 0.50 21.61 C ATOM 572 NZ LYS A 73 16.415 -17.719 18.822 0.50 21.63 N ATOM 0 H LYS A 73 16.992 -12.410 14.704 1.00 24.49 H new ATOM 0 HA LYS A 73 17.865 -12.709 17.173 1.00 23.52 H new ATOM 0 HB2 LYS A 73 15.682 -13.399 16.624 0.50 21.33 H new ATOM 0 HB3 LYS A 73 16.250 -14.485 15.660 0.50 21.33 H new ATOM 0 HG2 LYS A 73 17.214 -15.600 17.539 0.50 19.54 H new ATOM 0 HG3 LYS A 73 16.554 -14.544 18.477 0.50 19.54 H new ATOM 0 HD2 LYS A 73 14.406 -15.280 17.772 0.50 22.20 H new ATOM 0 HD3 LYS A 73 15.082 -16.357 16.868 0.50 22.20 H new ATOM 0 HE2 LYS A 73 15.231 -16.323 19.705 0.50 21.61 H new ATOM 0 HE3 LYS A 73 14.414 -17.365 18.880 0.50 21.61 H new ATOM 0 HZ1 LYS A 73 16.196 -18.526 19.126 0.50 21.63 H new ATOM 0 HZ2 LYS A 73 16.698 -17.786 17.981 0.50 21.63 H new ATOM 0 HZ3 LYS A 73 17.064 -17.378 19.327 0.50 21.63 H new ATOM 573 N TYR A 74 19.035 -14.661 14.901 1.00 22.99 N ATOM 574 CA TYR A 74 20.106 -15.601 14.595 1.00 24.47 C ATOM 575 C TYR A 74 21.467 -14.928 14.678 1.00 24.09 C ATOM 576 O TYR A 74 22.420 -15.508 15.188 1.00 24.02 O ATOM 577 CB TYR A 74 19.914 -16.204 13.195 1.00 24.35 C ATOM 578 CG TYR A 74 20.787 -17.407 12.928 1.00 26.25 C ATOM 579 CD1 TYR A 74 20.696 -18.547 13.732 1.00 27.15 C ATOM 580 CD2 TYR A 74 21.694 -17.419 11.871 1.00 27.05 C ATOM 581 CE1 TYR A 74 21.481 -19.660 13.491 1.00 26.08 C ATOM 582 CE2 TYR A 74 22.488 -18.535 11.618 1.00 28.14 C ATOM 583 CZ TYR A 74 22.373 -19.654 12.433 1.00 29.48 C ATOM 584 OH TYR A 74 23.134 -20.773 12.180 1.00 28.60 O ATOM 0 H TYR A 74 18.534 -14.453 14.234 1.00 22.99 H new ATOM 0 HA TYR A 74 20.070 -16.311 15.255 1.00 24.47 H new ATOM 0 HB2 TYR A 74 18.984 -16.458 13.086 1.00 24.35 H new ATOM 0 HB3 TYR A 74 20.102 -15.524 12.530 1.00 24.35 H new ATOM 0 HD1 TYR A 74 20.096 -18.557 14.443 1.00 27.15 H new ATOM 0 HD2 TYR A 74 21.771 -16.670 11.325 1.00 27.05 H new ATOM 0 HE1 TYR A 74 21.410 -20.409 14.038 1.00 26.08 H new ATOM 0 HE2 TYR A 74 23.090 -18.531 10.909 1.00 28.14 H new ATOM 0 HH TYR A 74 23.298 -20.820 11.358 1.00 28.60 H new ATOM 585 N ILE A 75 21.551 -13.703 14.170 1.00 23.50 N ATOM 586 CA ILE A 75 22.793 -12.963 14.196 1.00 22.60 C ATOM 587 C ILE A 75 22.593 -11.570 14.794 1.00 22.77 C ATOM 588 O ILE A 75 22.554 -10.563 14.076 1.00 21.32 O ATOM 589 CB ILE A 75 23.394 -12.837 12.781 1.00 24.88 C ATOM 590 CG1 ILE A 75 23.464 -14.220 12.117 1.00 25.66 C ATOM 591 CG2 ILE A 75 24.784 -12.237 12.875 1.00 23.33 C ATOM 592 CD1 ILE A 75 24.072 -14.227 10.712 1.00 25.25 C ATOM 0 H ILE A 75 20.893 -13.286 13.805 1.00 23.50 H new ATOM 0 HA ILE A 75 23.411 -13.458 14.756 1.00 22.60 H new ATOM 0 HB ILE A 75 22.831 -12.259 12.243 1.00 24.88 H new ATOM 0 HG12 ILE A 75 23.984 -14.811 12.684 1.00 25.66 H new ATOM 0 HG13 ILE A 75 22.568 -14.588 12.070 1.00 25.66 H new ATOM 0 HG21 ILE A 75 25.163 -12.157 11.986 1.00 23.33 H new ATOM 0 HG22 ILE A 75 24.731 -11.359 13.283 1.00 23.33 H new ATOM 0 HG23 ILE A 75 25.348 -12.811 13.416 1.00 23.33 H new ATOM 0 HD11 ILE A 75 24.079 -15.133 10.367 1.00 25.25 H new ATOM 0 HD12 ILE A 75 23.542 -13.663 10.127 1.00 25.25 H new ATOM 0 HD13 ILE A 75 24.980 -13.889 10.751 1.00 25.25 H new ATOM 593 N PRO A 76 22.479 -11.493 16.133 1.00 21.19 N ATOM 594 CA PRO A 76 22.282 -10.207 16.799 1.00 19.97 C ATOM 595 C PRO A 76 23.306 -9.193 16.332 1.00 20.30 C ATOM 596 O PRO A 76 24.511 -9.489 16.256 1.00 19.58 O ATOM 597 CB PRO A 76 22.448 -10.549 18.275 1.00 20.58 C ATOM 598 CG PRO A 76 21.967 -11.954 18.347 1.00 22.90 C ATOM 599 CD PRO A 76 22.569 -12.587 17.113 1.00 21.04 C ATOM 0 HA PRO A 76 21.422 -9.800 16.608 1.00 19.97 H new ATOM 0 HB2 PRO A 76 23.372 -10.470 18.561 1.00 20.58 H new ATOM 0 HB3 PRO A 76 21.925 -9.960 18.841 1.00 20.58 H new ATOM 0 HG2 PRO A 76 22.266 -12.394 19.158 1.00 22.90 H new ATOM 0 HG3 PRO A 76 20.998 -12.002 18.339 1.00 22.90 H new ATOM 0 HD2 PRO A 76 23.486 -12.869 17.260 1.00 21.04 H new ATOM 0 HD3 PRO A 76 22.074 -13.371 16.829 1.00 21.04 H new ATOM 600 N GLY A 77 22.827 -8.002 16.003 1.00 19.28 N ATOM 601 CA GLY A 77 23.729 -6.960 15.554 1.00 22.01 C ATOM 602 C GLY A 77 23.816 -6.821 14.047 1.00 23.49 C ATOM 603 O GLY A 77 24.391 -5.851 13.555 1.00 23.42 O ATOM 0 H GLY A 77 21.996 -7.781 16.032 1.00 19.28 H new ATOM 0 HA2 GLY A 77 23.442 -6.113 15.931 1.00 22.01 H new ATOM 0 HA3 GLY A 77 24.616 -7.141 15.904 1.00 22.01 H new ATOM 604 N THR A 78 23.261 -7.776 13.301 1.00 24.46 N ATOM 605 CA THR A 78 23.313 -7.674 11.841 1.00 25.54 C ATOM 606 C THR A 78 22.489 -6.463 11.407 1.00 24.67 C ATOM 607 O THR A 78 21.520 -6.100 12.071 1.00 25.12 O ATOM 608 CB THR A 78 22.780 -8.961 11.146 1.00 24.84 C ATOM 609 OG1 THR A 78 22.998 -8.862 9.736 1.00 26.45 O ATOM 610 CG2 THR A 78 21.304 -9.154 11.410 1.00 24.99 C ATOM 0 H THR A 78 22.860 -8.472 13.608 1.00 24.46 H new ATOM 0 HA THR A 78 24.239 -7.569 11.572 1.00 25.54 H new ATOM 0 HB THR A 78 23.258 -9.724 11.508 1.00 24.84 H new ATOM 0 HG1 THR A 78 23.822 -8.888 9.577 1.00 26.45 H new ATOM 0 HG21 THR A 78 20.999 -9.961 10.967 1.00 24.99 H new ATOM 0 HG22 THR A 78 21.154 -9.234 12.365 1.00 24.99 H new ATOM 0 HG23 THR A 78 20.811 -8.392 11.068 1.00 24.99 H new ATOM 611 N LYS A 79 22.889 -5.826 10.310 1.00 23.47 N ATOM 612 CA LYS A 79 22.189 -4.647 9.813 1.00 23.80 C ATOM 613 C LYS A 79 21.801 -4.829 8.350 1.00 25.03 C ATOM 614 O LYS A 79 22.645 -5.141 7.511 1.00 22.08 O ATOM 615 CB LYS A 79 23.072 -3.406 9.946 1.00 24.09 C ATOM 616 CG LYS A 79 23.545 -3.101 11.364 1.00 25.06 C ATOM 617 CD LYS A 79 22.403 -2.674 12.264 1.00 28.88 C ATOM 618 CE LYS A 79 22.914 -2.342 13.663 1.00 31.05 C ATOM 619 NZ LYS A 79 21.806 -1.966 14.579 1.00 33.50 N ATOM 0 H LYS A 79 23.567 -6.063 9.837 1.00 23.47 H new ATOM 0 HA LYS A 79 21.386 -4.531 10.345 1.00 23.80 H new ATOM 0 HB2 LYS A 79 23.850 -3.516 9.377 1.00 24.09 H new ATOM 0 HB3 LYS A 79 22.582 -2.639 9.611 1.00 24.09 H new ATOM 0 HG2 LYS A 79 23.973 -3.887 11.737 1.00 25.06 H new ATOM 0 HG3 LYS A 79 24.214 -2.399 11.337 1.00 25.06 H new ATOM 0 HD2 LYS A 79 21.958 -1.900 11.885 1.00 28.88 H new ATOM 0 HD3 LYS A 79 21.743 -3.383 12.315 1.00 28.88 H new ATOM 0 HE2 LYS A 79 23.387 -3.107 14.025 1.00 31.05 H new ATOM 0 HE3 LYS A 79 23.552 -1.613 13.610 1.00 31.05 H new ATOM 0 HZ1 LYS A 79 22.136 -1.779 15.384 1.00 33.50 H new ATOM 0 HZ2 LYS A 79 21.385 -1.251 14.258 1.00 33.50 H new ATOM 0 HZ3 LYS A 79 21.232 -2.643 14.644 1.00 33.50 H new ATOM 620 N MET A 80 20.517 -4.623 8.064 1.00 25.07 N ATOM 621 CA MET A 80 19.975 -4.759 6.716 1.00 27.48 C ATOM 622 C MET A 80 20.173 -3.502 5.865 1.00 26.52 C ATOM 623 O MET A 80 20.237 -3.584 4.642 1.00 25.75 O ATOM 624 CB MET A 80 18.480 -5.095 6.784 1.00 28.26 C ATOM 625 CG MET A 80 18.125 -6.512 6.337 1.00 33.16 C ATOM 626 SD MET A 80 18.733 -7.817 7.420 1.00 36.63 S ATOM 627 CE MET A 80 17.245 -8.299 8.237 1.00 38.09 C ATOM 0 H MET A 80 19.932 -4.398 8.653 1.00 25.07 H new ATOM 0 HA MET A 80 20.466 -5.479 6.289 1.00 27.48 H new ATOM 0 HB2 MET A 80 18.174 -4.970 7.696 1.00 28.26 H new ATOM 0 HB3 MET A 80 17.993 -4.463 6.232 1.00 28.26 H new ATOM 0 HG2 MET A 80 17.160 -6.585 6.272 1.00 33.16 H new ATOM 0 HG3 MET A 80 18.481 -6.656 5.446 1.00 33.16 H new ATOM 0 HE1 MET A 80 17.463 -8.750 9.067 1.00 38.09 H new ATOM 0 HE2 MET A 80 16.711 -7.512 8.428 1.00 38.09 H new ATOM 0 HE3 MET A 80 16.742 -8.900 7.665 1.00 38.09 H new ATOM 628 N ILE A 81 20.260 -2.337 6.498 1.00 26.94 N ATOM 629 CA ILE A 81 20.458 -1.117 5.728 1.00 26.42 C ATOM 630 C ILE A 81 21.689 -0.349 6.182 1.00 26.49 C ATOM 631 O ILE A 81 22.238 -0.622 7.251 1.00 22.71 O ATOM 632 CB ILE A 81 19.223 -0.207 5.781 1.00 27.27 C ATOM 633 CG1 ILE A 81 18.950 0.234 7.207 1.00 27.59 C ATOM 634 CG2 ILE A 81 18.003 -0.955 5.221 1.00 27.14 C ATOM 635 CD1 ILE A 81 17.810 1.229 7.306 1.00 31.27 C ATOM 0 H ILE A 81 20.209 -2.232 7.350 1.00 26.94 H new ATOM 0 HA ILE A 81 20.597 -1.394 4.809 1.00 26.42 H new ATOM 0 HB ILE A 81 19.392 0.581 5.241 1.00 27.27 H new ATOM 0 HG12 ILE A 81 18.743 -0.544 7.748 1.00 27.59 H new ATOM 0 HG13 ILE A 81 19.754 0.631 7.578 1.00 27.59 H new ATOM 0 HG21 ILE A 81 17.225 -0.377 5.256 1.00 27.14 H new ATOM 0 HG22 ILE A 81 18.174 -1.211 4.301 1.00 27.14 H new ATOM 0 HG23 ILE A 81 17.839 -1.750 5.752 1.00 27.14 H new ATOM 0 HD11 ILE A 81 17.677 1.478 8.234 1.00 31.27 H new ATOM 0 HD12 ILE A 81 18.025 2.020 6.787 1.00 31.27 H new ATOM 0 HD13 ILE A 81 16.998 0.827 6.960 1.00 31.27 H new ATOM 636 N PHE A 82 22.121 0.605 5.356 1.00 24.66 N ATOM 637 CA PHE A 82 23.311 1.392 5.647 1.00 25.76 C ATOM 638 C PHE A 82 23.463 1.691 7.130 1.00 26.54 C ATOM 639 O PHE A 82 22.559 2.235 7.760 1.00 25.43 O ATOM 640 CB PHE A 82 23.302 2.708 4.872 1.00 26.33 C ATOM 641 CG PHE A 82 24.540 3.527 5.079 1.00 26.99 C ATOM 642 CD1 PHE A 82 25.792 3.012 4.738 1.00 27.02 C ATOM 643 CD2 PHE A 82 24.467 4.792 5.658 1.00 27.05 C ATOM 644 CE1 PHE A 82 26.958 3.744 4.974 1.00 25.92 C ATOM 645 CE2 PHE A 82 25.620 5.532 5.898 1.00 26.47 C ATOM 646 CZ PHE A 82 26.869 5.009 5.558 1.00 27.57 C ATOM 0 H PHE A 82 21.733 0.810 4.617 1.00 24.66 H new ATOM 0 HA PHE A 82 24.066 0.851 5.367 1.00 25.76 H new ATOM 0 HB2 PHE A 82 23.202 2.518 3.926 1.00 26.33 H new ATOM 0 HB3 PHE A 82 22.529 3.229 5.140 1.00 26.33 H new ATOM 0 HD1 PHE A 82 25.851 2.170 4.348 1.00 27.02 H new ATOM 0 HD2 PHE A 82 23.638 5.146 5.887 1.00 27.05 H new ATOM 0 HE1 PHE A 82 27.787 3.391 4.744 1.00 25.92 H new ATOM 0 HE2 PHE A 82 25.559 6.375 6.285 1.00 26.47 H new ATOM 0 HZ PHE A 82 27.640 5.502 5.720 1.00 27.57 H new ATOM 647 N ALA A 83 24.622 1.334 7.668 1.00 24.98 N ATOM 648 CA ALA A 83 24.930 1.546 9.073 1.00 26.64 C ATOM 649 C ALA A 83 26.321 2.173 9.186 1.00 28.52 C ATOM 650 O ALA A 83 26.872 2.281 10.278 1.00 26.73 O ATOM 651 CB ALA A 83 24.889 0.214 9.817 1.00 26.86 C ATOM 0 H ALA A 83 25.256 0.959 7.224 1.00 24.98 H new ATOM 0 HA ALA A 83 24.274 2.141 9.469 1.00 26.64 H new ATOM 0 HB1 ALA A 83 25.095 0.360 10.754 1.00 26.86 H new ATOM 0 HB2 ALA A 83 24.004 -0.174 9.738 1.00 26.86 H new ATOM 0 HB3 ALA A 83 25.542 -0.391 9.433 1.00 26.86 H new ATOM 652 N GLY A 84 26.881 2.580 8.047 1.00 28.55 N ATOM 653 CA GLY A 84 28.194 3.198 8.047 1.00 28.81 C ATOM 654 C GLY A 84 29.194 2.504 7.145 1.00 28.87 C ATOM 655 O GLY A 84 28.895 1.461 6.564 1.00 30.37 O ATOM 0 H GLY A 84 26.516 2.506 7.272 1.00 28.55 H new ATOM 0 HA2 GLY A 84 28.107 4.123 7.769 1.00 28.81 H new ATOM 0 HA3 GLY A 84 28.539 3.206 8.954 1.00 28.81 H new ATOM 656 N ILE A 85 30.383 3.095 7.032 1.00 29.48 N ATOM 657 CA ILE A 85 31.485 2.570 6.220 1.00 28.45 C ATOM 658 C ILE A 85 32.723 2.462 7.124 1.00 28.03 C ATOM 659 O ILE A 85 33.229 3.474 7.615 1.00 25.80 O ATOM 660 CB ILE A 85 31.813 3.520 5.043 1.00 30.00 C ATOM 661 CG1 ILE A 85 30.616 3.602 4.093 1.00 31.75 C ATOM 662 CG2 ILE A 85 33.057 3.030 4.302 1.00 30.18 C ATOM 663 CD1 ILE A 85 30.812 4.557 2.947 1.00 34.59 C ATOM 0 H ILE A 85 30.577 3.830 7.434 1.00 29.48 H new ATOM 0 HA ILE A 85 31.231 1.708 5.855 1.00 28.45 H new ATOM 0 HB ILE A 85 31.995 4.407 5.391 1.00 30.00 H new ATOM 0 HG12 ILE A 85 30.435 2.718 3.738 1.00 31.75 H new ATOM 0 HG13 ILE A 85 29.832 3.872 4.597 1.00 31.75 H new ATOM 0 HG21 ILE A 85 33.254 3.632 3.567 1.00 30.18 H new ATOM 0 HG22 ILE A 85 33.810 3.009 4.913 1.00 30.18 H new ATOM 0 HG23 ILE A 85 32.897 2.138 3.955 1.00 30.18 H new ATOM 0 HD11 ILE A 85 30.019 4.559 2.388 1.00 34.59 H new ATOM 0 HD12 ILE A 85 30.966 5.450 3.293 1.00 34.59 H new ATOM 0 HD13 ILE A 85 31.578 4.278 2.421 1.00 34.59 H new ATOM 664 N LYS A 86 33.208 1.242 7.331 1.00 26.25 N ATOM 665 CA LYS A 86 34.357 1.007 8.203 1.00 27.62 C ATOM 666 C LYS A 86 35.719 1.476 7.686 1.00 28.96 C ATOM 667 O LYS A 86 36.455 2.160 8.402 1.00 29.64 O ATOM 668 CB LYS A 86 34.437 -0.480 8.561 0.50 25.80 C ATOM 669 CG LYS A 86 35.618 -0.839 9.444 0.50 26.48 C ATOM 670 CD LYS A 86 35.658 -2.332 9.738 0.50 26.90 C ATOM 671 CE LYS A 86 36.948 -2.721 10.446 0.50 27.92 C ATOM 672 NZ LYS A 86 36.994 -4.172 10.774 0.50 28.96 N ATOM 0 H LYS A 86 32.884 0.530 6.973 1.00 26.25 H new ATOM 0 HA LYS A 86 34.184 1.564 8.978 1.00 27.62 H new ATOM 0 HB2 LYS A 86 33.618 -0.740 9.011 0.50 25.80 H new ATOM 0 HB3 LYS A 86 34.487 -0.998 7.743 0.50 25.80 H new ATOM 0 HG2 LYS A 86 36.443 -0.571 9.009 0.50 26.48 H new ATOM 0 HG3 LYS A 86 35.563 -0.345 10.277 0.50 26.48 H new ATOM 0 HD2 LYS A 86 34.898 -2.576 10.289 0.50 26.90 H new ATOM 0 HD3 LYS A 86 35.579 -2.829 8.909 0.50 26.90 H new ATOM 0 HE2 LYS A 86 37.705 -2.494 9.883 0.50 27.92 H new ATOM 0 HE3 LYS A 86 37.036 -2.204 11.262 0.50 27.92 H new ATOM 0 HZ1 LYS A 86 37.761 -4.359 11.186 0.50 28.96 H new ATOM 0 HZ2 LYS A 86 36.313 -4.377 11.309 0.50 28.96 H new ATOM 0 HZ3 LYS A 86 36.936 -4.648 10.024 0.50 28.96 H new ATOM 673 N LYS A 87 36.057 1.110 6.454 1.00 30.14 N ATOM 674 CA LYS A 87 37.348 1.476 5.868 1.00 31.39 C ATOM 675 C LYS A 87 37.548 2.980 5.712 1.00 30.78 C ATOM 676 O LYS A 87 36.740 3.666 5.089 1.00 31.91 O ATOM 677 CB LYS A 87 37.519 0.806 4.501 0.50 31.69 C ATOM 678 CG LYS A 87 37.557 -0.709 4.543 0.50 33.22 C ATOM 679 CD LYS A 87 37.672 -1.295 3.142 0.50 33.48 C ATOM 680 CE LYS A 87 37.636 -2.815 3.179 0.50 35.28 C ATOM 681 NZ LYS A 87 37.682 -3.419 1.816 0.50 34.89 N ATOM 0 H LYS A 87 35.551 0.646 5.936 1.00 30.14 H new ATOM 0 HA LYS A 87 38.020 1.162 6.493 1.00 31.39 H new ATOM 0 HB2 LYS A 87 36.790 1.084 3.924 0.50 31.69 H new ATOM 0 HB3 LYS A 87 38.340 1.128 4.096 0.50 31.69 H new ATOM 0 HG2 LYS A 87 38.309 -1.002 5.082 0.50 33.22 H new ATOM 0 HG3 LYS A 87 36.754 -1.044 4.972 0.50 33.22 H new ATOM 0 HD2 LYS A 87 36.946 -0.965 2.590 0.50 33.48 H new ATOM 0 HD3 LYS A 87 38.499 -0.998 2.731 0.50 33.48 H new ATOM 0 HE2 LYS A 87 38.387 -3.141 3.700 0.50 35.28 H new ATOM 0 HE3 LYS A 87 36.829 -3.106 3.632 0.50 35.28 H new ATOM 0 HZ1 LYS A 87 37.659 -4.306 1.883 0.50 34.89 H new ATOM 0 HZ2 LYS A 87 36.982 -3.139 1.343 0.50 34.89 H new ATOM 0 HZ3 LYS A 87 38.433 -3.172 1.407 0.50 34.89 H new ATOM 682 N LYS A 88 38.642 3.482 6.270 1.00 31.04 N ATOM 683 CA LYS A 88 38.971 4.901 6.189 1.00 32.62 C ATOM 684 C LYS A 88 39.193 5.295 4.725 1.00 32.15 C ATOM 685 O LYS A 88 38.754 6.354 4.282 1.00 32.45 O ATOM 686 CB LYS A 88 40.234 5.175 7.007 1.00 35.29 C ATOM 687 CG LYS A 88 40.557 6.640 7.216 1.00 39.12 C ATOM 688 CD LYS A 88 41.684 6.792 8.232 1.00 42.27 C ATOM 689 CE LYS A 88 41.930 8.251 8.586 1.00 44.14 C ATOM 690 NZ LYS A 88 43.073 8.400 9.528 1.00 44.16 N ATOM 0 H LYS A 88 39.215 3.011 6.706 1.00 31.04 H new ATOM 0 HA LYS A 88 38.239 5.428 6.547 1.00 32.62 H new ATOM 0 HB2 LYS A 88 40.139 4.752 7.875 1.00 35.29 H new ATOM 0 HB3 LYS A 88 40.987 4.752 6.566 1.00 35.29 H new ATOM 0 HG2 LYS A 88 40.816 7.044 6.373 1.00 39.12 H new ATOM 0 HG3 LYS A 88 39.768 7.111 7.526 1.00 39.12 H new ATOM 0 HD2 LYS A 88 41.464 6.296 9.036 1.00 42.27 H new ATOM 0 HD3 LYS A 88 42.498 6.404 7.874 1.00 42.27 H new ATOM 0 HE2 LYS A 88 42.108 8.756 7.777 1.00 44.14 H new ATOM 0 HE3 LYS A 88 41.130 8.628 8.985 1.00 44.14 H new ATOM 0 HZ1 LYS A 88 43.011 9.182 9.949 1.00 44.16 H new ATOM 0 HZ2 LYS A 88 43.054 7.740 10.125 1.00 44.16 H new ATOM 0 HZ3 LYS A 88 43.838 8.368 9.074 1.00 44.16 H new ATOM 691 N THR A 89 39.880 4.434 3.981 1.00 31.28 N ATOM 692 CA THR A 89 40.157 4.685 2.567 1.00 32.91 C ATOM 693 C THR A 89 38.857 4.877 1.784 1.00 33.00 C ATOM 694 O THR A 89 38.724 5.811 0.992 1.00 33.23 O ATOM 695 CB THR A 89 40.949 3.513 1.940 1.00 31.61 C ATOM 696 OG1 THR A 89 42.190 3.351 2.639 1.00 31.79 O ATOM 697 CG2 THR A 89 41.240 3.783 0.457 1.00 31.47 C ATOM 0 H THR A 89 40.198 3.692 4.278 1.00 31.28 H new ATOM 0 HA THR A 89 40.688 5.495 2.517 1.00 32.91 H new ATOM 0 HB THR A 89 40.415 2.707 2.012 1.00 31.61 H new ATOM 0 HG1 THR A 89 42.050 2.968 3.373 1.00 31.79 H new ATOM 0 HG21 THR A 89 41.736 3.038 0.084 1.00 31.47 H new ATOM 0 HG22 THR A 89 40.404 3.887 -0.023 1.00 31.47 H new ATOM 0 HG23 THR A 89 41.764 4.595 0.372 1.00 31.47 H new ATOM 698 N GLU A 90 37.904 3.982 2.019 1.00 33.47 N ATOM 699 CA GLU A 90 36.603 4.020 1.362 1.00 32.64 C ATOM 700 C GLU A 90 35.893 5.347 1.660 1.00 32.65 C ATOM 701 O GLU A 90 35.417 6.030 0.749 1.00 29.78 O ATOM 702 CB GLU A 90 35.768 2.837 1.852 1.00 36.09 C ATOM 703 CG GLU A 90 34.754 2.321 0.855 1.00 39.99 C ATOM 704 CD GLU A 90 34.083 1.041 1.318 1.00 41.99 C ATOM 705 OE1 GLU A 90 34.799 0.045 1.565 1.00 40.92 O ATOM 706 OE2 GLU A 90 32.837 1.034 1.429 1.00 44.00 O ATOM 0 H GLU A 90 37.996 3.328 2.570 1.00 33.47 H new ATOM 0 HA GLU A 90 36.719 3.955 0.401 1.00 32.64 H new ATOM 0 HB2 GLU A 90 36.366 2.112 2.091 1.00 36.09 H new ATOM 0 HB3 GLU A 90 35.303 3.099 2.662 1.00 36.09 H new ATOM 0 HG2 GLU A 90 34.078 3.001 0.704 1.00 39.99 H new ATOM 0 HG3 GLU A 90 35.193 2.163 0.004 1.00 39.99 H new ATOM 707 N ARG A 91 35.827 5.711 2.940 1.00 31.07 N ATOM 708 CA ARG A 91 35.195 6.965 3.334 1.00 30.94 C ATOM 709 C ARG A 91 35.882 8.160 2.669 1.00 31.03 C ATOM 710 O ARG A 91 35.220 9.099 2.228 1.00 29.07 O ATOM 711 CB ARG A 91 35.227 7.125 4.860 1.00 30.40 C ATOM 712 CG ARG A 91 34.115 6.357 5.582 1.00 31.73 C ATOM 713 CD ARG A 91 34.196 6.521 7.097 1.00 33.57 C ATOM 714 NE ARG A 91 35.168 5.608 7.690 1.00 34.40 N ATOM 715 CZ ARG A 91 36.019 5.947 8.650 1.00 34.60 C ATOM 716 NH1 ARG A 91 36.025 7.185 9.126 1.00 36.74 N ATOM 717 NH2 ARG A 91 36.855 5.046 9.145 1.00 34.08 N ATOM 0 H ARG A 91 36.141 5.247 3.592 1.00 31.07 H new ATOM 0 HA ARG A 91 34.272 6.939 3.038 1.00 30.94 H new ATOM 0 HB2 ARG A 91 36.087 6.822 5.191 1.00 30.40 H new ATOM 0 HB3 ARG A 91 35.155 8.067 5.080 1.00 30.40 H new ATOM 0 HG2 ARG A 91 33.252 6.670 5.270 1.00 31.73 H new ATOM 0 HG3 ARG A 91 34.174 5.416 5.356 1.00 31.73 H new ATOM 0 HD2 ARG A 91 34.439 7.435 7.311 1.00 33.57 H new ATOM 0 HD3 ARG A 91 33.322 6.361 7.487 1.00 33.57 H new ATOM 0 HE ARG A 91 35.191 4.799 7.399 1.00 34.40 H new ATOM 0 HH11 ARG A 91 35.477 7.769 8.812 1.00 36.74 H new ATOM 0 HH12 ARG A 91 36.577 7.404 9.748 1.00 36.74 H new ATOM 0 HH21 ARG A 91 36.846 4.240 8.844 1.00 34.08 H new ATOM 0 HH22 ARG A 91 37.406 5.267 9.767 1.00 34.08 H new ATOM 718 N GLU A 92 37.210 8.126 2.604 1.00 30.48 N ATOM 719 CA GLU A 92 37.967 9.205 1.979 1.00 31.78 C ATOM 720 C GLU A 92 37.574 9.366 0.513 1.00 31.61 C ATOM 721 O GLU A 92 37.315 10.474 0.049 1.00 31.92 O ATOM 722 CB GLU A 92 39.472 8.929 2.082 1.00 32.61 C ATOM 723 CG GLU A 92 40.046 9.107 3.478 1.00 36.83 C ATOM 724 CD GLU A 92 41.506 8.690 3.575 1.00 39.90 C ATOM 725 OE1 GLU A 92 42.137 8.999 4.608 1.00 41.08 O ATOM 726 OE2 GLU A 92 42.017 8.049 2.624 1.00 41.00 O ATOM 0 H GLU A 92 37.692 7.486 2.916 1.00 30.48 H new ATOM 0 HA GLU A 92 37.760 10.028 2.449 1.00 31.78 H new ATOM 0 HB2 GLU A 92 39.645 8.022 1.786 1.00 32.61 H new ATOM 0 HB3 GLU A 92 39.941 9.520 1.473 1.00 32.61 H new ATOM 0 HG2 GLU A 92 39.962 10.037 3.741 1.00 36.83 H new ATOM 0 HG3 GLU A 92 39.523 8.586 4.107 1.00 36.83 H new ATOM 727 N ASP A 93 37.535 8.252 -0.213 1.00 31.92 N ATOM 728 CA ASP A 93 37.170 8.276 -1.625 1.00 30.85 C ATOM 729 C ASP A 93 35.739 8.765 -1.804 1.00 30.92 C ATOM 730 O ASP A 93 35.451 9.564 -2.693 1.00 29.65 O ATOM 731 CB ASP A 93 37.330 6.880 -2.220 1.00 30.84 C ATOM 732 CG ASP A 93 38.770 6.428 -2.236 1.00 31.01 C ATOM 733 OD1 ASP A 93 39.022 5.233 -2.480 1.00 30.40 O ATOM 734 OD2 ASP A 93 39.652 7.280 -2.003 1.00 31.96 O ATOM 0 H ASP A 93 37.717 7.470 0.095 1.00 31.92 H new ATOM 0 HA ASP A 93 37.759 8.891 -2.089 1.00 30.85 H new ATOM 0 HB2 ASP A 93 36.801 6.249 -1.707 1.00 30.84 H new ATOM 0 HB3 ASP A 93 36.981 6.874 -3.125 1.00 30.84 H new ATOM 735 N LEU A 94 34.842 8.289 -0.950 1.00 30.16 N ATOM 736 CA LEU A 94 33.453 8.708 -1.043 1.00 29.51 C ATOM 737 C LEU A 94 33.372 10.215 -0.840 1.00 29.67 C ATOM 738 O LEU A 94 32.709 10.920 -1.605 1.00 28.17 O ATOM 739 CB LEU A 94 32.608 7.990 0.012 1.00 30.16 C ATOM 740 CG LEU A 94 31.107 8.292 -0.028 1.00 30.88 C ATOM 741 CD1 LEU A 94 30.534 7.943 -1.410 1.00 28.65 C ATOM 742 CD2 LEU A 94 30.411 7.505 1.071 1.00 31.23 C ATOM 0 H LEU A 94 35.014 7.731 -0.319 1.00 30.16 H new ATOM 0 HA LEU A 94 33.107 8.478 -1.920 1.00 29.51 H new ATOM 0 HB2 LEU A 94 32.733 7.034 -0.092 1.00 30.16 H new ATOM 0 HB3 LEU A 94 32.946 8.226 0.890 1.00 30.16 H new ATOM 0 HG LEU A 94 30.957 9.238 0.123 1.00 30.88 H new ATOM 0 HD11 LEU A 94 29.584 8.138 -1.425 1.00 28.65 H new ATOM 0 HD12 LEU A 94 30.983 8.471 -2.089 1.00 28.65 H new ATOM 0 HD13 LEU A 94 30.673 7.000 -1.590 1.00 28.65 H new ATOM 0 HD21 LEU A 94 29.459 7.692 1.051 1.00 31.23 H new ATOM 0 HD22 LEU A 94 30.556 6.556 0.931 1.00 31.23 H new ATOM 0 HD23 LEU A 94 30.773 7.764 1.933 1.00 31.23 H new ATOM 743 N ILE A 95 34.071 10.710 0.183 1.00 29.56 N ATOM 744 CA ILE A 95 34.063 12.133 0.494 1.00 29.23 C ATOM 745 C ILE A 95 34.696 12.978 -0.609 1.00 29.90 C ATOM 746 O ILE A 95 34.282 14.111 -0.839 1.00 28.46 O ATOM 747 CB ILE A 95 34.762 12.413 1.847 1.00 30.06 C ATOM 748 CG1 ILE A 95 33.889 11.884 2.995 1.00 32.08 C ATOM 749 CG2 ILE A 95 35.004 13.902 2.019 1.00 28.48 C ATOM 750 CD1 ILE A 95 34.552 11.921 4.364 1.00 30.68 C ATOM 0 H ILE A 95 34.557 10.233 0.709 1.00 29.56 H new ATOM 0 HA ILE A 95 33.131 12.393 0.560 1.00 29.23 H new ATOM 0 HB ILE A 95 35.619 11.959 1.860 1.00 30.06 H new ATOM 0 HG12 ILE A 95 33.072 12.405 3.030 1.00 32.08 H new ATOM 0 HG13 ILE A 95 33.634 10.969 2.797 1.00 32.08 H new ATOM 0 HG21 ILE A 95 35.442 14.063 2.870 1.00 28.48 H new ATOM 0 HG22 ILE A 95 35.569 14.223 1.299 1.00 28.48 H new ATOM 0 HG23 ILE A 95 34.156 14.372 1.998 1.00 28.48 H new ATOM 0 HD11 ILE A 95 33.939 11.572 5.030 1.00 30.68 H new ATOM 0 HD12 ILE A 95 35.356 11.378 4.349 1.00 30.68 H new ATOM 0 HD13 ILE A 95 34.784 12.836 4.587 1.00 30.68 H new ATOM 751 N ALA A 96 35.700 12.437 -1.288 1.00 31.39 N ATOM 752 CA ALA A 96 36.325 13.176 -2.379 1.00 33.82 C ATOM 753 C ALA A 96 35.243 13.395 -3.445 1.00 34.00 C ATOM 754 O ALA A 96 34.984 14.525 -3.865 1.00 33.78 O ATOM 755 CB ALA A 96 37.494 12.380 -2.960 1.00 33.25 C ATOM 0 H ALA A 96 36.030 11.657 -1.138 1.00 31.39 H new ATOM 0 HA ALA A 96 36.679 14.023 -2.066 1.00 33.82 H new ATOM 0 HB1 ALA A 96 37.900 12.882 -3.684 1.00 33.25 H new ATOM 0 HB2 ALA A 96 38.154 12.221 -2.267 1.00 33.25 H new ATOM 0 HB3 ALA A 96 37.171 11.530 -3.298 1.00 33.25 H new ATOM 756 N TYR A 97 34.602 12.306 -3.862 1.00 35.36 N ATOM 757 CA TYR A 97 33.543 12.384 -4.864 1.00 36.58 C ATOM 758 C TYR A 97 32.437 13.346 -4.442 1.00 36.06 C ATOM 759 O TYR A 97 31.892 14.072 -5.267 1.00 38.22 O ATOM 760 CB TYR A 97 32.931 11.003 -5.115 1.00 35.76 C ATOM 761 CG TYR A 97 31.647 11.069 -5.914 1.00 37.42 C ATOM 762 CD1 TYR A 97 31.661 11.366 -7.280 1.00 37.79 C ATOM 763 CD2 TYR A 97 30.410 10.912 -5.288 1.00 37.42 C ATOM 764 CE1 TYR A 97 30.473 11.512 -7.999 1.00 35.57 C ATOM 765 CE2 TYR A 97 29.223 11.057 -5.994 1.00 38.31 C ATOM 766 CZ TYR A 97 29.261 11.359 -7.348 1.00 36.93 C ATOM 767 OH TYR A 97 28.082 11.520 -8.032 1.00 33.84 O ATOM 0 H TYR A 97 34.766 11.511 -3.577 1.00 35.36 H new ATOM 0 HA TYR A 97 33.951 12.715 -5.679 1.00 36.58 H new ATOM 0 HB2 TYR A 97 33.573 10.450 -5.587 1.00 35.76 H new ATOM 0 HB3 TYR A 97 32.756 10.571 -4.264 1.00 35.76 H new ATOM 0 HD1 TYR A 97 32.475 11.468 -7.717 1.00 37.79 H new ATOM 0 HD2 TYR A 97 30.380 10.707 -4.381 1.00 37.42 H new ATOM 0 HE1 TYR A 97 30.496 11.710 -8.907 1.00 35.57 H new ATOM 0 HE2 TYR A 97 28.406 10.952 -5.561 1.00 38.31 H new ATOM 0 HH TYR A 97 27.436 11.396 -7.510 1.00 33.84 H new ATOM 768 N LEU A 98 32.114 13.355 -3.156 1.00 37.56 N ATOM 769 CA LEU A 98 31.058 14.221 -2.652 1.00 37.33 C ATOM 770 C LEU A 98 31.425 15.693 -2.676 1.00 38.79 C ATOM 771 O LEU A 98 30.571 16.545 -2.922 1.00 38.61 O ATOM 772 CB LEU A 98 30.670 13.825 -1.225 1.00 36.78 C ATOM 773 CG LEU A 98 29.854 12.543 -1.039 1.00 37.24 C ATOM 774 CD1 LEU A 98 29.522 12.375 0.435 1.00 36.11 C ATOM 775 CD2 LEU A 98 28.575 12.614 -1.861 1.00 33.69 C ATOM 0 H LEU A 98 32.494 12.867 -2.558 1.00 37.56 H new ATOM 0 HA LEU A 98 30.306 14.098 -3.252 1.00 37.33 H new ATOM 0 HB2 LEU A 98 31.486 13.737 -0.707 1.00 36.78 H new ATOM 0 HB3 LEU A 98 30.166 14.558 -0.838 1.00 36.78 H new ATOM 0 HG LEU A 98 30.372 11.781 -1.342 1.00 37.24 H new ATOM 0 HD11 LEU A 98 29.005 11.564 0.560 1.00 36.11 H new ATOM 0 HD12 LEU A 98 30.344 12.316 0.947 1.00 36.11 H new ATOM 0 HD13 LEU A 98 29.006 13.138 0.740 1.00 36.11 H new ATOM 0 HD21 LEU A 98 28.065 11.798 -1.737 1.00 33.69 H new ATOM 0 HD22 LEU A 98 28.045 13.373 -1.571 1.00 33.69 H new ATOM 0 HD23 LEU A 98 28.798 12.716 -2.799 1.00 33.69 H new ATOM 776 N LYS A 99 32.687 15.999 -2.410 1.00 39.03 N ATOM 777 CA LYS A 99 33.122 17.389 -2.403 1.00 40.71 C ATOM 778 C LYS A 99 33.027 17.937 -3.821 1.00 41.57 C ATOM 779 O LYS A 99 32.762 19.117 -4.034 1.00 42.39 O ATOM 780 CB LYS A 99 34.560 17.490 -1.891 1.00 41.42 C ATOM 781 CG LYS A 99 34.997 18.900 -1.557 1.00 40.54 C ATOM 782 CD LYS A 99 36.382 18.905 -0.938 1.00 44.10 C ATOM 783 CE LYS A 99 36.742 20.288 -0.426 1.00 44.17 C ATOM 784 NZ LYS A 99 38.033 20.274 0.303 1.00 47.59 N ATOM 0 H LYS A 99 33.302 15.425 -2.233 1.00 39.03 H new ATOM 0 HA LYS A 99 32.553 17.908 -1.813 1.00 40.71 H new ATOM 0 HB2 LYS A 99 34.651 16.937 -1.099 1.00 41.42 H new ATOM 0 HB3 LYS A 99 35.159 17.126 -2.562 1.00 41.42 H new ATOM 0 HG2 LYS A 99 34.996 19.442 -2.361 1.00 40.54 H new ATOM 0 HG3 LYS A 99 34.363 19.302 -0.943 1.00 40.54 H new ATOM 0 HD2 LYS A 99 36.416 18.267 -0.208 1.00 44.10 H new ATOM 0 HD3 LYS A 99 37.035 18.619 -1.596 1.00 44.10 H new ATOM 0 HE2 LYS A 99 36.796 20.907 -1.171 1.00 44.17 H new ATOM 0 HE3 LYS A 99 36.040 20.611 0.161 1.00 44.17 H new ATOM 0 HZ1 LYS A 99 38.220 21.095 0.592 1.00 47.59 H new ATOM 0 HZ2 LYS A 99 37.976 19.721 0.998 1.00 47.59 H new ATOM 0 HZ3 LYS A 99 38.679 19.998 -0.243 1.00 47.59 H new ATOM 785 N LYS A 100 33.234 17.056 -4.789 1.00 42.14 N ATOM 786 CA LYS A 100 33.170 17.422 -6.192 1.00 43.01 C ATOM 787 C LYS A 100 31.727 17.424 -6.697 1.00 42.45 C ATOM 788 O LYS A 100 31.204 18.452 -7.127 1.00 41.48 O ATOM 789 CB LYS A 100 34.032 16.443 -7.004 1.00 44.91 C ATOM 790 CG LYS A 100 33.822 16.457 -8.518 1.00 48.92 C ATOM 791 CD LYS A 100 32.781 15.419 -8.946 1.00 52.41 C ATOM 792 CE LYS A 100 32.696 15.288 -10.464 1.00 54.22 C ATOM 793 NZ LYS A 100 31.677 14.275 -10.880 1.00 55.32 N ATOM 0 H LYS A 100 33.416 16.227 -4.649 1.00 42.14 H new ATOM 0 HA LYS A 100 33.514 18.323 -6.301 1.00 43.01 H new ATOM 0 HB2 LYS A 100 34.965 16.636 -6.824 1.00 44.91 H new ATOM 0 HB3 LYS A 100 33.861 15.545 -6.680 1.00 44.91 H new ATOM 0 HG2 LYS A 100 33.535 17.340 -8.799 1.00 48.92 H new ATOM 0 HG3 LYS A 100 34.664 16.277 -8.965 1.00 48.92 H new ATOM 0 HD2 LYS A 100 33.006 14.558 -8.560 1.00 52.41 H new ATOM 0 HD3 LYS A 100 31.912 15.669 -8.594 1.00 52.41 H new ATOM 0 HE2 LYS A 100 32.472 16.149 -10.851 1.00 54.22 H new ATOM 0 HE3 LYS A 100 33.564 15.036 -10.816 1.00 54.22 H new ATOM 0 HZ1 LYS A 100 31.654 14.224 -11.768 1.00 55.32 H new ATOM 0 HZ2 LYS A 100 31.894 13.480 -10.543 1.00 55.32 H new ATOM 0 HZ3 LYS A 100 30.876 14.517 -10.576 1.00 55.32 H new ATOM 794 N ALA A 101 31.077 16.271 -6.612 1.00 42.31 N ATOM 795 CA ALA A 101 29.710 16.122 -7.094 1.00 41.38 C ATOM 796 C ALA A 101 28.670 17.093 -6.522 1.00 40.85 C ATOM 797 O ALA A 101 27.805 17.573 -7.252 1.00 40.61 O ATOM 798 CB ALA A 101 29.256 14.683 -6.878 1.00 40.60 C ATOM 0 H ALA A 101 31.414 15.555 -6.275 1.00 42.31 H new ATOM 0 HA ALA A 101 29.752 16.354 -8.035 1.00 41.38 H new ATOM 0 HB1 ALA A 101 28.346 14.579 -7.198 1.00 40.60 H new ATOM 0 HB2 ALA A 101 29.840 14.082 -7.366 1.00 40.60 H new ATOM 0 HB3 ALA A 101 29.292 14.471 -5.932 1.00 40.60 H new ATOM 799 N THR A 102 28.745 17.382 -5.227 1.00 40.35 N ATOM 800 CA THR A 102 27.766 18.270 -4.596 1.00 39.87 C ATOM 801 C THR A 102 28.159 19.738 -4.656 1.00 41.45 C ATOM 802 O THR A 102 27.539 20.583 -4.007 1.00 39.71 O ATOM 803 CB THR A 102 27.544 17.900 -3.106 1.00 40.08 C ATOM 804 OG1 THR A 102 28.715 18.229 -2.349 1.00 35.25 O ATOM 805 CG2 THR A 102 27.250 16.402 -2.956 1.00 38.74 C ATOM 0 H THR A 102 29.350 17.078 -4.697 1.00 40.35 H new ATOM 0 HA THR A 102 26.951 18.145 -5.106 1.00 39.87 H new ATOM 0 HB THR A 102 26.783 18.403 -2.775 1.00 40.08 H new ATOM 0 HG1 THR A 102 29.300 17.637 -2.466 1.00 35.25 H new ATOM 0 HG21 THR A 102 27.114 16.191 -2.019 1.00 38.74 H new ATOM 0 HG22 THR A 102 26.450 16.177 -3.457 1.00 38.74 H new ATOM 0 HG23 THR A 102 27.999 15.889 -3.297 1.00 38.74 H new ATOM 806 N ASN A 103 29.179 20.048 -5.444 1.00 44.03 N ATOM 807 CA ASN A 103 29.646 21.422 -5.540 1.00 48.57 C ATOM 808 C ASN A 103 29.566 22.013 -6.946 1.00 50.52 C ATOM 809 O ASN A 103 30.452 22.758 -7.368 1.00 50.22 O ATOM 810 CB ASN A 103 31.082 21.506 -5.016 1.00 49.00 C ATOM 811 CG ASN A 103 31.650 22.901 -5.100 1.00 51.15 C ATOM 812 OD1 ASN A 103 31.103 23.844 -4.528 1.00 51.04 O ATOM 813 ND2 ASN A 103 32.753 23.043 -5.826 1.00 52.90 N ATOM 0 H ASN A 103 29.611 19.483 -5.927 1.00 44.03 H new ATOM 0 HA ASN A 103 29.046 21.956 -4.996 1.00 48.57 H new ATOM 0 HB2 ASN A 103 31.104 21.207 -4.094 1.00 49.00 H new ATOM 0 HB3 ASN A 103 31.644 20.901 -5.524 1.00 49.00 H new ATOM 0 HD21 ASN A 103 33.115 23.819 -5.912 1.00 52.90 H new ATOM 0 HD22 ASN A 103 33.106 22.359 -6.211 1.00 52.90 H new ATOM 814 N GLU A 104 28.502 21.680 -7.669 1.00 52.67 N ATOM 815 CA GLU A 104 28.316 22.198 -9.018 1.00 55.76 C ATOM 816 C GLU A 104 28.265 23.719 -8.946 1.00 57.24 C ATOM 817 O GLU A 104 29.112 24.371 -9.594 1.00 58.69 O ATOM 818 CB GLU A 104 27.010 21.679 -9.618 1.00 56.68 C ATOM 819 CG GLU A 104 26.811 20.180 -9.473 1.00 59.27 C ATOM 820 CD GLU A 104 25.538 19.702 -10.143 1.00 59.08 C ATOM 821 OE1 GLU A 104 24.486 20.347 -9.943 1.00 58.77 O ATOM 822 OE2 GLU A 104 25.590 18.682 -10.864 1.00 59.14 O ATOM 823 OXT GLU A 104 27.375 24.235 -8.233 1.00 58.28 O ATOM 0 H GLU A 104 27.877 21.156 -7.397 1.00 52.67 H new ATOM 0 HA GLU A 104 29.051 21.905 -9.579 1.00 55.76 H new ATOM 0 HB2 GLU A 104 26.267 22.136 -9.194 1.00 56.68 H new ATOM 0 HB3 GLU A 104 26.985 21.909 -10.560 1.00 56.68 H new ATOM 0 HG2 GLU A 104 27.571 19.716 -9.858 1.00 59.27 H new ATOM 0 HG3 GLU A 104 26.785 19.949 -8.531 1.00 59.27 H new TER 824 GLU A 104 ATOM 825 N GLY B 1 4.847 -28.257 38.761 1.00 39.37 N ATOM 826 CA GLY B 1 5.784 -27.127 39.045 1.00 40.23 C ATOM 827 C GLY B 1 6.239 -27.069 40.493 1.00 40.02 C ATOM 828 O GLY B 1 5.419 -27.119 41.409 1.00 41.25 O ATOM 0 H1 GLY B 1 4.615 -28.242 37.902 1.00 39.37 H new ATOM 0 H2 GLY B 1 5.249 -29.029 38.946 1.00 39.37 H new ATOM 0 H3 GLY B 1 4.119 -28.173 39.266 1.00 39.37 H new ATOM 0 HA2 GLY B 1 6.562 -27.209 38.472 1.00 40.23 H new ATOM 0 HA3 GLY B 1 5.350 -26.290 38.816 1.00 40.23 H new ATOM 829 N ASP B 2 7.547 -26.935 40.698 1.00 40.82 N ATOM 830 CA ASP B 2 8.130 -26.889 42.038 1.00 40.71 C ATOM 831 C ASP B 2 8.008 -25.518 42.702 1.00 39.98 C ATOM 832 O ASP B 2 8.849 -24.644 42.495 1.00 39.68 O ATOM 833 CB ASP B 2 9.603 -27.287 41.968 1.00 43.02 C ATOM 834 CG ASP B 2 10.180 -27.636 43.328 1.00 44.62 C ATOM 835 OD1 ASP B 2 9.967 -26.863 44.289 1.00 42.43 O ATOM 836 OD2 ASP B 2 10.857 -28.684 43.424 1.00 44.77 O ATOM 0 H ASP B 2 8.123 -26.868 40.063 1.00 40.82 H new ATOM 0 HA ASP B 2 7.628 -27.514 42.584 1.00 40.71 H new ATOM 0 HB2 ASP B 2 9.701 -28.048 41.374 1.00 43.02 H new ATOM 0 HB3 ASP B 2 10.113 -26.558 41.582 1.00 43.02 H new ATOM 837 N VAL B 3 6.974 -25.346 43.518 1.00 38.14 N ATOM 838 CA VAL B 3 6.736 -24.081 44.203 1.00 37.62 C ATOM 839 C VAL B 3 7.956 -23.538 44.942 1.00 38.74 C ATOM 840 O VAL B 3 8.308 -22.367 44.793 1.00 38.23 O ATOM 841 CB VAL B 3 5.556 -24.211 45.198 1.00 37.60 C ATOM 842 CG1 VAL B 3 5.452 -22.964 46.070 1.00 35.99 C ATOM 843 CG2 VAL B 3 4.258 -24.415 44.431 1.00 35.05 C ATOM 0 H VAL B 3 6.393 -25.956 43.690 1.00 38.14 H new ATOM 0 HA VAL B 3 6.522 -23.445 43.502 1.00 37.62 H new ATOM 0 HB VAL B 3 5.715 -24.977 45.772 1.00 37.60 H new ATOM 0 HG11 VAL B 3 4.709 -23.061 46.687 1.00 35.99 H new ATOM 0 HG12 VAL B 3 6.275 -22.850 46.571 1.00 35.99 H new ATOM 0 HG13 VAL B 3 5.305 -22.187 45.508 1.00 35.99 H new ATOM 0 HG21 VAL B 3 3.521 -24.496 45.057 1.00 35.05 H new ATOM 0 HG22 VAL B 3 4.104 -23.656 43.847 1.00 35.05 H new ATOM 0 HG23 VAL B 3 4.320 -25.224 43.899 1.00 35.05 H new ATOM 844 N GLU B 4 8.601 -24.383 45.738 1.00 39.32 N ATOM 845 CA GLU B 4 9.774 -23.959 46.499 1.00 40.37 C ATOM 846 C GLU B 4 10.905 -23.482 45.586 1.00 38.48 C ATOM 847 O GLU B 4 11.603 -22.525 45.904 1.00 37.97 O ATOM 848 CB GLU B 4 10.258 -25.106 47.395 1.00 42.47 C ATOM 849 CG GLU B 4 10.387 -24.722 48.868 1.00 46.46 C ATOM 850 CD GLU B 4 9.200 -23.908 49.375 1.00 50.17 C ATOM 851 OE1 GLU B 4 8.048 -24.380 49.245 1.00 52.09 O ATOM 852 OE2 GLU B 4 9.416 -22.794 49.904 1.00 48.58 O ATOM 0 H GLU B 4 8.377 -25.205 45.853 1.00 39.32 H new ATOM 0 HA GLU B 4 9.513 -23.206 47.052 1.00 40.37 H new ATOM 0 HB2 GLU B 4 9.641 -25.850 47.316 1.00 42.47 H new ATOM 0 HB3 GLU B 4 11.119 -25.416 47.073 1.00 42.47 H new ATOM 0 HG2 GLU B 4 10.472 -25.528 49.401 1.00 46.46 H new ATOM 0 HG3 GLU B 4 11.202 -24.211 48.994 1.00 46.46 H new ATOM 853 N LYS B 5 11.087 -24.155 44.456 1.00 37.93 N ATOM 854 CA LYS B 5 12.121 -23.767 43.502 1.00 37.24 C ATOM 855 C LYS B 5 11.703 -22.468 42.817 1.00 35.55 C ATOM 856 O LYS B 5 12.518 -21.567 42.616 1.00 32.90 O ATOM 857 CB LYS B 5 12.316 -24.866 42.457 1.00 40.03 C ATOM 858 CG LYS B 5 12.994 -26.115 43.001 1.00 43.31 C ATOM 859 CD LYS B 5 12.987 -27.257 41.988 1.00 46.40 C ATOM 860 CE LYS B 5 13.617 -26.848 40.668 1.00 47.64 C ATOM 861 NZ LYS B 5 15.027 -26.394 40.842 1.00 50.89 N ATOM 0 H LYS B 5 10.623 -24.840 44.222 1.00 37.93 H new ATOM 0 HA LYS B 5 12.960 -23.636 43.971 1.00 37.24 H new ATOM 0 HB2 LYS B 5 11.451 -25.110 42.091 1.00 40.03 H new ATOM 0 HB3 LYS B 5 12.845 -24.514 41.724 1.00 40.03 H new ATOM 0 HG2 LYS B 5 13.909 -25.905 43.244 1.00 43.31 H new ATOM 0 HG3 LYS B 5 12.543 -26.400 43.811 1.00 43.31 H new ATOM 0 HD2 LYS B 5 13.468 -28.016 42.354 1.00 46.40 H new ATOM 0 HD3 LYS B 5 12.074 -27.547 41.834 1.00 46.40 H new ATOM 0 HE2 LYS B 5 13.592 -27.597 40.052 1.00 47.64 H new ATOM 0 HE3 LYS B 5 13.095 -26.135 40.268 1.00 47.64 H new ATOM 0 HZ1 LYS B 5 15.401 -26.274 40.043 1.00 50.89 H new ATOM 0 HZ2 LYS B 5 15.039 -25.627 41.293 1.00 50.89 H new ATOM 0 HZ3 LYS B 5 15.484 -27.010 41.293 1.00 50.89 H new ATOM 862 N GLY B 6 10.423 -22.384 42.466 1.00 34.10 N ATOM 863 CA GLY B 6 9.911 -21.192 41.823 1.00 33.32 C ATOM 864 C GLY B 6 10.140 -19.967 42.689 1.00 33.76 C ATOM 865 O GLY B 6 10.475 -18.897 42.187 1.00 34.22 O ATOM 0 H GLY B 6 9.842 -23.005 42.593 1.00 34.10 H new ATOM 0 HA2 GLY B 6 10.346 -21.071 40.964 1.00 33.32 H new ATOM 0 HA3 GLY B 6 8.963 -21.296 41.648 1.00 33.32 H new ATOM 866 N LYS B 7 9.968 -20.125 43.997 1.00 33.33 N ATOM 867 CA LYS B 7 10.157 -19.029 44.935 1.00 30.94 C ATOM 868 C LYS B 7 11.580 -18.472 44.884 1.00 31.25 C ATOM 869 O LYS B 7 11.783 -17.265 44.990 1.00 28.95 O ATOM 870 CB LYS B 7 9.828 -19.501 46.349 1.00 32.16 C ATOM 871 CG LYS B 7 9.938 -18.432 47.404 1.00 32.49 C ATOM 872 CD LYS B 7 9.156 -18.842 48.635 1.00 37.56 C ATOM 873 CE LYS B 7 9.439 -17.919 49.806 1.00 41.89 C ATOM 874 NZ LYS B 7 10.854 -18.054 50.254 1.00 43.13 N ATOM 0 H LYS B 7 9.739 -20.869 44.363 1.00 33.33 H new ATOM 0 HA LYS B 7 9.556 -18.312 44.680 1.00 30.94 H new ATOM 0 HB2 LYS B 7 8.926 -19.857 46.358 1.00 32.16 H new ATOM 0 HB3 LYS B 7 10.423 -20.231 46.581 1.00 32.16 H new ATOM 0 HG2 LYS B 7 10.869 -18.289 47.635 1.00 32.49 H new ATOM 0 HG3 LYS B 7 9.598 -17.591 47.060 1.00 32.49 H new ATOM 0 HD2 LYS B 7 8.207 -18.832 48.435 1.00 37.56 H new ATOM 0 HD3 LYS B 7 9.385 -19.753 48.877 1.00 37.56 H new ATOM 0 HE2 LYS B 7 9.262 -17.000 49.550 1.00 41.89 H new ATOM 0 HE3 LYS B 7 8.841 -18.128 50.541 1.00 41.89 H new ATOM 0 HZ1 LYS B 7 10.935 -17.736 51.081 1.00 43.13 H new ATOM 0 HZ2 LYS B 7 11.089 -18.912 50.243 1.00 43.13 H new ATOM 0 HZ3 LYS B 7 11.384 -17.595 49.706 1.00 43.13 H new ATOM 875 N LYS B 8 12.561 -19.354 44.717 1.00 32.24 N ATOM 876 CA LYS B 8 13.958 -18.933 44.641 1.00 33.99 C ATOM 877 C LYS B 8 14.206 -18.180 43.336 1.00 32.72 C ATOM 878 O LYS B 8 14.961 -17.214 43.300 1.00 31.41 O ATOM 879 CB LYS B 8 14.893 -20.147 44.717 1.00 37.26 C ATOM 880 CG LYS B 8 14.868 -20.876 46.064 1.00 41.11 C ATOM 881 CD LYS B 8 15.770 -22.105 46.039 1.00 43.69 C ATOM 882 CE LYS B 8 15.716 -22.863 47.355 1.00 45.43 C ATOM 883 NZ LYS B 8 16.187 -22.021 48.491 1.00 48.04 N ATOM 0 H LYS B 8 12.439 -20.202 44.645 1.00 32.24 H new ATOM 0 HA LYS B 8 14.142 -18.348 45.393 1.00 33.99 H new ATOM 0 HB2 LYS B 8 14.651 -20.773 44.017 1.00 37.26 H new ATOM 0 HB3 LYS B 8 15.800 -19.856 44.535 1.00 37.26 H new ATOM 0 HG2 LYS B 8 15.157 -20.273 46.767 1.00 41.11 H new ATOM 0 HG3 LYS B 8 13.959 -21.142 46.274 1.00 41.11 H new ATOM 0 HD2 LYS B 8 15.500 -22.691 45.315 1.00 43.69 H new ATOM 0 HD3 LYS B 8 16.683 -21.834 45.858 1.00 43.69 H new ATOM 0 HE2 LYS B 8 14.807 -23.156 47.524 1.00 45.43 H new ATOM 0 HE3 LYS B 8 16.265 -23.661 47.293 1.00 45.43 H new ATOM 0 HZ1 LYS B 8 16.324 -22.535 49.205 1.00 48.04 H new ATOM 0 HZ2 LYS B 8 16.947 -21.617 48.266 1.00 48.04 H new ATOM 0 HZ3 LYS B 8 15.571 -21.408 48.682 1.00 48.04 H new ATOM 884 N ILE B 9 13.579 -18.628 42.255 1.00 31.63 N ATOM 885 CA ILE B 9 13.753 -17.950 40.979 1.00 29.71 C ATOM 886 C ILE B 9 13.157 -16.539 41.090 1.00 29.43 C ATOM 887 O ILE B 9 13.806 -15.546 40.746 1.00 27.48 O ATOM 888 CB ILE B 9 13.066 -18.742 39.836 1.00 29.96 C ATOM 889 CG1 ILE B 9 13.723 -20.118 39.700 1.00 26.51 C ATOM 890 CG2 ILE B 9 13.174 -17.979 38.522 1.00 25.61 C ATOM 891 CD1 ILE B 9 12.981 -21.065 38.759 1.00 27.56 C ATOM 0 H ILE B 9 13.057 -19.311 42.238 1.00 31.63 H new ATOM 0 HA ILE B 9 14.698 -17.893 40.768 1.00 29.71 H new ATOM 0 HB ILE B 9 12.127 -18.854 40.050 1.00 29.96 H new ATOM 0 HG12 ILE B 9 14.631 -20.003 39.380 1.00 26.51 H new ATOM 0 HG13 ILE B 9 13.781 -20.527 40.577 1.00 26.51 H new ATOM 0 HG21 ILE B 9 12.741 -18.485 37.817 1.00 25.61 H new ATOM 0 HG22 ILE B 9 12.741 -17.116 38.612 1.00 25.61 H new ATOM 0 HG23 ILE B 9 14.109 -17.850 38.299 1.00 25.61 H new ATOM 0 HD11 ILE B 9 13.449 -21.914 38.719 1.00 27.56 H new ATOM 0 HD12 ILE B 9 12.080 -21.208 39.088 1.00 27.56 H new ATOM 0 HD13 ILE B 9 12.943 -20.675 37.871 1.00 27.56 H new ATOM 892 N PHE B 10 11.931 -16.449 41.596 1.00 29.57 N ATOM 893 CA PHE B 10 11.275 -15.154 41.752 1.00 29.44 C ATOM 894 C PHE B 10 12.101 -14.158 42.575 1.00 30.18 C ATOM 895 O PHE B 10 12.212 -12.983 42.207 1.00 29.29 O ATOM 896 CB PHE B 10 9.908 -15.317 42.415 1.00 29.45 C ATOM 897 CG PHE B 10 9.164 -14.026 42.567 1.00 27.98 C ATOM 898 CD1 PHE B 10 8.362 -13.544 41.539 1.00 29.01 C ATOM 899 CD2 PHE B 10 9.301 -13.263 43.723 1.00 26.65 C ATOM 900 CE1 PHE B 10 7.707 -12.315 41.658 1.00 26.88 C ATOM 901 CE2 PHE B 10 8.653 -12.039 43.849 1.00 25.16 C ATOM 902 CZ PHE B 10 7.855 -11.564 42.815 1.00 25.42 C ATOM 0 H PHE B 10 11.463 -17.123 41.854 1.00 29.57 H new ATOM 0 HA PHE B 10 11.178 -14.797 40.855 1.00 29.44 H new ATOM 0 HB2 PHE B 10 9.372 -15.932 41.890 1.00 29.45 H new ATOM 0 HB3 PHE B 10 10.026 -15.720 43.290 1.00 29.45 H new ATOM 0 HD1 PHE B 10 8.260 -14.045 40.762 1.00 29.01 H new ATOM 0 HD2 PHE B 10 9.832 -13.575 44.419 1.00 26.65 H new ATOM 0 HE1 PHE B 10 7.174 -12.002 40.964 1.00 26.88 H new ATOM 0 HE2 PHE B 10 8.754 -11.538 44.626 1.00 25.16 H new ATOM 0 HZ PHE B 10 7.422 -10.745 42.898 1.00 25.42 H new ATOM 903 N VAL B 11 12.669 -14.606 43.692 1.00 29.26 N ATOM 904 CA VAL B 11 13.463 -13.692 44.510 1.00 30.46 C ATOM 905 C VAL B 11 14.697 -13.183 43.760 1.00 29.53 C ATOM 906 O VAL B 11 15.013 -11.991 43.811 1.00 28.49 O ATOM 907 CB VAL B 11 13.933 -14.337 45.840 1.00 30.32 C ATOM 908 CG1 VAL B 11 12.737 -14.731 46.681 1.00 33.22 C ATOM 909 CG2 VAL B 11 14.814 -15.537 45.562 1.00 33.68 C ATOM 0 H VAL B 11 12.610 -15.411 43.988 1.00 29.26 H new ATOM 0 HA VAL B 11 12.871 -12.950 44.711 1.00 30.46 H new ATOM 0 HB VAL B 11 14.455 -13.687 46.336 1.00 30.32 H new ATOM 0 HG11 VAL B 11 13.042 -15.133 47.509 1.00 33.22 H new ATOM 0 HG12 VAL B 11 12.207 -13.943 46.880 1.00 33.22 H new ATOM 0 HG13 VAL B 11 12.194 -15.370 46.193 1.00 33.22 H new ATOM 0 HG21 VAL B 11 15.100 -15.930 46.401 1.00 33.68 H new ATOM 0 HG22 VAL B 11 14.315 -16.194 45.052 1.00 33.68 H new ATOM 0 HG23 VAL B 11 15.592 -15.257 45.055 1.00 33.68 H new ATOM 910 N GLN B 12 15.389 -14.086 43.072 1.00 28.81 N ATOM 911 CA GLN B 12 16.596 -13.730 42.323 1.00 30.72 C ATOM 912 C GLN B 12 16.319 -12.906 41.071 1.00 28.53 C ATOM 913 O GLN B 12 17.071 -11.992 40.745 1.00 28.12 O ATOM 914 CB GLN B 12 17.359 -14.990 41.887 1.00 31.61 C ATOM 915 CG GLN B 12 18.674 -14.689 41.144 1.00 36.11 C ATOM 916 CD GLN B 12 19.200 -15.863 40.314 1.00 38.51 C ATOM 917 OE1 GLN B 12 19.285 -16.995 40.793 1.00 39.24 O ATOM 918 NE2 GLN B 12 19.569 -15.585 39.066 1.00 38.01 N ATOM 0 H GLN B 12 15.176 -14.918 43.025 1.00 28.81 H new ATOM 0 HA GLN B 12 17.121 -13.191 42.935 1.00 30.72 H new ATOM 0 HB2 GLN B 12 17.555 -15.528 42.670 1.00 31.61 H new ATOM 0 HB3 GLN B 12 16.787 -15.523 41.313 1.00 31.61 H new ATOM 0 HG2 GLN B 12 18.538 -13.927 40.560 1.00 36.11 H new ATOM 0 HG3 GLN B 12 19.350 -14.433 41.791 1.00 36.11 H new ATOM 0 HE21 GLN B 12 19.496 -14.783 38.764 1.00 38.01 H new ATOM 0 HE22 GLN B 12 19.881 -16.207 38.561 1.00 38.01 H new ATOM 919 N LYS B 13 15.227 -13.208 40.382 1.00 27.95 N ATOM 920 CA LYS B 13 14.944 -12.526 39.128 1.00 27.90 C ATOM 921 C LYS B 13 13.722 -11.620 38.996 1.00 28.00 C ATOM 922 O LYS B 13 13.597 -10.905 37.998 1.00 28.60 O ATOM 923 CB LYS B 13 14.900 -13.574 38.018 1.00 28.21 C ATOM 924 CG LYS B 13 16.165 -14.426 37.934 1.00 30.59 C ATOM 925 CD LYS B 13 16.069 -15.449 36.811 1.00 32.85 C ATOM 926 CE LYS B 13 17.367 -16.237 36.674 1.00 33.37 C ATOM 927 NZ LYS B 13 17.267 -17.298 35.637 1.00 31.86 N ATOM 0 H LYS B 13 14.645 -13.795 40.618 1.00 27.95 H new ATOM 0 HA LYS B 13 15.669 -11.884 39.073 1.00 27.90 H new ATOM 0 HB2 LYS B 13 14.136 -14.155 38.161 1.00 28.21 H new ATOM 0 HB3 LYS B 13 14.762 -13.128 37.168 1.00 28.21 H new ATOM 0 HG2 LYS B 13 16.934 -13.853 37.788 1.00 30.59 H new ATOM 0 HG3 LYS B 13 16.307 -14.882 38.778 1.00 30.59 H new ATOM 0 HD2 LYS B 13 15.334 -16.058 36.986 1.00 32.85 H new ATOM 0 HD3 LYS B 13 15.871 -14.998 35.975 1.00 32.85 H new ATOM 0 HE2 LYS B 13 18.090 -15.631 36.447 1.00 33.37 H new ATOM 0 HE3 LYS B 13 17.592 -16.640 37.527 1.00 33.37 H new ATOM 0 HZ1 LYS B 13 18.074 -17.638 35.481 1.00 31.86 H new ATOM 0 HZ2 LYS B 13 16.724 -17.943 35.923 1.00 31.86 H new ATOM 0 HZ3 LYS B 13 16.943 -16.949 34.885 1.00 31.86 H new ATOM 928 N CYS B 14 12.835 -11.619 39.986 1.00 27.09 N ATOM 929 CA CYS B 14 11.621 -10.815 39.883 1.00 26.73 C ATOM 930 C CYS B 14 11.364 -9.818 40.998 1.00 25.91 C ATOM 931 O CYS B 14 10.870 -8.722 40.739 1.00 24.02 O ATOM 932 CB CYS B 14 10.402 -11.735 39.784 1.00 24.68 C ATOM 933 SG CYS B 14 10.600 -13.137 38.640 1.00 25.90 S ATOM 0 H CYS B 14 12.914 -12.069 40.715 1.00 27.09 H new ATOM 0 HA CYS B 14 11.766 -10.282 39.086 1.00 26.73 H new ATOM 0 HB2 CYS B 14 10.200 -12.080 40.668 1.00 24.68 H new ATOM 0 HB3 CYS B 14 9.637 -11.209 39.503 1.00 24.68 H new ATOM 934 N ALA B 15 11.685 -10.212 42.229 1.00 26.98 N ATOM 935 CA ALA B 15 11.450 -9.385 43.413 1.00 28.24 C ATOM 936 C ALA B 15 11.920 -7.940 43.323 1.00 27.60 C ATOM 937 O ALA B 15 11.299 -7.053 43.901 1.00 28.01 O ATOM 938 CB ALA B 15 12.064 -10.053 44.648 1.00 28.32 C ATOM 0 H ALA B 15 12.048 -10.972 42.402 1.00 26.98 H new ATOM 0 HA ALA B 15 10.484 -9.328 43.482 1.00 28.24 H new ATOM 0 HB1 ALA B 15 11.904 -9.500 45.428 1.00 28.32 H new ATOM 0 HB2 ALA B 15 11.658 -10.924 44.781 1.00 28.32 H new ATOM 0 HB3 ALA B 15 13.019 -10.159 44.517 1.00 28.32 H new ATOM 939 N GLN B 16 13.014 -7.704 42.610 1.00 29.40 N ATOM 940 CA GLN B 16 13.544 -6.351 42.460 1.00 32.18 C ATOM 941 C GLN B 16 12.457 -5.403 41.961 1.00 30.62 C ATOM 942 O GLN B 16 12.389 -4.241 42.369 1.00 31.45 O ATOM 943 CB GLN B 16 14.693 -6.305 41.441 1.00 36.39 C ATOM 944 CG GLN B 16 15.817 -7.313 41.618 1.00 43.40 C ATOM 945 CD GLN B 16 15.439 -8.726 41.187 1.00 45.06 C ATOM 946 OE1 GLN B 16 14.916 -9.520 41.982 1.00 43.17 O ATOM 947 NE2 GLN B 16 15.699 -9.045 39.917 1.00 45.39 N ATOM 0 H GLN B 16 13.466 -8.313 42.204 1.00 29.40 H new ATOM 0 HA GLN B 16 13.866 -6.080 43.334 1.00 32.18 H new ATOM 0 HB2 GLN B 16 14.315 -6.428 40.556 1.00 36.39 H new ATOM 0 HB3 GLN B 16 15.080 -5.416 41.464 1.00 36.39 H new ATOM 0 HG2 GLN B 16 16.587 -7.021 41.106 1.00 43.40 H new ATOM 0 HG3 GLN B 16 16.085 -7.328 42.550 1.00 43.40 H new ATOM 0 HE21 GLN B 16 16.063 -8.467 39.394 1.00 45.39 H new ATOM 0 HE22 GLN B 16 15.502 -9.828 39.622 1.00 45.39 H new ATOM 948 N CYS B 17 11.602 -5.906 41.080 1.00 27.66 N ATOM 949 CA CYS B 17 10.563 -5.076 40.492 1.00 26.34 C ATOM 950 C CYS B 17 9.120 -5.387 40.848 1.00 27.16 C ATOM 951 O CYS B 17 8.234 -4.577 40.559 1.00 25.88 O ATOM 952 CB CYS B 17 10.697 -5.120 38.971 1.00 26.56 C ATOM 953 SG CYS B 17 12.323 -4.577 38.364 1.00 26.80 S ATOM 0 H CYS B 17 11.607 -6.723 40.811 1.00 27.66 H new ATOM 0 HA CYS B 17 10.724 -4.202 40.880 1.00 26.34 H new ATOM 0 HB2 CYS B 17 10.533 -6.026 38.666 1.00 26.56 H new ATOM 0 HB3 CYS B 17 10.010 -4.559 38.577 1.00 26.56 H new ATOM 954 N HIS B 18 8.875 -6.538 41.471 1.00 25.70 N ATOM 955 CA HIS B 18 7.507 -6.940 41.792 1.00 27.47 C ATOM 956 C HIS B 18 7.305 -7.486 43.209 1.00 27.97 C ATOM 957 O HIS B 18 8.197 -8.113 43.780 1.00 28.44 O ATOM 958 CB HIS B 18 7.041 -8.054 40.829 1.00 26.96 C ATOM 959 CG HIS B 18 6.998 -7.672 39.378 1.00 27.30 C ATOM 960 ND1 HIS B 18 5.931 -7.003 38.812 1.00 26.07 N ATOM 961 CD2 HIS B 18 7.841 -7.963 38.356 1.00 25.26 C ATOM 962 CE1 HIS B 18 6.115 -6.906 37.507 1.00 24.11 C ATOM 963 NE2 HIS B 18 7.266 -7.481 37.204 1.00 24.45 N ATOM 0 H HIS B 18 9.482 -7.097 41.715 1.00 25.70 H new ATOM 0 HA HIS B 18 6.994 -6.121 41.708 1.00 27.47 H new ATOM 0 HB2 HIS B 18 7.632 -8.816 40.930 1.00 26.96 H new ATOM 0 HB3 HIS B 18 6.155 -8.344 41.098 1.00 26.96 H new ATOM 0 HD1 HIS B 18 5.252 -6.697 39.242 1.00 26.07 H new ATOM 0 HD2 HIS B 18 8.656 -8.406 38.422 1.00 25.26 H new ATOM 0 HE1 HIS B 18 5.533 -6.502 36.904 1.00 24.11 H new ATOM 964 N THR B 19 6.115 -7.250 43.754 1.00 28.92 N ATOM 965 CA THR B 19 5.721 -7.796 45.055 1.00 29.00 C ATOM 966 C THR B 19 4.559 -8.692 44.647 1.00 29.87 C ATOM 967 O THR B 19 3.987 -8.496 43.577 1.00 30.20 O ATOM 968 CB THR B 19 5.193 -6.729 46.034 1.00 27.44 C ATOM 969 OG1 THR B 19 4.140 -5.987 45.410 1.00 28.43 O ATOM 970 CG2 THR B 19 6.309 -5.794 46.470 1.00 26.73 C ATOM 0 H THR B 19 5.510 -6.767 43.380 1.00 28.92 H new ATOM 0 HA THR B 19 6.462 -8.218 45.517 1.00 29.00 H new ATOM 0 HB THR B 19 4.849 -7.174 46.824 1.00 27.44 H new ATOM 0 HG1 THR B 19 4.354 -5.176 45.371 1.00 28.43 H new ATOM 0 HG21 THR B 19 5.955 -5.132 47.084 1.00 26.73 H new ATOM 0 HG22 THR B 19 7.005 -6.305 46.912 1.00 26.73 H new ATOM 0 HG23 THR B 19 6.680 -5.348 45.693 1.00 26.73 H new ATOM 971 N VAL B 20 4.202 -9.663 45.477 1.00 31.75 N ATOM 972 CA VAL B 20 3.120 -10.575 45.130 1.00 34.07 C ATOM 973 C VAL B 20 1.966 -10.624 46.125 1.00 36.13 C ATOM 974 O VAL B 20 0.866 -11.060 45.778 1.00 34.27 O ATOM 975 CB VAL B 20 3.655 -12.020 44.960 1.00 32.90 C ATOM 976 CG1 VAL B 20 4.562 -12.107 43.743 1.00 33.99 C ATOM 977 CG2 VAL B 20 4.419 -12.442 46.207 1.00 32.85 C ATOM 0 H VAL B 20 4.570 -9.811 46.240 1.00 31.75 H new ATOM 0 HA VAL B 20 2.769 -10.216 44.300 1.00 34.07 H new ATOM 0 HB VAL B 20 2.902 -12.618 44.832 1.00 32.90 H new ATOM 0 HG11 VAL B 20 4.890 -13.015 43.648 1.00 33.99 H new ATOM 0 HG12 VAL B 20 4.063 -11.859 42.949 1.00 33.99 H new ATOM 0 HG13 VAL B 20 5.313 -11.503 43.855 1.00 33.99 H new ATOM 0 HG21 VAL B 20 4.750 -13.347 46.093 1.00 32.85 H new ATOM 0 HG22 VAL B 20 5.166 -11.840 46.348 1.00 32.85 H new ATOM 0 HG23 VAL B 20 3.828 -12.409 46.975 1.00 32.85 H new ATOM 978 N GLU B 21 2.204 -10.185 47.358 1.00 37.09 N ATOM 979 CA GLU B 21 1.153 -10.247 48.368 1.00 39.88 C ATOM 980 C GLU B 21 0.021 -9.260 48.136 1.00 39.64 C ATOM 981 O GLU B 21 0.176 -8.260 47.430 1.00 39.54 O ATOM 982 CB GLU B 21 1.734 -10.056 49.778 1.00 41.75 C ATOM 983 CG GLU B 21 2.152 -8.634 50.141 1.00 47.82 C ATOM 984 CD GLU B 21 3.459 -8.204 49.496 1.00 51.65 C ATOM 985 OE1 GLU B 21 3.908 -7.068 49.766 1.00 54.03 O ATOM 986 OE2 GLU B 21 4.040 -8.995 48.721 1.00 54.58 O ATOM 0 H GLU B 21 2.951 -9.854 47.626 1.00 37.09 H new ATOM 0 HA GLU B 21 0.769 -11.134 48.289 1.00 39.88 H new ATOM 0 HB2 GLU B 21 1.075 -10.355 50.424 1.00 41.75 H new ATOM 0 HB3 GLU B 21 2.506 -10.635 49.872 1.00 41.75 H new ATOM 0 HG2 GLU B 21 1.450 -8.020 49.874 1.00 47.82 H new ATOM 0 HG3 GLU B 21 2.237 -8.565 51.105 1.00 47.82 H new ATOM 987 N LYS B 22 -1.129 -9.561 48.730 1.00 41.42 N ATOM 988 CA LYS B 22 -2.302 -8.706 48.613 1.00 41.58 C ATOM 989 C LYS B 22 -1.975 -7.387 49.288 1.00 41.36 C ATOM 990 O LYS B 22 -1.479 -7.364 50.415 1.00 41.45 O ATOM 991 CB LYS B 22 -3.503 -9.359 49.299 1.00 42.87 C ATOM 992 CG LYS B 22 -4.815 -8.615 49.097 1.00 45.12 C ATOM 993 CD LYS B 22 -5.958 -9.285 49.855 1.00 46.54 C ATOM 994 CE LYS B 22 -7.298 -8.633 49.533 1.00 47.76 C ATOM 995 NZ LYS B 22 -7.297 -7.163 49.800 1.00 48.68 N ATOM 0 H LYS B 22 -1.250 -10.264 49.210 1.00 41.42 H new ATOM 0 HA LYS B 22 -2.528 -8.567 47.680 1.00 41.58 H new ATOM 0 HB2 LYS B 22 -3.601 -10.264 48.965 1.00 42.87 H new ATOM 0 HB3 LYS B 22 -3.323 -9.425 50.250 1.00 42.87 H new ATOM 0 HG2 LYS B 22 -4.718 -7.698 49.398 1.00 45.12 H new ATOM 0 HG3 LYS B 22 -5.028 -8.582 48.151 1.00 45.12 H new ATOM 0 HD2 LYS B 22 -5.992 -10.227 49.626 1.00 46.54 H new ATOM 0 HD3 LYS B 22 -5.791 -9.231 50.809 1.00 46.54 H new ATOM 0 HE2 LYS B 22 -7.515 -8.789 48.601 1.00 47.76 H new ATOM 0 HE3 LYS B 22 -7.995 -9.054 50.061 1.00 47.76 H new ATOM 0 HZ1 LYS B 22 -8.121 -6.842 49.697 1.00 48.68 H new ATOM 0 HZ2 LYS B 22 -7.022 -7.013 50.633 1.00 48.68 H new ATOM 0 HZ3 LYS B 22 -6.747 -6.758 49.229 1.00 48.68 H new ATOM 996 N GLY B 23 -2.248 -6.289 48.598 1.00 41.95 N ATOM 997 CA GLY B 23 -1.950 -4.988 49.161 1.00 41.77 C ATOM 998 C GLY B 23 -0.486 -4.673 48.933 1.00 42.33 C ATOM 999 O GLY B 23 0.024 -3.649 49.390 1.00 41.94 O ATOM 0 H GLY B 23 -2.601 -6.277 47.814 1.00 41.95 H new ATOM 0 HA2 GLY B 23 -2.507 -4.309 48.748 1.00 41.77 H new ATOM 0 HA3 GLY B 23 -2.150 -4.980 50.110 1.00 41.77 H new ATOM 1000 N GLY B 24 0.193 -5.568 48.221 1.00 41.82 N ATOM 1001 CA GLY B 24 1.600 -5.373 47.930 1.00 40.15 C ATOM 1002 C GLY B 24 1.843 -4.058 47.213 1.00 39.30 C ATOM 1003 O GLY B 24 1.033 -3.609 46.404 1.00 39.42 O ATOM 0 H GLY B 24 -0.145 -6.291 47.900 1.00 41.82 H new ATOM 0 HA2 GLY B 24 2.108 -5.391 48.756 1.00 40.15 H new ATOM 0 HA3 GLY B 24 1.923 -6.106 47.383 1.00 40.15 H new ATOM 1004 N LYS B 25 2.977 -3.443 47.515 1.00 38.83 N ATOM 1005 CA LYS B 25 3.358 -2.166 46.931 1.00 37.43 C ATOM 1006 C LYS B 25 3.786 -2.266 45.462 1.00 34.85 C ATOM 1007 O LYS B 25 4.308 -3.293 45.023 1.00 32.32 O ATOM 1008 CB LYS B 25 4.505 -1.583 47.758 1.00 40.46 C ATOM 1009 CG LYS B 25 4.999 -0.225 47.315 1.00 46.09 C ATOM 1010 CD LYS B 25 6.156 0.246 48.195 1.00 50.94 C ATOM 1011 CE LYS B 25 5.748 0.347 49.669 1.00 53.75 C ATOM 1012 NZ LYS B 25 4.665 1.351 49.912 1.00 55.75 N ATOM 0 H LYS B 25 3.553 -3.758 48.070 1.00 38.83 H new ATOM 0 HA LYS B 25 2.575 -1.593 46.947 1.00 37.43 H new ATOM 0 HB2 LYS B 25 4.218 -1.520 48.682 1.00 40.46 H new ATOM 0 HB3 LYS B 25 5.249 -2.205 47.734 1.00 40.46 H new ATOM 0 HG2 LYS B 25 5.287 -0.267 46.390 1.00 46.09 H new ATOM 0 HG3 LYS B 25 4.273 0.417 47.357 1.00 46.09 H new ATOM 0 HD2 LYS B 25 6.900 -0.370 48.107 1.00 50.94 H new ATOM 0 HD3 LYS B 25 6.466 1.111 47.885 1.00 50.94 H new ATOM 0 HE2 LYS B 25 5.450 -0.523 49.977 1.00 53.75 H new ATOM 0 HE3 LYS B 25 6.525 0.584 50.199 1.00 53.75 H new ATOM 0 HZ1 LYS B 25 4.497 1.401 50.785 1.00 55.75 H new ATOM 0 HZ2 LYS B 25 4.926 2.148 49.614 1.00 55.75 H new ATOM 0 HZ3 LYS B 25 3.927 1.102 49.482 1.00 55.75 H new ATOM 1013 N HIS B 26 3.549 -1.199 44.705 1.00 32.34 N ATOM 1014 CA HIS B 26 3.981 -1.157 43.312 1.00 31.03 C ATOM 1015 C HIS B 26 5.428 -0.699 43.409 1.00 30.73 C ATOM 1016 O HIS B 26 5.772 0.084 44.298 1.00 30.00 O ATOM 1017 CB HIS B 26 3.205 -0.116 42.495 1.00 32.07 C ATOM 1018 CG HIS B 26 1.793 -0.502 42.183 1.00 34.77 C ATOM 1019 ND1 HIS B 26 1.439 -1.770 41.775 1.00 35.67 N ATOM 1020 CD2 HIS B 26 0.650 0.223 42.188 1.00 34.46 C ATOM 1021 CE1 HIS B 26 0.139 -1.811 41.545 1.00 35.33 C ATOM 1022 NE2 HIS B 26 -0.364 -0.614 41.787 1.00 35.91 N ATOM 0 H HIS B 26 3.142 -0.492 44.977 1.00 32.34 H new ATOM 0 HA HIS B 26 3.847 -2.012 42.875 1.00 31.03 H new ATOM 0 HB2 HIS B 26 3.199 0.723 42.982 1.00 32.07 H new ATOM 0 HB3 HIS B 26 3.677 0.043 41.662 1.00 32.07 H new ATOM 0 HD2 HIS B 26 0.566 1.120 42.419 1.00 34.46 H new ATOM 0 HE1 HIS B 26 -0.340 -2.556 41.261 1.00 35.33 H new ATOM 0 HE2 HIS B 26 -1.191 -0.394 41.707 1.00 35.91 H new ATOM 1023 N LYS B 27 6.275 -1.189 42.513 1.00 28.08 N ATOM 1024 CA LYS B 27 7.679 -0.798 42.494 1.00 26.67 C ATOM 1025 C LYS B 27 7.969 -0.458 41.042 1.00 26.15 C ATOM 1026 O LYS B 27 7.154 0.194 40.396 1.00 25.35 O ATOM 1027 CB LYS B 27 8.552 -1.956 42.979 1.00 27.16 C ATOM 1028 CG LYS B 27 8.205 -2.392 44.393 1.00 29.37 C ATOM 1029 CD LYS B 27 8.998 -3.616 44.831 1.00 32.89 C ATOM 1030 CE LYS B 27 10.482 -3.317 45.007 1.00 31.72 C ATOM 1031 NZ LYS B 27 11.191 -4.508 45.570 1.00 31.36 N ATOM 0 H LYS B 27 6.055 -1.754 41.903 1.00 28.08 H new ATOM 0 HA LYS B 27 7.868 -0.048 43.079 1.00 26.67 H new ATOM 0 HB2 LYS B 27 8.449 -2.709 42.377 1.00 27.16 H new ATOM 0 HB3 LYS B 27 9.484 -1.691 42.945 1.00 27.16 H new ATOM 0 HG2 LYS B 27 8.378 -1.661 45.006 1.00 29.37 H new ATOM 0 HG3 LYS B 27 7.256 -2.588 44.445 1.00 29.37 H new ATOM 0 HD2 LYS B 27 8.637 -3.950 45.667 1.00 32.89 H new ATOM 0 HD3 LYS B 27 8.889 -4.321 44.174 1.00 32.89 H new ATOM 0 HE2 LYS B 27 10.873 -3.075 44.153 1.00 31.72 H new ATOM 0 HE3 LYS B 27 10.597 -2.556 45.597 1.00 31.72 H new ATOM 0 HZ1 LYS B 27 12.043 -4.302 45.722 1.00 31.36 H new ATOM 0 HZ2 LYS B 27 10.804 -4.750 46.334 1.00 31.36 H new ATOM 0 HZ3 LYS B 27 11.148 -5.181 44.989 1.00 31.36 H new ATOM 1032 N THR B 28 9.116 -0.872 40.520 1.00 25.61 N ATOM 1033 CA THR B 28 9.390 -0.599 39.119 1.00 26.96 C ATOM 1034 C THR B 28 8.239 -1.241 38.340 1.00 26.18 C ATOM 1035 O THR B 28 7.685 -0.643 37.422 1.00 24.95 O ATOM 1036 CB THR B 28 10.712 -1.225 38.664 1.00 27.54 C ATOM 1037 OG1 THR B 28 11.790 -0.651 39.407 1.00 26.87 O ATOM 1038 CG2 THR B 28 10.940 -0.957 37.178 1.00 28.53 C ATOM 0 H THR B 28 9.730 -1.299 40.944 1.00 25.61 H new ATOM 0 HA THR B 28 9.463 0.357 38.970 1.00 26.96 H new ATOM 0 HB THR B 28 10.673 -2.182 38.816 1.00 27.54 H new ATOM 0 HG1 THR B 28 12.085 -1.216 39.954 1.00 26.87 H new ATOM 0 HG21 THR B 28 11.779 -1.358 36.902 1.00 28.53 H new ATOM 0 HG22 THR B 28 10.213 -1.343 36.664 1.00 28.53 H new ATOM 0 HG23 THR B 28 10.973 -0.000 37.023 1.00 28.53 H new ATOM 1039 N GLY B 29 7.885 -2.459 38.741 1.00 26.25 N ATOM 1040 CA GLY B 29 6.806 -3.188 38.103 1.00 27.51 C ATOM 1041 C GLY B 29 5.561 -3.200 38.971 1.00 28.30 C ATOM 1042 O GLY B 29 5.605 -2.782 40.131 1.00 28.71 O ATOM 0 H GLY B 29 8.264 -2.880 39.388 1.00 26.25 H new ATOM 0 HA2 GLY B 29 6.601 -2.783 37.246 1.00 27.51 H new ATOM 0 HA3 GLY B 29 7.088 -4.099 37.926 1.00 27.51 H new ATOM 1043 N PRO B 30 4.427 -3.683 38.446 1.00 27.97 N ATOM 1044 CA PRO B 30 3.192 -3.714 39.233 1.00 28.82 C ATOM 1045 C PRO B 30 3.104 -4.843 40.247 1.00 28.13 C ATOM 1046 O PRO B 30 3.706 -5.902 40.071 1.00 24.96 O ATOM 1047 CB PRO B 30 2.116 -3.853 38.160 1.00 28.77 C ATOM 1048 CG PRO B 30 2.790 -4.748 37.169 1.00 29.20 C ATOM 1049 CD PRO B 30 4.177 -4.139 37.067 1.00 28.46 C ATOM 0 HA PRO B 30 3.114 -2.924 39.790 1.00 28.82 H new ATOM 0 HB2 PRO B 30 1.301 -4.246 38.510 1.00 28.77 H new ATOM 0 HB3 PRO B 30 1.875 -2.997 37.773 1.00 28.77 H new ATOM 0 HG2 PRO B 30 2.821 -5.668 37.476 1.00 29.20 H new ATOM 0 HG3 PRO B 30 2.332 -4.749 36.314 1.00 29.20 H new ATOM 0 HD2 PRO B 30 4.836 -4.789 36.776 1.00 28.46 H new ATOM 0 HD3 PRO B 30 4.203 -3.405 36.433 1.00 28.46 H new ATOM 1050 N ASN B 31 2.348 -4.610 41.315 1.00 28.46 N ATOM 1051 CA ASN B 31 2.143 -5.656 42.305 1.00 29.17 C ATOM 1052 C ASN B 31 1.442 -6.783 41.538 1.00 28.11 C ATOM 1053 O ASN B 31 0.583 -6.522 40.696 1.00 26.58 O ATOM 1054 CB ASN B 31 1.266 -5.150 43.450 1.00 29.33 C ATOM 1055 CG ASN B 31 0.672 -6.276 44.256 1.00 29.57 C ATOM 1056 OD1 ASN B 31 -0.457 -6.700 44.008 1.00 31.28 O ATOM 1057 ND2 ASN B 31 1.438 -6.788 45.208 1.00 29.54 N ATOM 0 H ASN B 31 1.951 -3.865 41.482 1.00 28.46 H new ATOM 0 HA ASN B 31 2.975 -5.950 42.708 1.00 29.17 H new ATOM 0 HB2 ASN B 31 1.794 -4.582 44.032 1.00 29.33 H new ATOM 0 HB3 ASN B 31 0.552 -4.601 43.090 1.00 29.33 H new ATOM 0 HD21 ASN B 31 1.152 -7.445 45.683 1.00 29.54 H new ATOM 0 HD22 ASN B 31 2.222 -6.463 45.350 1.00 29.54 H new ATOM 1058 N LEU B 32 1.803 -8.029 41.828 1.00 28.24 N ATOM 1059 CA LEU B 32 1.239 -9.175 41.109 1.00 28.74 C ATOM 1060 C LEU B 32 0.097 -9.957 41.760 1.00 29.39 C ATOM 1061 O LEU B 32 -0.322 -10.991 41.235 1.00 27.50 O ATOM 1062 CB LEU B 32 2.364 -10.151 40.772 1.00 26.24 C ATOM 1063 CG LEU B 32 3.504 -9.551 39.950 1.00 23.97 C ATOM 1064 CD1 LEU B 32 4.605 -10.586 39.754 1.00 24.58 C ATOM 1065 CD2 LEU B 32 2.950 -9.084 38.612 1.00 22.32 C ATOM 0 H LEU B 32 2.373 -8.236 42.438 1.00 28.24 H new ATOM 0 HA LEU B 32 0.822 -8.765 40.335 1.00 28.74 H new ATOM 0 HB2 LEU B 32 2.728 -10.504 41.599 1.00 26.24 H new ATOM 0 HB3 LEU B 32 1.990 -10.901 40.284 1.00 26.24 H new ATOM 0 HG LEU B 32 3.888 -8.792 40.416 1.00 23.97 H new ATOM 0 HD11 LEU B 32 5.325 -10.198 39.232 1.00 24.58 H new ATOM 0 HD12 LEU B 32 4.946 -10.863 40.619 1.00 24.58 H new ATOM 0 HD13 LEU B 32 4.246 -11.356 39.287 1.00 24.58 H new ATOM 0 HD21 LEU B 32 3.666 -8.701 38.081 1.00 22.32 H new ATOM 0 HD22 LEU B 32 2.566 -9.839 38.139 1.00 22.32 H new ATOM 0 HD23 LEU B 32 2.265 -8.414 38.761 1.00 22.32 H new ATOM 1066 N HIS B 33 -0.415 -9.475 42.886 1.00 31.04 N ATOM 1067 CA HIS B 33 -1.491 -10.185 43.557 1.00 31.72 C ATOM 1068 C HIS B 33 -2.721 -10.383 42.679 1.00 32.02 C ATOM 1069 O HIS B 33 -3.229 -9.438 42.086 1.00 32.84 O ATOM 1070 CB HIS B 33 -1.894 -9.465 44.839 1.00 34.82 C ATOM 1071 CG HIS B 33 -2.959 -10.180 45.605 1.00 34.37 C ATOM 1072 ND1 HIS B 33 -4.298 -9.888 45.466 1.00 34.76 N ATOM 1073 CD2 HIS B 33 -2.887 -11.225 46.464 1.00 34.84 C ATOM 1074 CE1 HIS B 33 -5.005 -10.722 46.207 1.00 37.26 C ATOM 1075 NE2 HIS B 33 -4.173 -11.543 46.822 1.00 34.70 N ATOM 0 H HIS B 33 -0.158 -8.751 43.272 1.00 31.04 H new ATOM 0 HA HIS B 33 -1.140 -11.065 43.766 1.00 31.72 H new ATOM 0 HB2 HIS B 33 -1.112 -9.360 45.404 1.00 34.82 H new ATOM 0 HB3 HIS B 33 -2.206 -8.573 44.618 1.00 34.82 H new ATOM 0 HD2 HIS B 33 -2.112 -11.647 46.756 1.00 34.84 H new ATOM 0 HE1 HIS B 33 -5.932 -10.730 46.283 1.00 37.26 H new ATOM 0 HE2 HIS B 33 -4.400 -12.175 47.360 1.00 34.70 H new ATOM 1076 N GLY B 34 -3.185 -11.627 42.604 1.00 32.34 N ATOM 1077 CA GLY B 34 -4.355 -11.950 41.806 1.00 33.86 C ATOM 1078 C GLY B 34 -4.037 -12.064 40.328 1.00 33.64 C ATOM 1079 O GLY B 34 -4.926 -11.987 39.478 1.00 33.25 O ATOM 0 H GLY B 34 -2.833 -12.298 43.010 1.00 32.34 H new ATOM 0 HA2 GLY B 34 -4.734 -12.787 42.118 1.00 33.86 H new ATOM 0 HA3 GLY B 34 -5.031 -11.266 41.937 1.00 33.86 H new ATOM 1080 N LEU B 35 -2.761 -12.256 40.022 1.00 32.52 N ATOM 1081 CA LEU B 35 -2.319 -12.365 38.643 1.00 31.20 C ATOM 1082 C LEU B 35 -3.152 -13.323 37.799 1.00 30.50 C ATOM 1083 O LEU B 35 -3.614 -12.961 36.714 1.00 28.38 O ATOM 1084 CB LEU B 35 -0.850 -12.794 38.597 1.00 32.44 C ATOM 1085 CG LEU B 35 -0.199 -12.848 37.212 1.00 32.00 C ATOM 1086 CD1 LEU B 35 -0.318 -11.493 36.536 1.00 33.96 C ATOM 1087 CD2 LEU B 35 1.259 -13.251 37.356 1.00 30.85 C ATOM 0 H LEU B 35 -2.132 -12.326 40.604 1.00 32.52 H new ATOM 0 HA LEU B 35 -2.434 -11.483 38.256 1.00 31.20 H new ATOM 0 HB2 LEU B 35 -0.338 -12.184 39.150 1.00 32.44 H new ATOM 0 HB3 LEU B 35 -0.777 -13.673 39.002 1.00 32.44 H new ATOM 0 HG LEU B 35 -0.652 -13.506 36.662 1.00 32.00 H new ATOM 0 HD11 LEU B 35 0.095 -11.531 35.659 1.00 33.96 H new ATOM 0 HD12 LEU B 35 -1.255 -11.259 36.442 1.00 33.96 H new ATOM 0 HD13 LEU B 35 0.129 -10.822 37.075 1.00 33.96 H new ATOM 0 HD21 LEU B 35 1.673 -13.286 36.480 1.00 30.85 H new ATOM 0 HD22 LEU B 35 1.722 -12.600 37.906 1.00 30.85 H new ATOM 0 HD23 LEU B 35 1.314 -14.125 37.774 1.00 30.85 H new ATOM 1088 N PHE B 36 -3.351 -14.542 38.287 1.00 29.70 N ATOM 1089 CA PHE B 36 -4.115 -15.518 37.519 1.00 30.51 C ATOM 1090 C PHE B 36 -5.566 -15.087 37.362 1.00 31.63 C ATOM 1091 O PHE B 36 -6.283 -14.892 38.345 1.00 31.76 O ATOM 1092 CB PHE B 36 -4.019 -16.905 38.162 1.00 29.77 C ATOM 1093 CG PHE B 36 -2.663 -17.538 38.021 1.00 27.95 C ATOM 1094 CD1 PHE B 36 -1.566 -17.029 38.711 1.00 29.07 C ATOM 1095 CD2 PHE B 36 -2.475 -18.628 37.174 1.00 27.80 C ATOM 1096 CE1 PHE B 36 -0.301 -17.594 38.562 1.00 28.06 C ATOM 1097 CE2 PHE B 36 -1.216 -19.202 37.015 1.00 27.34 C ATOM 1098 CZ PHE B 36 -0.127 -18.687 37.708 1.00 29.31 C ATOM 0 H PHE B 36 -3.059 -14.821 39.046 1.00 29.70 H new ATOM 0 HA PHE B 36 -3.729 -15.568 36.631 1.00 30.51 H new ATOM 0 HB2 PHE B 36 -4.238 -16.833 39.104 1.00 29.77 H new ATOM 0 HB3 PHE B 36 -4.683 -17.487 37.760 1.00 29.77 H new ATOM 0 HD1 PHE B 36 -1.679 -16.302 39.279 1.00 29.07 H new ATOM 0 HD2 PHE B 36 -3.200 -18.977 36.708 1.00 27.80 H new ATOM 0 HE1 PHE B 36 0.424 -17.246 39.029 1.00 28.06 H new ATOM 0 HE2 PHE B 36 -1.104 -19.929 36.446 1.00 27.34 H new ATOM 0 HZ PHE B 36 0.715 -19.068 37.604 1.00 29.31 H new ATOM 1099 N GLY B 37 -5.979 -14.921 36.109 1.00 31.37 N ATOM 1100 CA GLY B 37 -7.331 -14.495 35.816 1.00 34.15 C ATOM 1101 C GLY B 37 -7.381 -12.993 35.603 1.00 36.08 C ATOM 1102 O GLY B 37 -8.372 -12.458 35.108 1.00 36.12 O ATOM 0 H GLY B 37 -5.486 -15.052 35.416 1.00 31.37 H new ATOM 0 HA2 GLY B 37 -7.655 -14.950 35.023 1.00 34.15 H new ATOM 0 HA3 GLY B 37 -7.920 -14.743 36.546 1.00 34.15 H new ATOM 1103 N ARG B 38 -6.306 -12.308 35.983 1.00 36.20 N ATOM 1104 CA ARG B 38 -6.236 -10.862 35.822 1.00 36.84 C ATOM 1105 C ARG B 38 -5.842 -10.588 34.379 1.00 36.61 C ATOM 1106 O ARG B 38 -5.073 -11.340 33.782 1.00 36.08 O ATOM 1107 CB ARG B 38 -5.196 -10.270 36.785 1.00 39.35 C ATOM 1108 CG ARG B 38 -5.377 -8.784 37.083 1.00 39.66 C ATOM 1109 CD ARG B 38 -4.460 -8.320 38.226 1.00 40.20 C ATOM 1110 NE ARG B 38 -3.084 -8.079 37.791 1.00 38.23 N ATOM 1111 CZ ARG B 38 -2.063 -7.855 38.615 1.00 40.40 C ATOM 1112 NH1 ARG B 38 -0.844 -7.640 38.123 1.00 37.49 N ATOM 1113 NH2 ARG B 38 -2.254 -7.858 39.933 1.00 38.66 N ATOM 0 H ARG B 38 -5.607 -12.663 36.336 1.00 36.20 H new ATOM 0 HA ARG B 38 -7.091 -10.451 36.025 1.00 36.84 H new ATOM 0 HB2 ARG B 38 -5.230 -10.762 37.621 1.00 39.35 H new ATOM 0 HB3 ARG B 38 -4.312 -10.407 36.411 1.00 39.35 H new ATOM 0 HG2 ARG B 38 -5.186 -8.268 36.284 1.00 39.66 H new ATOM 0 HG3 ARG B 38 -6.302 -8.611 37.319 1.00 39.66 H new ATOM 0 HD2 ARG B 38 -4.819 -7.506 38.612 1.00 40.20 H new ATOM 0 HD3 ARG B 38 -4.460 -8.991 38.927 1.00 40.20 H new ATOM 0 HE ARG B 38 -2.924 -8.082 36.946 1.00 38.23 H new ATOM 0 HH11 ARG B 38 -0.716 -7.646 37.273 1.00 37.49 H new ATOM 0 HH12 ARG B 38 -0.185 -7.495 38.656 1.00 37.49 H new ATOM 0 HH21 ARG B 38 -3.038 -8.005 40.253 1.00 38.66 H new ATOM 0 HH22 ARG B 38 -1.593 -7.713 40.464 1.00 38.66 H new ATOM 1114 N LYS B 39 -6.390 -9.523 33.812 1.00 36.11 N ATOM 1115 CA LYS B 39 -6.086 -9.168 32.440 1.00 35.88 C ATOM 1116 C LYS B 39 -4.887 -8.222 32.405 1.00 34.65 C ATOM 1117 O LYS B 39 -4.696 -7.421 33.321 1.00 33.35 O ATOM 1118 CB LYS B 39 -7.308 -8.513 31.800 1.00 38.31 C ATOM 1119 CG LYS B 39 -7.155 -8.210 30.330 1.00 40.07 C ATOM 1120 CD LYS B 39 -8.499 -8.261 29.641 1.00 40.88 C ATOM 1121 CE LYS B 39 -9.030 -9.684 29.590 1.00 40.48 C ATOM 1122 NZ LYS B 39 -8.193 -10.564 28.718 1.00 41.91 N ATOM 0 H LYS B 39 -6.941 -8.994 34.207 1.00 36.11 H new ATOM 0 HA LYS B 39 -5.862 -9.967 31.938 1.00 35.88 H new ATOM 0 HB2 LYS B 39 -8.074 -9.096 31.921 1.00 38.31 H new ATOM 0 HB3 LYS B 39 -7.502 -7.687 32.271 1.00 38.31 H new ATOM 0 HG2 LYS B 39 -6.758 -7.333 30.214 1.00 40.07 H new ATOM 0 HG3 LYS B 39 -6.551 -8.851 29.923 1.00 40.07 H new ATOM 0 HD2 LYS B 39 -9.129 -7.693 30.112 1.00 40.88 H new ATOM 0 HD3 LYS B 39 -8.418 -7.910 28.740 1.00 40.88 H new ATOM 0 HE2 LYS B 39 -9.056 -10.051 30.488 1.00 40.48 H new ATOM 0 HE3 LYS B 39 -9.942 -9.676 29.260 1.00 40.48 H new ATOM 0 HZ1 LYS B 39 -8.677 -10.842 28.024 1.00 41.91 H new ATOM 0 HZ2 LYS B 39 -7.488 -10.107 28.424 1.00 41.91 H new ATOM 0 HZ3 LYS B 39 -7.915 -11.268 29.186 1.00 41.91 H new ATOM 1123 N THR B 40 -4.075 -8.332 31.358 1.00 32.89 N ATOM 1124 CA THR B 40 -2.898 -7.479 31.212 1.00 33.09 C ATOM 1125 C THR B 40 -3.222 -6.015 31.482 1.00 33.19 C ATOM 1126 O THR B 40 -4.285 -5.527 31.112 1.00 31.91 O ATOM 1127 CB THR B 40 -2.286 -7.581 29.791 1.00 35.04 C ATOM 1128 OG1 THR B 40 -3.324 -7.456 28.809 1.00 37.72 O ATOM 1129 CG2 THR B 40 -1.570 -8.912 29.601 1.00 34.11 C ATOM 0 H THR B 40 -4.188 -8.896 30.719 1.00 32.89 H new ATOM 0 HA THR B 40 -2.258 -7.798 31.868 1.00 33.09 H new ATOM 0 HB THR B 40 -1.641 -6.864 29.684 1.00 35.04 H new ATOM 0 HG1 THR B 40 -3.680 -6.698 28.872 1.00 37.72 H new ATOM 0 HG21 THR B 40 -1.196 -8.954 28.707 1.00 34.11 H new ATOM 0 HG22 THR B 40 -0.857 -8.992 30.254 1.00 34.11 H new ATOM 0 HG23 THR B 40 -2.201 -9.639 29.721 1.00 34.11 H new ATOM 1130 N GLY B 41 -2.296 -5.331 32.147 1.00 34.00 N ATOM 1131 CA GLY B 41 -2.461 -3.922 32.456 1.00 34.87 C ATOM 1132 C GLY B 41 -3.660 -3.523 33.297 1.00 35.31 C ATOM 1133 O GLY B 41 -4.215 -2.454 33.085 1.00 34.45 O ATOM 0 H GLY B 41 -1.559 -5.672 32.429 1.00 34.00 H new ATOM 0 HA2 GLY B 41 -1.661 -3.621 32.914 1.00 34.87 H new ATOM 0 HA3 GLY B 41 -2.508 -3.436 31.618 1.00 34.87 H new ATOM 1134 N GLN B 42 -4.059 -4.346 34.261 1.00 38.75 N ATOM 1135 CA GLN B 42 -5.216 -3.989 35.076 1.00 41.32 C ATOM 1136 C GLN B 42 -4.959 -3.788 36.567 1.00 41.81 C ATOM 1137 O GLN B 42 -5.892 -3.517 37.322 1.00 42.66 O ATOM 1138 CB GLN B 42 -6.335 -5.013 34.877 1.00 44.63 C ATOM 1139 CG GLN B 42 -6.755 -5.181 33.418 1.00 49.72 C ATOM 1140 CD GLN B 42 -6.981 -3.853 32.708 1.00 52.64 C ATOM 1141 OE1 GLN B 42 -7.827 -3.052 33.114 1.00 55.20 O ATOM 1142 NE2 GLN B 42 -6.222 -3.615 31.639 1.00 53.86 N ATOM 0 H GLN B 42 -3.686 -5.096 34.457 1.00 38.75 H new ATOM 0 HA GLN B 42 -5.474 -3.112 34.752 1.00 41.32 H new ATOM 0 HB2 GLN B 42 -6.044 -5.871 35.223 1.00 44.63 H new ATOM 0 HB3 GLN B 42 -7.107 -4.744 35.399 1.00 44.63 H new ATOM 0 HG2 GLN B 42 -6.072 -5.683 32.946 1.00 49.72 H new ATOM 0 HG3 GLN B 42 -7.570 -5.706 33.379 1.00 49.72 H new ATOM 0 HE21 GLN B 42 -5.642 -4.197 31.385 1.00 53.86 H new ATOM 0 HE22 GLN B 42 -6.312 -2.879 31.203 1.00 53.86 H new ATOM 1143 N ALA B 43 -3.711 -3.916 37.003 1.00 40.76 N ATOM 1144 CA ALA B 43 -3.404 -3.697 38.411 1.00 40.11 C ATOM 1145 C ALA B 43 -3.686 -2.217 38.693 1.00 40.23 C ATOM 1146 O ALA B 43 -3.076 -1.331 38.094 1.00 38.94 O ATOM 1147 CB ALA B 43 -1.939 -4.024 38.697 1.00 39.91 C ATOM 0 H ALA B 43 -3.038 -4.125 36.510 1.00 40.76 H new ATOM 0 HA ALA B 43 -3.942 -4.271 38.979 1.00 40.11 H new ATOM 0 HB1 ALA B 43 -1.751 -3.873 39.637 1.00 39.91 H new ATOM 0 HB2 ALA B 43 -1.766 -4.953 38.478 1.00 39.91 H new ATOM 0 HB3 ALA B 43 -1.369 -3.454 38.158 1.00 39.91 H new ATOM 1148 N PRO B 44 -4.630 -1.933 39.601 1.00 41.06 N ATOM 1149 CA PRO B 44 -5.006 -0.560 39.965 1.00 40.40 C ATOM 1150 C PRO B 44 -3.856 0.271 40.534 1.00 38.38 C ATOM 1151 O PRO B 44 -3.138 -0.180 41.421 1.00 38.11 O ATOM 1152 CB PRO B 44 -6.112 -0.772 41.000 1.00 41.26 C ATOM 1153 CG PRO B 44 -6.693 -2.111 40.611 1.00 41.45 C ATOM 1154 CD PRO B 44 -5.459 -2.911 40.326 1.00 40.64 C ATOM 0 HA PRO B 44 -5.282 -0.047 39.189 1.00 40.40 H new ATOM 0 HB2 PRO B 44 -5.760 -0.783 41.904 1.00 41.26 H new ATOM 0 HB3 PRO B 44 -6.778 -0.068 40.963 1.00 41.26 H new ATOM 0 HG2 PRO B 44 -7.221 -2.500 41.326 1.00 41.45 H new ATOM 0 HG3 PRO B 44 -7.271 -2.045 39.835 1.00 41.45 H new ATOM 0 HD2 PRO B 44 -5.030 -3.221 41.139 1.00 40.64 H new ATOM 0 HD3 PRO B 44 -5.650 -3.696 39.789 1.00 40.64 H new ATOM 1155 N GLY B 45 -3.682 1.484 40.020 1.00 38.16 N ATOM 1156 CA GLY B 45 -2.629 2.347 40.531 1.00 37.37 C ATOM 1157 C GLY B 45 -1.266 2.250 39.865 1.00 36.78 C ATOM 1158 O GLY B 45 -0.338 2.954 40.259 1.00 36.17 O ATOM 0 H GLY B 45 -4.155 1.820 39.386 1.00 38.16 H new ATOM 0 HA2 GLY B 45 -2.933 3.266 40.461 1.00 37.37 H new ATOM 0 HA3 GLY B 45 -2.516 2.157 41.475 1.00 37.37 H new ATOM 1159 N PHE B 46 -1.120 1.369 38.881 1.00 35.67 N ATOM 1160 CA PHE B 46 0.152 1.252 38.183 1.00 33.66 C ATOM 1161 C PHE B 46 -0.042 1.745 36.759 1.00 33.92 C ATOM 1162 O PHE B 46 -1.018 1.384 36.100 1.00 34.91 O ATOM 1163 CB PHE B 46 0.642 -0.197 38.147 1.00 32.06 C ATOM 1164 CG PHE B 46 2.006 -0.356 37.528 1.00 28.99 C ATOM 1165 CD1 PHE B 46 3.156 -0.156 38.284 1.00 28.64 C ATOM 1166 CD2 PHE B 46 2.140 -0.661 36.177 1.00 29.32 C ATOM 1167 CE1 PHE B 46 4.427 -0.256 37.708 1.00 26.74 C ATOM 1168 CE2 PHE B 46 3.405 -0.764 35.589 1.00 27.99 C ATOM 1169 CZ PHE B 46 4.552 -0.559 36.360 1.00 27.31 C ATOM 0 H PHE B 46 -1.737 0.837 38.606 1.00 35.67 H new ATOM 0 HA PHE B 46 0.816 1.781 38.652 1.00 33.66 H new ATOM 0 HB2 PHE B 46 0.663 -0.546 39.052 1.00 32.06 H new ATOM 0 HB3 PHE B 46 0.005 -0.734 37.650 1.00 32.06 H new ATOM 0 HD1 PHE B 46 3.079 0.048 39.188 1.00 28.64 H new ATOM 0 HD2 PHE B 46 1.380 -0.798 35.659 1.00 29.32 H new ATOM 0 HE1 PHE B 46 5.186 -0.120 38.227 1.00 26.74 H new ATOM 0 HE2 PHE B 46 3.483 -0.969 34.685 1.00 27.99 H new ATOM 0 HZ PHE B 46 5.394 -0.625 35.972 1.00 27.31 H new ATOM 1170 N THR B 47 0.883 2.576 36.292 1.00 32.63 N ATOM 1171 CA THR B 47 0.814 3.093 34.937 1.00 33.05 C ATOM 1172 C THR B 47 1.648 2.206 34.019 1.00 32.41 C ATOM 1173 O THR B 47 2.873 2.150 34.132 1.00 33.38 O ATOM 1174 CB THR B 47 1.344 4.543 34.854 1.00 35.20 C ATOM 1175 OG1 THR B 47 0.538 5.394 35.680 1.00 38.68 O ATOM 1176 CG2 THR B 47 1.287 5.047 33.422 1.00 35.01 C ATOM 0 H THR B 47 1.559 2.852 36.747 1.00 32.63 H new ATOM 0 HA THR B 47 -0.116 3.093 34.662 1.00 33.05 H new ATOM 0 HB THR B 47 2.265 4.555 35.160 1.00 35.20 H new ATOM 0 HG1 THR B 47 0.826 6.182 35.637 1.00 38.68 H new ATOM 0 HG21 THR B 47 1.622 5.957 33.385 1.00 35.01 H new ATOM 0 HG22 THR B 47 1.833 4.479 32.857 1.00 35.01 H new ATOM 0 HG23 THR B 47 0.369 5.028 33.108 1.00 35.01 H new ATOM 1177 N TYR B 48 0.961 1.514 33.117 1.00 30.64 N ATOM 1178 CA TYR B 48 1.578 0.603 32.158 1.00 29.51 C ATOM 1179 C TYR B 48 1.886 1.315 30.844 1.00 29.95 C ATOM 1180 O TYR B 48 1.485 2.457 30.632 1.00 31.23 O ATOM 1181 CB TYR B 48 0.610 -0.536 31.832 1.00 29.15 C ATOM 1182 CG TYR B 48 0.273 -1.463 32.975 1.00 30.48 C ATOM 1183 CD1 TYR B 48 0.912 -2.699 33.102 1.00 29.00 C ATOM 1184 CD2 TYR B 48 -0.707 -1.124 33.914 1.00 29.45 C ATOM 1185 CE1 TYR B 48 0.586 -3.577 34.128 1.00 29.36 C ATOM 1186 CE2 TYR B 48 -1.043 -1.999 34.949 1.00 28.96 C ATOM 1187 CZ TYR B 48 -0.390 -3.227 35.047 1.00 29.09 C ATOM 1188 OH TYR B 48 -0.715 -4.110 36.051 1.00 27.34 O ATOM 0 H TYR B 48 0.105 1.561 33.043 1.00 30.64 H new ATOM 0 HA TYR B 48 2.397 0.271 32.558 1.00 29.51 H new ATOM 0 HB2 TYR B 48 -0.215 -0.150 31.497 1.00 29.15 H new ATOM 0 HB3 TYR B 48 0.989 -1.063 31.112 1.00 29.15 H new ATOM 0 HD1 TYR B 48 1.568 -2.938 32.488 1.00 29.00 H new ATOM 0 HD2 TYR B 48 -1.141 -0.304 33.848 1.00 29.45 H new ATOM 0 HE1 TYR B 48 1.021 -4.396 34.198 1.00 29.36 H new ATOM 0 HE2 TYR B 48 -1.697 -1.765 35.568 1.00 28.96 H new ATOM 0 HH TYR B 48 -0.635 -4.897 35.769 1.00 27.34 H new ATOM 1189 N THR B 49 2.604 0.631 29.963 1.00 29.39 N ATOM 1190 CA THR B 49 2.876 1.177 28.645 1.00 27.35 C ATOM 1191 C THR B 49 1.564 0.879 27.917 1.00 27.28 C ATOM 1192 O THR B 49 0.797 0.031 28.359 1.00 24.68 O ATOM 1193 CB THR B 49 4.013 0.424 27.919 1.00 26.03 C ATOM 1194 OG1 THR B 49 3.733 -0.981 27.925 1.00 25.13 O ATOM 1195 CG2 THR B 49 5.357 0.687 28.590 1.00 25.25 C ATOM 0 H THR B 49 2.941 -0.147 30.109 1.00 29.39 H new ATOM 0 HA THR B 49 3.148 2.108 28.679 1.00 27.35 H new ATOM 0 HB THR B 49 4.063 0.745 27.005 1.00 26.03 H new ATOM 0 HG1 THR B 49 4.286 -1.375 28.420 1.00 25.13 H new ATOM 0 HG21 THR B 49 6.054 0.205 28.118 1.00 25.25 H new ATOM 0 HG22 THR B 49 5.550 1.637 28.568 1.00 25.25 H new ATOM 0 HG23 THR B 49 5.323 0.386 29.511 1.00 25.25 H new ATOM 1196 N ASP B 50 1.294 1.582 26.824 1.00 27.35 N ATOM 1197 CA ASP B 50 0.077 1.339 26.068 1.00 28.65 C ATOM 1198 C ASP B 50 0.096 -0.108 25.586 1.00 26.67 C ATOM 1199 O ASP B 50 -0.946 -0.757 25.485 1.00 24.43 O ATOM 1200 CB ASP B 50 -0.001 2.287 24.865 1.00 30.26 C ATOM 1201 CG ASP B 50 -0.408 3.701 25.258 1.00 34.43 C ATOM 1202 OD1 ASP B 50 -0.167 4.638 24.463 1.00 37.93 O ATOM 1203 OD2 ASP B 50 -0.980 3.877 26.353 1.00 33.66 O ATOM 0 H ASP B 50 1.800 2.200 26.506 1.00 27.35 H new ATOM 0 HA ASP B 50 -0.697 1.497 26.630 1.00 28.65 H new ATOM 0 HB2 ASP B 50 0.862 2.314 24.422 1.00 30.26 H new ATOM 0 HB3 ASP B 50 -0.639 1.937 24.223 1.00 30.26 H new ATOM 1204 N ALA B 51 1.292 -0.607 25.294 1.00 23.93 N ATOM 1205 CA ALA B 51 1.447 -1.977 24.816 1.00 23.36 C ATOM 1206 C ALA B 51 0.919 -2.971 25.844 1.00 23.45 C ATOM 1207 O ALA B 51 0.003 -3.744 25.561 1.00 27.01 O ATOM 1208 CB ALA B 51 2.909 -2.258 24.515 1.00 23.95 C ATOM 0 H ALA B 51 2.028 -0.168 25.366 1.00 23.93 H new ATOM 0 HA ALA B 51 0.930 -2.080 24.002 1.00 23.36 H new ATOM 0 HB1 ALA B 51 3.005 -3.170 24.198 1.00 23.95 H new ATOM 0 HB2 ALA B 51 3.223 -1.644 23.833 1.00 23.95 H new ATOM 0 HB3 ALA B 51 3.434 -2.140 25.322 1.00 23.95 H new ATOM 1209 N ASN B 52 1.490 -2.938 27.042 1.00 22.13 N ATOM 1210 CA ASN B 52 1.081 -3.848 28.109 1.00 24.85 C ATOM 1211 C ASN B 52 -0.386 -3.591 28.458 1.00 26.38 C ATOM 1212 O ASN B 52 -1.159 -4.528 28.656 1.00 24.22 O ATOM 1213 CB ASN B 52 1.972 -3.635 29.338 1.00 21.98 C ATOM 1214 CG ASN B 52 1.792 -4.713 30.403 1.00 25.07 C ATOM 1215 OD1 ASN B 52 2.729 -5.013 31.146 1.00 24.61 O ATOM 1216 ND2 ASN B 52 0.592 -5.286 30.493 1.00 23.54 N ATOM 0 H ASN B 52 2.119 -2.394 27.260 1.00 22.13 H new ATOM 0 HA ASN B 52 1.178 -4.767 27.813 1.00 24.85 H new ATOM 0 HB2 ASN B 52 2.901 -3.617 29.058 1.00 21.98 H new ATOM 0 HB3 ASN B 52 1.776 -2.768 29.727 1.00 21.98 H new ATOM 0 HD21 ASN B 52 0.448 -5.891 31.087 1.00 23.54 H new ATOM 0 HD22 ASN B 52 -0.038 -5.051 29.957 1.00 23.54 H new ATOM 1217 N LYS B 53 -0.764 -2.317 28.517 1.00 26.46 N ATOM 1218 CA LYS B 53 -2.136 -1.963 28.840 1.00 29.35 C ATOM 1219 C LYS B 53 -3.151 -2.468 27.819 1.00 29.40 C ATOM 1220 O LYS B 53 -4.271 -2.795 28.184 1.00 33.08 O ATOM 1221 CB LYS B 53 -2.275 -0.447 28.989 0.50 27.87 C ATOM 1222 CG LYS B 53 -3.717 0.033 28.986 0.50 28.45 C ATOM 1223 CD LYS B 53 -3.907 1.219 29.900 0.50 29.74 C ATOM 1224 CE LYS B 53 -3.824 0.791 31.353 0.50 28.49 C ATOM 1225 NZ LYS B 53 -4.934 -0.122 31.724 0.50 29.90 N ATOM 0 H LYS B 53 -0.243 -1.648 28.374 1.00 26.46 H new ATOM 0 HA LYS B 53 -2.335 -2.404 29.681 1.00 29.35 H new ATOM 0 HB2 LYS B 53 -1.851 -0.170 29.817 0.50 27.87 H new ATOM 0 HB3 LYS B 53 -1.796 -0.013 28.266 0.50 27.87 H new ATOM 0 HG2 LYS B 53 -3.977 0.274 28.083 0.50 28.45 H new ATOM 0 HG3 LYS B 53 -4.300 -0.690 29.266 0.50 28.45 H new ATOM 0 HD2 LYS B 53 -3.229 1.888 29.715 0.50 29.74 H new ATOM 0 HD3 LYS B 53 -4.768 1.632 29.728 0.50 29.74 H new ATOM 0 HE2 LYS B 53 -2.975 0.349 31.512 0.50 28.49 H new ATOM 0 HE3 LYS B 53 -3.847 1.576 31.923 0.50 28.49 H new ATOM 0 HZ1 LYS B 53 -5.412 0.243 32.381 0.50 29.90 H new ATOM 0 HZ2 LYS B 53 -5.457 -0.257 31.017 0.50 29.90 H new ATOM 0 HZ3 LYS B 53 -4.600 -0.900 31.998 0.50 29.90 H new ATOM 1226 N ASN B 54 -2.760 -2.551 26.550 1.00 31.06 N ATOM 1227 CA ASN B 54 -3.679 -2.996 25.504 1.00 32.01 C ATOM 1228 C ASN B 54 -3.452 -4.404 24.955 1.00 32.09 C ATOM 1229 O ASN B 54 -4.085 -4.777 23.969 1.00 31.61 O ATOM 1230 CB ASN B 54 -3.654 -2.029 24.312 1.00 34.41 C ATOM 1231 CG ASN B 54 -3.900 -0.587 24.710 1.00 37.05 C ATOM 1232 OD1 ASN B 54 -4.536 -0.305 25.730 1.00 38.33 O ATOM 1233 ND2 ASN B 54 -3.411 0.344 23.885 1.00 40.95 N ATOM 0 H ASN B 54 -1.970 -2.355 26.274 1.00 31.06 H new ATOM 0 HA ASN B 54 -4.536 -3.010 25.958 1.00 32.01 H new ATOM 0 HB2 ASN B 54 -2.794 -2.094 23.868 1.00 34.41 H new ATOM 0 HB3 ASN B 54 -4.327 -2.300 23.668 1.00 34.41 H new ATOM 0 HD21 ASN B 54 -3.535 1.178 24.056 1.00 40.95 H new ATOM 0 HD22 ASN B 54 -2.973 0.109 23.183 1.00 40.95 H new ATOM 1234 N LYS B 55 -2.565 -5.190 25.563 1.00 30.35 N ATOM 1235 CA LYS B 55 -2.314 -6.538 25.045 1.00 29.27 C ATOM 1236 C LYS B 55 -3.622 -7.323 24.903 1.00 29.00 C ATOM 1237 O LYS B 55 -3.795 -8.094 23.961 1.00 27.23 O ATOM 1238 CB LYS B 55 -1.336 -7.298 25.948 1.00 28.72 C ATOM 1239 CG LYS B 55 -1.086 -8.749 25.516 1.00 28.49 C ATOM 1240 CD LYS B 55 -0.512 -8.839 24.102 1.00 29.42 C ATOM 1241 CE LYS B 55 -0.246 -10.285 23.697 1.00 27.22 C ATOM 1242 NZ LYS B 55 0.273 -10.400 22.296 1.00 24.19 N ATOM 0 H LYS B 55 -2.108 -4.972 26.258 1.00 30.35 H new ATOM 0 HA LYS B 55 -1.914 -6.446 24.166 1.00 29.27 H new ATOM 0 HB2 LYS B 55 -0.490 -6.824 25.963 1.00 28.72 H new ATOM 0 HB3 LYS B 55 -1.679 -7.295 26.855 1.00 28.72 H new ATOM 0 HG2 LYS B 55 -0.473 -9.170 26.140 1.00 28.49 H new ATOM 0 HG3 LYS B 55 -1.918 -9.245 25.558 1.00 28.49 H new ATOM 0 HD2 LYS B 55 -1.131 -8.435 23.474 1.00 29.42 H new ATOM 0 HD3 LYS B 55 0.313 -8.331 24.054 1.00 29.42 H new ATOM 0 HE2 LYS B 55 0.395 -10.677 24.310 1.00 27.22 H new ATOM 0 HE3 LYS B 55 -1.066 -10.797 23.779 1.00 27.22 H new ATOM 0 HZ1 LYS B 55 0.156 -11.232 22.003 1.00 24.19 H new ATOM 0 HZ2 LYS B 55 -0.169 -9.836 21.768 1.00 24.19 H new ATOM 0 HZ3 LYS B 55 1.140 -10.200 22.283 1.00 24.19 H new ATOM 1243 N GLY B 56 -4.533 -7.129 25.848 1.00 28.33 N ATOM 1244 CA GLY B 56 -5.818 -7.800 25.776 1.00 29.86 C ATOM 1245 C GLY B 56 -5.901 -9.289 26.068 1.00 30.51 C ATOM 1246 O GLY B 56 -6.825 -9.956 25.598 1.00 31.36 O ATOM 0 H GLY B 56 -4.427 -6.618 26.532 1.00 28.33 H new ATOM 0 HA2 GLY B 56 -6.416 -7.349 26.392 1.00 29.86 H new ATOM 0 HA3 GLY B 56 -6.170 -7.659 24.883 1.00 29.86 H new ATOM 1247 N ILE B 57 -4.958 -9.835 26.825 1.00 29.14 N ATOM 1248 CA ILE B 57 -5.042 -11.254 27.133 1.00 28.27 C ATOM 1249 C ILE B 57 -5.160 -11.466 28.630 1.00 28.90 C ATOM 1250 O ILE B 57 -4.900 -10.556 29.419 1.00 28.34 O ATOM 1251 CB ILE B 57 -3.827 -12.047 26.575 1.00 29.32 C ATOM 1252 CG1 ILE B 57 -2.517 -11.495 27.134 1.00 29.07 C ATOM 1253 CG2 ILE B 57 -3.841 -12.010 25.055 1.00 27.82 C ATOM 1254 CD1 ILE B 57 -2.117 -12.108 28.467 1.00 30.04 C ATOM 0 H ILE B 57 -4.284 -9.419 27.160 1.00 29.14 H new ATOM 0 HA ILE B 57 -5.839 -11.595 26.697 1.00 28.27 H new ATOM 0 HB ILE B 57 -3.896 -12.972 26.859 1.00 29.32 H new ATOM 0 HG12 ILE B 57 -1.809 -11.650 26.490 1.00 29.07 H new ATOM 0 HG13 ILE B 57 -2.599 -10.534 27.240 1.00 29.07 H new ATOM 0 HG21 ILE B 57 -3.081 -12.506 24.712 1.00 27.82 H new ATOM 0 HG22 ILE B 57 -4.662 -12.411 24.729 1.00 27.82 H new ATOM 0 HG23 ILE B 57 -3.789 -11.090 24.753 1.00 27.82 H new ATOM 0 HD11 ILE B 57 -1.281 -11.717 28.766 1.00 30.04 H new ATOM 0 HD12 ILE B 57 -2.808 -11.933 29.124 1.00 30.04 H new ATOM 0 HD13 ILE B 57 -2.006 -13.066 28.363 1.00 30.04 H new ATOM 1255 N THR B 58 -5.576 -12.667 29.016 1.00 28.68 N ATOM 1256 CA THR B 58 -5.736 -13.000 30.420 1.00 29.89 C ATOM 1257 C THR B 58 -4.548 -13.798 30.910 1.00 29.68 C ATOM 1258 O THR B 58 -4.134 -14.777 30.285 1.00 31.29 O ATOM 1259 CB THR B 58 -7.020 -13.818 30.655 1.00 31.13 C ATOM 1260 OG1 THR B 58 -8.156 -13.015 30.314 1.00 29.79 O ATOM 1261 CG2 THR B 58 -7.126 -14.245 32.120 1.00 33.82 C ATOM 0 H THR B 58 -5.771 -13.305 28.474 1.00 28.68 H new ATOM 0 HA THR B 58 -5.798 -12.167 30.913 1.00 29.89 H new ATOM 0 HB THR B 58 -6.992 -14.613 30.100 1.00 31.13 H new ATOM 0 HG1 THR B 58 -8.859 -13.457 30.439 1.00 29.79 H new ATOM 0 HG21 THR B 58 -7.939 -14.758 32.250 1.00 33.82 H new ATOM 0 HG22 THR B 58 -6.359 -14.790 32.355 1.00 33.82 H new ATOM 0 HG23 THR B 58 -7.147 -13.458 32.686 1.00 33.82 H new ATOM 1262 N TRP B 59 -3.988 -13.377 32.030 1.00 28.82 N ATOM 1263 CA TRP B 59 -2.845 -14.085 32.570 1.00 29.62 C ATOM 1264 C TRP B 59 -3.252 -15.440 33.133 1.00 30.70 C ATOM 1265 O TRP B 59 -4.150 -15.542 33.979 1.00 29.18 O ATOM 1266 CB TRP B 59 -2.153 -13.236 33.634 1.00 27.83 C ATOM 1267 CG TRP B 59 -1.358 -12.089 33.053 1.00 28.95 C ATOM 1268 CD1 TRP B 59 -1.379 -10.785 33.467 1.00 28.96 C ATOM 1269 CD2 TRP B 59 -0.409 -12.150 31.974 1.00 26.51 C ATOM 1270 NE1 TRP B 59 -0.503 -10.035 32.717 1.00 29.66 N ATOM 1271 CE2 TRP B 59 0.104 -10.846 31.794 1.00 25.81 C ATOM 1272 CE3 TRP B 59 0.056 -13.180 31.144 1.00 26.45 C ATOM 1273 CZ2 TRP B 59 1.061 -10.541 30.816 1.00 24.93 C ATOM 1274 CZ3 TRP B 59 1.013 -12.874 30.165 1.00 26.22 C ATOM 1275 CH2 TRP B 59 1.502 -11.561 30.015 1.00 24.43 C ATOM 0 H TRP B 59 -4.249 -12.696 32.486 1.00 28.82 H new ATOM 0 HA TRP B 59 -2.218 -14.246 31.848 1.00 29.62 H new ATOM 0 HB2 TRP B 59 -2.820 -12.884 34.243 1.00 27.83 H new ATOM 0 HB3 TRP B 59 -1.562 -13.800 34.156 1.00 27.83 H new ATOM 0 HD1 TRP B 59 -1.909 -10.454 34.156 1.00 28.96 H new ATOM 0 HE1 TRP B 59 -0.359 -9.192 32.812 1.00 29.66 H new ATOM 0 HE3 TRP B 59 -0.263 -14.048 31.241 1.00 26.45 H new ATOM 0 HZ2 TRP B 59 1.386 -9.675 30.714 1.00 24.93 H new ATOM 0 HZ3 TRP B 59 1.329 -13.547 29.607 1.00 26.22 H new ATOM 0 HH2 TRP B 59 2.137 -11.383 29.359 1.00 24.43 H new ATOM 1276 N LYS B 60 -2.596 -16.477 32.620 1.00 29.75 N ATOM 1277 CA LYS B 60 -2.823 -17.852 33.036 1.00 30.81 C ATOM 1278 C LYS B 60 -1.548 -18.615 32.716 1.00 31.10 C ATOM 1279 O LYS B 60 -0.609 -18.038 32.172 1.00 29.57 O ATOM 1280 CB LYS B 60 -4.025 -18.450 32.299 1.00 32.03 C ATOM 1281 CG LYS B 60 -3.932 -18.446 30.780 1.00 31.06 C ATOM 1282 CD LYS B 60 -5.234 -18.970 30.178 1.00 32.46 C ATOM 1283 CE LYS B 60 -5.201 -18.956 28.658 1.00 34.10 C ATOM 1284 NZ LYS B 60 -6.474 -19.458 28.066 1.00 35.17 N ATOM 0 H LYS B 60 -1.996 -16.397 32.009 1.00 29.75 H new ATOM 0 HA LYS B 60 -3.026 -17.903 33.983 1.00 30.81 H new ATOM 0 HB2 LYS B 60 -4.145 -19.365 32.597 1.00 32.03 H new ATOM 0 HB3 LYS B 60 -4.821 -17.960 32.560 1.00 32.03 H new ATOM 0 HG2 LYS B 60 -3.758 -17.547 30.461 1.00 31.06 H new ATOM 0 HG3 LYS B 60 -3.188 -18.998 30.492 1.00 31.06 H new ATOM 0 HD2 LYS B 60 -5.393 -19.875 30.489 1.00 32.46 H new ATOM 0 HD3 LYS B 60 -5.976 -18.428 30.490 1.00 32.46 H new ATOM 0 HE2 LYS B 60 -5.035 -18.052 28.347 1.00 34.10 H new ATOM 0 HE3 LYS B 60 -4.463 -19.503 28.346 1.00 34.10 H new ATOM 0 HZ1 LYS B 60 -6.418 -19.435 27.178 1.00 35.17 H new ATOM 0 HZ2 LYS B 60 -6.616 -20.295 28.333 1.00 35.17 H new ATOM 0 HZ3 LYS B 60 -7.149 -18.944 28.333 1.00 35.17 H new ATOM 1285 N GLU B 61 -1.498 -19.897 33.060 1.00 32.04 N ATOM 1286 CA GLU B 61 -0.295 -20.687 32.810 1.00 32.67 C ATOM 1287 C GLU B 61 0.204 -20.606 31.374 1.00 31.63 C ATOM 1288 O GLU B 61 1.391 -20.353 31.132 1.00 30.22 O ATOM 1289 CB GLU B 61 -0.526 -22.156 33.159 1.00 35.79 C ATOM 1290 CG GLU B 61 -0.837 -22.424 34.620 1.00 41.13 C ATOM 1291 CD GLU B 61 -0.767 -23.902 34.946 1.00 43.09 C ATOM 1292 OE1 GLU B 61 -1.229 -24.302 36.037 1.00 45.60 O ATOM 1293 OE2 GLU B 61 -0.238 -24.663 34.109 1.00 44.00 O ATOM 0 H GLU B 61 -2.142 -20.326 33.435 1.00 32.04 H new ATOM 0 HA GLU B 61 0.386 -20.300 33.382 1.00 32.67 H new ATOM 0 HB2 GLU B 61 -1.258 -22.492 32.619 1.00 35.79 H new ATOM 0 HB3 GLU B 61 0.264 -22.662 32.912 1.00 35.79 H new ATOM 0 HG2 GLU B 61 -0.210 -21.939 35.179 1.00 41.13 H new ATOM 0 HG3 GLU B 61 -1.722 -22.088 34.830 1.00 41.13 H new ATOM 1294 N GLU B 62 -0.690 -20.842 30.420 1.00 28.38 N ATOM 1295 CA GLU B 62 -0.296 -20.796 29.023 1.00 31.25 C ATOM 1296 C GLU B 62 0.275 -19.440 28.607 1.00 30.15 C ATOM 1297 O GLU B 62 1.360 -19.374 28.027 1.00 30.53 O ATOM 1298 CB GLU B 62 -1.470 -21.137 28.104 1.00 33.21 C ATOM 1299 CG GLU B 62 -1.117 -20.947 26.638 1.00 36.95 C ATOM 1300 CD GLU B 62 -2.316 -20.998 25.728 1.00 37.76 C ATOM 1301 OE1 GLU B 62 -2.192 -20.543 24.573 1.00 40.08 O ATOM 1302 OE2 GLU B 62 -3.374 -21.494 26.162 1.00 38.85 O ATOM 0 H GLU B 62 -1.518 -21.028 30.560 1.00 28.38 H new ATOM 0 HA GLU B 62 0.404 -21.461 28.929 1.00 31.25 H new ATOM 0 HB2 GLU B 62 -1.741 -22.056 28.254 1.00 33.21 H new ATOM 0 HB3 GLU B 62 -2.229 -20.577 28.329 1.00 33.21 H new ATOM 0 HG2 GLU B 62 -0.670 -20.093 26.527 1.00 36.95 H new ATOM 0 HG3 GLU B 62 -0.486 -21.634 26.371 1.00 36.95 H new ATOM 1303 N THR B 63 -0.444 -18.361 28.897 1.00 28.97 N ATOM 1304 CA THR B 63 0.040 -17.042 28.509 1.00 27.86 C ATOM 1305 C THR B 63 1.293 -16.650 29.297 1.00 28.15 C ATOM 1306 O THR B 63 2.214 -16.046 28.747 1.00 25.30 O ATOM 1307 CB THR B 63 -1.046 -15.982 28.686 1.00 26.92 C ATOM 1308 OG1 THR B 63 -1.556 -16.041 30.020 1.00 28.88 O ATOM 1309 CG2 THR B 63 -2.183 -16.222 27.696 1.00 25.50 C ATOM 0 H THR B 63 -1.199 -18.369 29.309 1.00 28.97 H new ATOM 0 HA THR B 63 0.275 -17.089 27.569 1.00 27.86 H new ATOM 0 HB THR B 63 -0.663 -15.107 28.520 1.00 26.92 H new ATOM 0 HG1 THR B 63 -2.305 -15.662 30.051 1.00 28.88 H new ATOM 0 HG21 THR B 63 -2.866 -15.544 27.817 1.00 25.50 H new ATOM 0 HG22 THR B 63 -1.839 -16.176 26.790 1.00 25.50 H new ATOM 0 HG23 THR B 63 -2.567 -17.099 27.851 1.00 25.50 H new ATOM 1310 N LEU B 64 1.336 -17.008 30.578 1.00 25.34 N ATOM 1311 CA LEU B 64 2.498 -16.701 31.401 1.00 25.35 C ATOM 1312 C LEU B 64 3.724 -17.454 30.885 1.00 25.18 C ATOM 1313 O LEU B 64 4.815 -16.906 30.831 1.00 24.38 O ATOM 1314 CB LEU B 64 2.233 -17.061 32.865 1.00 24.71 C ATOM 1315 CG LEU B 64 1.348 -16.052 33.606 1.00 28.13 C ATOM 1316 CD1 LEU B 64 1.018 -16.573 34.999 1.00 27.15 C ATOM 1317 CD2 LEU B 64 2.069 -14.708 33.683 1.00 29.30 C ATOM 0 H LEU B 64 0.706 -17.427 30.986 1.00 25.34 H new ATOM 0 HA LEU B 64 2.669 -15.748 31.346 1.00 25.35 H new ATOM 0 HB2 LEU B 64 1.813 -17.934 32.902 1.00 24.71 H new ATOM 0 HB3 LEU B 64 3.082 -17.134 33.329 1.00 24.71 H new ATOM 0 HG LEU B 64 0.515 -15.932 33.124 1.00 28.13 H new ATOM 0 HD11 LEU B 64 0.458 -15.930 35.461 1.00 27.15 H new ATOM 0 HD12 LEU B 64 0.546 -17.417 34.926 1.00 27.15 H new ATOM 0 HD13 LEU B 64 1.839 -16.704 35.499 1.00 27.15 H new ATOM 0 HD21 LEU B 64 1.511 -14.068 34.151 1.00 29.30 H new ATOM 0 HD22 LEU B 64 2.906 -14.817 34.160 1.00 29.30 H new ATOM 0 HD23 LEU B 64 2.248 -14.385 32.786 1.00 29.30 H new ATOM 1318 N MET B 65 3.538 -18.709 30.495 1.00 26.19 N ATOM 1319 CA MET B 65 4.640 -19.505 29.976 1.00 25.81 C ATOM 1320 C MET B 65 5.236 -18.862 28.730 1.00 27.33 C ATOM 1321 O MET B 65 6.453 -18.857 28.549 1.00 27.42 O ATOM 1322 CB MET B 65 4.169 -20.921 29.648 1.00 27.91 C ATOM 1323 CG MET B 65 4.064 -21.838 30.865 1.00 31.82 C ATOM 1324 SD MET B 65 5.678 -22.159 31.617 1.00 31.80 S ATOM 1325 CE MET B 65 6.391 -23.289 30.400 1.00 32.75 C ATOM 0 H MET B 65 2.782 -19.118 30.523 1.00 26.19 H new ATOM 0 HA MET B 65 5.324 -19.548 30.662 1.00 25.81 H new ATOM 0 HB2 MET B 65 3.302 -20.872 29.216 1.00 27.91 H new ATOM 0 HB3 MET B 65 4.782 -21.316 29.009 1.00 27.91 H new ATOM 0 HG2 MET B 65 3.477 -21.434 31.523 1.00 31.82 H new ATOM 0 HG3 MET B 65 3.659 -22.679 30.601 1.00 31.82 H new ATOM 0 HE1 MET B 65 6.536 -24.156 30.809 1.00 32.75 H new ATOM 0 HE2 MET B 65 5.783 -23.383 29.650 1.00 32.75 H new ATOM 0 HE3 MET B 65 7.238 -22.935 30.086 1.00 32.75 H new ATOM 1326 N GLU B 66 4.380 -18.312 27.877 1.00 26.46 N ATOM 1327 CA GLU B 66 4.853 -17.682 26.653 1.00 26.95 C ATOM 1328 C GLU B 66 5.479 -16.316 26.925 1.00 24.61 C ATOM 1329 O GLU B 66 6.529 -15.991 26.381 1.00 22.67 O ATOM 1330 CB GLU B 66 3.708 -17.531 25.649 1.00 27.79 C ATOM 1331 CG GLU B 66 4.199 -17.183 24.254 1.00 31.57 C ATOM 1332 CD GLU B 66 3.069 -17.050 23.245 1.00 32.40 C ATOM 1333 OE1 GLU B 66 2.064 -17.781 23.372 1.00 32.50 O ATOM 1334 OE2 GLU B 66 3.199 -16.226 22.318 1.00 34.49 O ATOM 0 H GLU B 66 3.527 -18.293 27.988 1.00 26.46 H new ATOM 0 HA GLU B 66 5.537 -18.260 26.279 1.00 26.95 H new ATOM 0 HB2 GLU B 66 3.202 -18.358 25.614 1.00 27.79 H new ATOM 0 HB3 GLU B 66 3.101 -16.840 25.957 1.00 27.79 H new ATOM 0 HG2 GLU B 66 4.695 -16.350 24.289 1.00 31.57 H new ATOM 0 HG3 GLU B 66 4.816 -17.868 23.953 1.00 31.57 H new ATOM 1335 N TYR B 67 4.831 -15.520 27.768 1.00 23.50 N ATOM 1336 CA TYR B 67 5.339 -14.194 28.106 1.00 22.52 C ATOM 1337 C TYR B 67 6.698 -14.233 28.814 1.00 22.87 C ATOM 1338 O TYR B 67 7.629 -13.529 28.423 1.00 21.59 O ATOM 1339 CB TYR B 67 4.326 -13.464 28.992 1.00 22.19 C ATOM 1340 CG TYR B 67 4.814 -12.157 29.585 1.00 21.63 C ATOM 1341 CD1 TYR B 67 4.940 -11.010 28.800 1.00 20.25 C ATOM 1342 CD2 TYR B 67 5.129 -12.064 30.943 1.00 22.26 C ATOM 1343 CE1 TYR B 67 5.362 -9.801 29.351 1.00 20.42 C ATOM 1344 CE2 TYR B 67 5.550 -10.860 31.507 1.00 23.48 C ATOM 1345 CZ TYR B 67 5.663 -9.731 30.709 1.00 22.57 C ATOM 1346 OH TYR B 67 6.036 -8.534 31.280 1.00 21.58 O ATOM 0 H TYR B 67 4.093 -15.729 28.157 1.00 23.50 H new ATOM 0 HA TYR B 67 5.466 -13.721 27.269 1.00 22.52 H new ATOM 0 HB2 TYR B 67 3.528 -13.288 28.469 1.00 22.19 H new ATOM 0 HB3 TYR B 67 4.066 -14.055 29.716 1.00 22.19 H new ATOM 0 HD1 TYR B 67 4.739 -11.053 27.893 1.00 20.25 H new ATOM 0 HD2 TYR B 67 5.057 -12.819 31.481 1.00 22.26 H new ATOM 0 HE1 TYR B 67 5.442 -9.045 28.815 1.00 20.42 H new ATOM 0 HE2 TYR B 67 5.754 -10.814 32.413 1.00 23.48 H new ATOM 0 HH TYR B 67 5.699 -8.472 32.047 1.00 21.58 H new ATOM 1347 N LEU B 68 6.814 -15.061 29.847 1.00 21.82 N ATOM 1348 CA LEU B 68 8.054 -15.132 30.609 1.00 24.13 C ATOM 1349 C LEU B 68 9.237 -15.600 29.784 1.00 24.38 C ATOM 1350 O LEU B 68 10.392 -15.316 30.115 1.00 23.86 O ATOM 1351 CB LEU B 68 7.880 -16.020 31.850 1.00 23.33 C ATOM 1352 CG LEU B 68 7.127 -15.382 33.023 1.00 26.27 C ATOM 1353 CD1 LEU B 68 7.792 -14.071 33.420 1.00 25.52 C ATOM 1354 CD2 LEU B 68 5.692 -15.122 32.634 1.00 30.62 C ATOM 0 H LEU B 68 6.191 -15.586 30.121 1.00 21.82 H new ATOM 0 HA LEU B 68 8.253 -14.225 30.889 1.00 24.13 H new ATOM 0 HB2 LEU B 68 7.411 -16.827 31.587 1.00 23.33 H new ATOM 0 HB3 LEU B 68 8.759 -16.291 32.160 1.00 23.33 H new ATOM 0 HG LEU B 68 7.150 -15.992 33.777 1.00 26.27 H new ATOM 0 HD11 LEU B 68 7.309 -13.675 34.162 1.00 25.52 H new ATOM 0 HD12 LEU B 68 8.709 -14.241 33.685 1.00 25.52 H new ATOM 0 HD13 LEU B 68 7.782 -13.461 32.666 1.00 25.52 H new ATOM 0 HD21 LEU B 68 5.222 -14.719 33.381 1.00 30.62 H new ATOM 0 HD22 LEU B 68 5.667 -14.521 31.873 1.00 30.62 H new ATOM 0 HD23 LEU B 68 5.264 -15.960 32.398 1.00 30.62 H new ATOM 1355 N GLU B 69 8.955 -16.311 28.702 1.00 24.85 N ATOM 1356 CA GLU B 69 10.022 -16.790 27.842 1.00 26.58 C ATOM 1357 C GLU B 69 10.690 -15.599 27.150 1.00 25.75 C ATOM 1358 O GLU B 69 11.915 -15.546 27.019 1.00 24.47 O ATOM 1359 CB GLU B 69 9.454 -17.753 26.798 1.00 29.13 C ATOM 1360 CG GLU B 69 10.512 -18.489 26.002 1.00 34.06 C ATOM 1361 CD GLU B 69 9.908 -19.497 25.052 1.00 36.59 C ATOM 1362 OE1 GLU B 69 10.641 -20.396 24.596 1.00 38.12 O ATOM 1363 OE2 GLU B 69 8.700 -19.387 24.758 1.00 40.30 O ATOM 0 H GLU B 69 8.161 -16.525 28.451 1.00 24.85 H new ATOM 0 HA GLU B 69 10.681 -17.261 28.375 1.00 26.58 H new ATOM 0 HB2 GLU B 69 8.887 -18.402 27.244 1.00 29.13 H new ATOM 0 HB3 GLU B 69 8.889 -17.256 26.186 1.00 29.13 H new ATOM 0 HG2 GLU B 69 11.041 -17.849 25.500 1.00 34.06 H new ATOM 0 HG3 GLU B 69 11.117 -18.942 26.611 1.00 34.06 H new ATOM 1364 N ASN B 70 9.873 -14.640 26.724 1.00 25.13 N ATOM 1365 CA ASN B 70 10.367 -13.448 26.028 1.00 25.13 C ATOM 1366 C ASN B 70 9.296 -12.351 26.085 1.00 24.03 C ATOM 1367 O ASN B 70 8.475 -12.242 25.176 1.00 25.48 O ATOM 1368 CB ASN B 70 10.659 -13.791 24.561 1.00 25.49 C ATOM 1369 CG ASN B 70 11.338 -12.653 23.818 1.00 26.50 C ATOM 1370 OD1 ASN B 70 11.220 -11.489 24.195 1.00 26.09 O ATOM 1371 ND2 ASN B 70 12.041 -12.987 22.746 1.00 27.26 N ATOM 0 H ASN B 70 9.020 -14.659 26.828 1.00 25.13 H new ATOM 0 HA ASN B 70 11.181 -13.138 26.456 1.00 25.13 H new ATOM 0 HB2 ASN B 70 11.223 -14.579 24.523 1.00 25.49 H new ATOM 0 HB3 ASN B 70 9.828 -14.015 24.113 1.00 25.49 H new ATOM 0 HD21 ASN B 70 12.437 -12.379 22.284 1.00 27.26 H new ATOM 0 HD22 ASN B 70 12.102 -13.812 22.512 1.00 27.26 H new ATOM 1372 N PRO B 71 9.298 -11.529 27.152 1.00 22.33 N ATOM 1373 CA PRO B 71 8.342 -10.432 27.369 1.00 23.73 C ATOM 1374 C PRO B 71 8.183 -9.488 26.176 1.00 25.12 C ATOM 1375 O PRO B 71 7.064 -9.165 25.773 1.00 22.47 O ATOM 1376 CB PRO B 71 8.908 -9.713 28.592 1.00 23.50 C ATOM 1377 CG PRO B 71 9.570 -10.836 29.366 1.00 24.47 C ATOM 1378 CD PRO B 71 10.271 -11.608 28.261 1.00 24.00 C ATOM 0 HA PRO B 71 7.441 -10.769 27.494 1.00 23.73 H new ATOM 0 HB2 PRO B 71 9.544 -9.024 28.342 1.00 23.50 H new ATOM 0 HB3 PRO B 71 8.211 -9.281 29.110 1.00 23.50 H new ATOM 0 HG2 PRO B 71 10.195 -10.502 30.028 1.00 24.47 H new ATOM 0 HG3 PRO B 71 8.923 -11.383 29.837 1.00 24.47 H new ATOM 0 HD2 PRO B 71 11.122 -11.208 28.024 1.00 24.00 H new ATOM 0 HD3 PRO B 71 10.451 -12.525 28.519 1.00 24.00 H new ATOM 1379 N LYS B 72 9.319 -9.056 25.639 1.00 25.03 N ATOM 1380 CA LYS B 72 9.401 -8.156 24.493 1.00 26.10 C ATOM 1381 C LYS B 72 8.687 -8.730 23.278 1.00 25.98 C ATOM 1382 O LYS B 72 7.969 -8.022 22.582 1.00 27.41 O ATOM 1383 CB LYS B 72 10.869 -7.927 24.124 0.50 24.65 C ATOM 1384 CG LYS B 72 11.346 -6.502 24.223 0.50 26.33 C ATOM 1385 CD LYS B 72 11.472 -6.042 25.656 0.50 24.97 C ATOM 1386 CE LYS B 72 12.111 -4.668 25.710 0.50 21.82 C ATOM 1387 NZ LYS B 72 12.292 -4.184 27.096 0.50 21.66 N ATOM 0 H LYS B 72 10.090 -9.287 25.942 1.00 25.03 H new ATOM 0 HA LYS B 72 8.973 -7.322 24.744 1.00 26.10 H new ATOM 0 HB2 LYS B 72 11.421 -8.478 24.701 0.50 24.65 H new ATOM 0 HB3 LYS B 72 11.010 -8.237 23.216 0.50 24.65 H new ATOM 0 HG2 LYS B 72 12.206 -6.419 23.781 0.50 26.33 H new ATOM 0 HG3 LYS B 72 10.728 -5.922 23.752 0.50 26.33 H new ATOM 0 HD2 LYS B 72 10.596 -6.016 26.072 0.50 24.97 H new ATOM 0 HD3 LYS B 72 12.007 -6.675 26.160 0.50 24.97 H new ATOM 0 HE2 LYS B 72 12.973 -4.697 25.265 0.50 21.82 H new ATOM 0 HE3 LYS B 72 11.560 -4.038 25.220 0.50 21.82 H new ATOM 0 HZ1 LYS B 72 12.517 -3.323 27.083 0.50 21.66 H new ATOM 0 HZ2 LYS B 72 11.532 -4.285 27.548 0.50 21.66 H new ATOM 0 HZ3 LYS B 72 12.936 -4.653 27.493 0.50 21.66 H new ATOM 1388 N LYS B 73 8.905 -10.013 23.014 1.00 27.21 N ATOM 1389 CA LYS B 73 8.277 -10.662 21.869 1.00 27.41 C ATOM 1390 C LYS B 73 6.763 -10.797 22.065 1.00 27.34 C ATOM 1391 O LYS B 73 5.982 -10.542 21.139 1.00 27.19 O ATOM 1392 CB LYS B 73 8.896 -12.041 21.643 0.50 25.82 C ATOM 1393 CG LYS B 73 8.374 -12.751 20.413 0.50 24.53 C ATOM 1394 CD LYS B 73 8.973 -14.138 20.291 0.50 23.02 C ATOM 1395 CE LYS B 73 8.348 -14.891 19.141 0.50 23.92 C ATOM 1396 NZ LYS B 73 8.838 -16.289 19.087 0.50 26.42 N ATOM 0 H LYS B 73 9.412 -10.525 23.484 1.00 27.21 H new ATOM 0 HA LYS B 73 8.432 -10.106 21.089 1.00 27.41 H new ATOM 0 HB2 LYS B 73 9.858 -11.946 21.567 0.50 25.82 H new ATOM 0 HB3 LYS B 73 8.726 -12.594 22.422 0.50 25.82 H new ATOM 0 HG2 LYS B 73 7.407 -12.815 20.459 0.50 24.53 H new ATOM 0 HG3 LYS B 73 8.587 -12.232 19.621 0.50 24.53 H new ATOM 0 HD2 LYS B 73 9.931 -14.071 20.157 0.50 23.02 H new ATOM 0 HD3 LYS B 73 8.836 -14.628 21.117 0.50 23.02 H new ATOM 0 HE2 LYS B 73 7.383 -14.887 19.235 0.50 23.92 H new ATOM 0 HE3 LYS B 73 8.553 -14.441 18.307 0.50 23.92 H new ATOM 0 HZ1 LYS B 73 8.277 -16.782 18.602 0.50 26.42 H new ATOM 0 HZ2 LYS B 73 9.646 -16.306 18.714 0.50 26.42 H new ATOM 0 HZ3 LYS B 73 8.885 -16.619 19.912 0.50 26.42 H new ATOM 1397 N TYR B 74 6.352 -11.192 23.269 1.00 25.12 N ATOM 1398 CA TYR B 74 4.932 -11.362 23.569 1.00 24.29 C ATOM 1399 C TYR B 74 4.219 -10.015 23.567 1.00 22.35 C ATOM 1400 O TYR B 74 3.099 -9.895 23.063 1.00 24.61 O ATOM 1401 CB TYR B 74 4.744 -12.041 24.930 1.00 24.11 C ATOM 1402 CG TYR B 74 3.342 -12.562 25.170 1.00 27.54 C ATOM 1403 CD1 TYR B 74 2.790 -13.549 24.346 1.00 28.79 C ATOM 1404 CD2 TYR B 74 2.580 -12.097 26.236 1.00 28.06 C ATOM 1405 CE1 TYR B 74 1.510 -14.062 24.588 1.00 29.81 C ATOM 1406 CE2 TYR B 74 1.308 -12.598 26.489 1.00 28.60 C ATOM 1407 CZ TYR B 74 0.778 -13.584 25.665 1.00 31.37 C ATOM 1408 OH TYR B 74 -0.470 -14.103 25.943 1.00 30.56 O ATOM 0 H TYR B 74 6.879 -11.367 23.925 1.00 25.12 H new ATOM 0 HA TYR B 74 4.546 -11.925 22.880 1.00 24.29 H new ATOM 0 HB2 TYR B 74 5.370 -12.778 25.002 1.00 24.11 H new ATOM 0 HB3 TYR B 74 4.968 -11.409 25.630 1.00 24.11 H new ATOM 0 HD1 TYR B 74 3.282 -13.870 23.625 1.00 28.79 H new ATOM 0 HD2 TYR B 74 2.928 -11.437 26.791 1.00 28.06 H new ATOM 0 HE1 TYR B 74 1.154 -14.717 24.032 1.00 29.81 H new ATOM 0 HE2 TYR B 74 0.813 -12.275 27.207 1.00 28.60 H new ATOM 0 HH TYR B 74 -0.647 -14.715 25.396 1.00 30.56 H new ATOM 1409 N ILE B 75 4.868 -8.999 24.124 1.00 22.33 N ATOM 1410 CA ILE B 75 4.275 -7.666 24.167 1.00 23.09 C ATOM 1411 C ILE B 75 5.220 -6.585 23.659 1.00 23.53 C ATOM 1412 O ILE B 75 5.833 -5.846 24.442 1.00 22.97 O ATOM 1413 CB ILE B 75 3.823 -7.288 25.592 1.00 23.93 C ATOM 1414 CG1 ILE B 75 3.053 -8.454 26.229 1.00 21.07 C ATOM 1415 CG2 ILE B 75 2.926 -6.046 25.523 1.00 23.66 C ATOM 1416 CD1 ILE B 75 2.484 -8.131 27.602 1.00 23.89 C ATOM 0 H ILE B 75 5.648 -9.058 24.481 1.00 22.33 H new ATOM 0 HA ILE B 75 3.505 -7.710 23.578 1.00 23.09 H new ATOM 0 HB ILE B 75 4.602 -7.097 26.137 1.00 23.93 H new ATOM 0 HG12 ILE B 75 2.328 -8.713 25.639 1.00 21.07 H new ATOM 0 HG13 ILE B 75 3.644 -9.219 26.304 1.00 21.07 H new ATOM 0 HG21 ILE B 75 2.639 -5.804 26.417 1.00 23.66 H new ATOM 0 HG22 ILE B 75 3.422 -5.310 25.133 1.00 23.66 H new ATOM 0 HG23 ILE B 75 2.149 -6.238 24.975 1.00 23.66 H new ATOM 0 HD11 ILE B 75 2.012 -8.905 27.947 1.00 23.89 H new ATOM 0 HD12 ILE B 75 3.207 -7.898 28.205 1.00 23.89 H new ATOM 0 HD13 ILE B 75 1.870 -7.384 27.530 1.00 23.89 H new ATOM 1417 N PRO B 76 5.352 -6.478 22.328 1.00 23.73 N ATOM 1418 CA PRO B 76 6.228 -5.475 21.722 1.00 23.58 C ATOM 1419 C PRO B 76 5.921 -4.101 22.309 1.00 24.00 C ATOM 1420 O PRO B 76 4.755 -3.717 22.441 1.00 24.66 O ATOM 1421 CB PRO B 76 5.868 -5.558 20.242 1.00 24.92 C ATOM 1422 CG PRO B 76 5.487 -6.992 20.073 1.00 24.91 C ATOM 1423 CD PRO B 76 4.649 -7.257 21.294 1.00 23.02 C ATOM 0 HA PRO B 76 7.174 -5.622 21.878 1.00 23.58 H new ATOM 0 HB2 PRO B 76 5.137 -4.962 20.016 1.00 24.92 H new ATOM 0 HB3 PRO B 76 6.617 -5.316 19.675 1.00 24.92 H new ATOM 0 HG2 PRO B 76 4.988 -7.138 19.254 1.00 24.91 H new ATOM 0 HG3 PRO B 76 6.265 -7.570 20.038 1.00 24.91 H new ATOM 0 HD2 PRO B 76 3.733 -6.960 21.176 1.00 23.02 H new ATOM 0 HD3 PRO B 76 4.615 -8.202 21.512 1.00 23.02 H new ATOM 1424 N GLY B 77 6.967 -3.365 22.667 1.00 24.82 N ATOM 1425 CA GLY B 77 6.775 -2.046 23.238 1.00 22.27 C ATOM 1426 C GLY B 77 6.754 -2.022 24.755 1.00 23.37 C ATOM 1427 O GLY B 77 6.754 -0.940 25.347 1.00 24.47 O ATOM 0 H GLY B 77 7.787 -3.611 22.587 1.00 24.82 H new ATOM 0 HA2 GLY B 77 7.484 -1.463 22.925 1.00 22.27 H new ATOM 0 HA3 GLY B 77 5.940 -1.680 22.907 1.00 22.27 H new ATOM 1428 N THR B 78 6.725 -3.188 25.403 1.00 20.81 N ATOM 1429 CA THR B 78 6.715 -3.198 26.867 1.00 19.36 C ATOM 1430 C THR B 78 8.084 -2.758 27.400 1.00 20.99 C ATOM 1431 O THR B 78 9.115 -3.101 26.827 1.00 20.69 O ATOM 1432 CB THR B 78 6.351 -4.602 27.454 1.00 18.75 C ATOM 1433 OG1 THR B 78 6.324 -4.521 28.889 1.00 21.30 O ATOM 1434 CG2 THR B 78 7.370 -5.655 27.050 1.00 20.06 C ATOM 0 H THR B 78 6.711 -3.962 25.028 1.00 20.81 H new ATOM 0 HA THR B 78 6.028 -2.576 27.153 1.00 19.36 H new ATOM 0 HB THR B 78 5.484 -4.858 27.103 1.00 18.75 H new ATOM 0 HG1 THR B 78 5.736 -3.971 29.128 1.00 21.30 H new ATOM 0 HG21 THR B 78 7.117 -6.512 27.428 1.00 20.06 H new ATOM 0 HG22 THR B 78 7.398 -5.724 26.083 1.00 20.06 H new ATOM 0 HG23 THR B 78 8.246 -5.402 27.381 1.00 20.06 H new ATOM 1435 N LYS B 79 8.085 -1.989 28.487 1.00 20.47 N ATOM 1436 CA LYS B 79 9.321 -1.495 29.084 1.00 24.40 C ATOM 1437 C LYS B 79 9.491 -2.063 30.493 1.00 25.43 C ATOM 1438 O LYS B 79 8.549 -2.030 31.291 1.00 26.95 O ATOM 1439 CB LYS B 79 9.289 0.035 29.137 1.00 24.94 C ATOM 1440 CG LYS B 79 9.100 0.689 27.779 1.00 27.22 C ATOM 1441 CD LYS B 79 10.265 0.385 26.845 1.00 28.63 C ATOM 1442 CE LYS B 79 10.049 1.026 25.475 1.00 32.24 C ATOM 1443 NZ LYS B 79 11.228 0.843 24.576 1.00 34.19 N ATOM 0 H LYS B 79 7.371 -1.740 28.897 1.00 20.47 H new ATOM 0 HA LYS B 79 10.072 -1.782 28.541 1.00 24.40 H new ATOM 0 HB2 LYS B 79 8.570 0.315 29.725 1.00 24.94 H new ATOM 0 HB3 LYS B 79 10.117 0.355 29.529 1.00 24.94 H new ATOM 0 HG2 LYS B 79 8.274 0.375 27.380 1.00 27.22 H new ATOM 0 HG3 LYS B 79 9.015 1.649 27.890 1.00 27.22 H new ATOM 0 HD2 LYS B 79 11.090 0.715 27.234 1.00 28.63 H new ATOM 0 HD3 LYS B 79 10.362 -0.575 26.745 1.00 28.63 H new ATOM 0 HE2 LYS B 79 9.263 0.639 25.059 1.00 32.24 H new ATOM 0 HE3 LYS B 79 9.873 1.973 25.587 1.00 32.24 H new ATOM 0 HZ1 LYS B 79 11.065 1.228 23.790 1.00 34.19 H new ATOM 0 HZ2 LYS B 79 11.945 1.217 24.947 1.00 34.19 H new ATOM 0 HZ3 LYS B 79 11.377 -0.026 24.454 1.00 34.19 H new ATOM 1444 N MET B 80 10.681 -2.590 30.786 1.00 25.69 N ATOM 1445 CA MET B 80 10.970 -3.179 32.095 1.00 25.10 C ATOM 1446 C MET B 80 11.497 -2.131 33.072 1.00 26.94 C ATOM 1447 O MET B 80 11.449 -2.329 34.289 1.00 26.21 O ATOM 1448 CB MET B 80 11.998 -4.303 31.965 1.00 26.20 C ATOM 1449 CG MET B 80 11.644 -5.393 30.957 1.00 31.70 C ATOM 1450 SD MET B 80 10.279 -6.467 31.458 1.00 30.35 S ATOM 1451 CE MET B 80 8.897 -5.582 30.804 1.00 30.41 C ATOM 0 H MET B 80 11.340 -2.616 30.234 1.00 25.69 H new ATOM 0 HA MET B 80 10.137 -3.538 32.439 1.00 25.10 H new ATOM 0 HB2 MET B 80 12.851 -3.915 31.714 1.00 26.20 H new ATOM 0 HB3 MET B 80 12.119 -4.714 32.835 1.00 26.20 H new ATOM 0 HG2 MET B 80 11.417 -4.974 30.112 1.00 31.70 H new ATOM 0 HG3 MET B 80 12.430 -5.940 30.801 1.00 31.70 H new ATOM 0 HE1 MET B 80 8.238 -6.211 30.470 1.00 30.41 H new ATOM 0 HE2 MET B 80 8.500 -5.039 31.503 1.00 30.41 H new ATOM 0 HE3 MET B 80 9.193 -5.009 30.079 1.00 30.41 H new ATOM 1452 N ILE B 81 12.023 -1.032 32.536 1.00 25.48 N ATOM 1453 CA ILE B 81 12.539 0.052 33.364 1.00 29.10 C ATOM 1454 C ILE B 81 12.044 1.399 32.854 1.00 29.38 C ATOM 1455 O ILE B 81 11.480 1.490 31.759 1.00 27.70 O ATOM 1456 CB ILE B 81 14.080 0.075 33.401 1.00 30.76 C ATOM 1457 CG1 ILE B 81 14.639 0.261 31.989 1.00 31.26 C ATOM 1458 CG2 ILE B 81 14.605 -1.210 34.029 1.00 32.37 C ATOM 1459 CD1 ILE B 81 16.147 0.381 31.965 1.00 32.09 C ATOM 0 H ILE B 81 12.090 -0.895 31.690 1.00 25.48 H new ATOM 0 HA ILE B 81 12.211 -0.108 34.263 1.00 29.10 H new ATOM 0 HB ILE B 81 14.374 0.823 33.944 1.00 30.76 H new ATOM 0 HG12 ILE B 81 14.370 -0.490 31.438 1.00 31.26 H new ATOM 0 HG13 ILE B 81 14.249 1.057 31.594 1.00 31.26 H new ATOM 0 HG21 ILE B 81 15.575 -1.188 34.049 1.00 32.37 H new ATOM 0 HG22 ILE B 81 14.265 -1.290 34.934 1.00 32.37 H new ATOM 0 HG23 ILE B 81 14.310 -1.971 33.505 1.00 32.37 H new ATOM 0 HD11 ILE B 81 16.448 0.497 31.050 1.00 32.09 H new ATOM 0 HD12 ILE B 81 16.419 1.147 32.494 1.00 32.09 H new ATOM 0 HD13 ILE B 81 16.542 -0.424 32.335 1.00 32.09 H new ATOM 1460 N PHE B 82 12.263 2.440 33.652 1.00 29.13 N ATOM 1461 CA PHE B 82 11.814 3.786 33.314 1.00 29.62 C ATOM 1462 C PHE B 82 11.989 4.166 31.843 1.00 28.86 C ATOM 1463 O PHE B 82 13.098 4.172 31.315 1.00 28.48 O ATOM 1464 CB PHE B 82 12.533 4.817 34.183 1.00 29.54 C ATOM 1465 CG PHE B 82 12.050 6.219 33.966 1.00 31.82 C ATOM 1466 CD1 PHE B 82 10.723 6.554 34.218 1.00 32.57 C ATOM 1467 CD2 PHE B 82 12.908 7.199 33.475 1.00 33.38 C ATOM 1468 CE1 PHE B 82 10.255 7.849 33.979 1.00 34.58 C ATOM 1469 CE2 PHE B 82 12.450 8.500 33.232 1.00 32.68 C ATOM 1470 CZ PHE B 82 11.123 8.822 33.484 1.00 34.52 C ATOM 0 H PHE B 82 12.676 2.385 34.404 1.00 29.13 H new ATOM 0 HA PHE B 82 10.859 3.786 33.487 1.00 29.62 H new ATOM 0 HB2 PHE B 82 12.415 4.582 35.117 1.00 29.54 H new ATOM 0 HB3 PHE B 82 13.485 4.778 33.999 1.00 29.54 H new ATOM 0 HD1 PHE B 82 10.141 5.909 34.549 1.00 32.57 H new ATOM 0 HD2 PHE B 82 13.798 6.987 33.306 1.00 33.38 H new ATOM 0 HE1 PHE B 82 9.366 8.062 34.150 1.00 34.58 H new ATOM 0 HE2 PHE B 82 13.033 9.146 32.903 1.00 32.68 H new ATOM 0 HZ PHE B 82 10.814 9.684 33.323 1.00 34.52 H new ATOM 1471 N ALA B 83 10.883 4.488 31.189 1.00 29.20 N ATOM 1472 CA ALA B 83 10.918 4.876 29.785 1.00 30.83 C ATOM 1473 C ALA B 83 10.092 6.141 29.600 1.00 31.77 C ATOM 1474 O ALA B 83 9.844 6.576 28.472 1.00 28.82 O ATOM 1475 CB ALA B 83 10.363 3.755 28.917 1.00 32.64 C ATOM 0 H ALA B 83 10.098 4.489 31.540 1.00 29.20 H new ATOM 0 HA ALA B 83 11.835 5.045 29.517 1.00 30.83 H new ATOM 0 HB1 ALA B 83 10.391 4.023 27.985 1.00 32.64 H new ATOM 0 HB2 ALA B 83 10.899 2.956 29.039 1.00 32.64 H new ATOM 0 HB3 ALA B 83 9.446 3.571 29.173 1.00 32.64 H new ATOM 1476 N GLY B 84 9.676 6.725 30.723 1.00 30.40 N ATOM 1477 CA GLY B 84 8.882 7.936 30.679 1.00 31.95 C ATOM 1478 C GLY B 84 7.617 7.874 31.518 1.00 34.64 C ATOM 1479 O GLY B 84 7.219 6.812 32.010 1.00 32.99 O ATOM 0 H GLY B 84 9.845 6.433 31.514 1.00 30.40 H new ATOM 0 HA2 GLY B 84 9.425 8.680 30.984 1.00 31.95 H new ATOM 0 HA3 GLY B 84 8.640 8.120 29.758 1.00 31.95 H new ATOM 1480 N ILE B 85 6.991 9.034 31.685 1.00 33.99 N ATOM 1481 CA ILE B 85 5.761 9.154 32.447 1.00 34.03 C ATOM 1482 C ILE B 85 4.702 9.739 31.515 1.00 34.18 C ATOM 1483 O ILE B 85 4.808 10.880 31.061 1.00 33.23 O ATOM 1484 CB ILE B 85 5.967 10.068 33.665 1.00 33.83 C ATOM 1485 CG1 ILE B 85 7.077 9.488 34.543 1.00 34.69 C ATOM 1486 CG2 ILE B 85 4.663 10.200 34.438 1.00 33.76 C ATOM 1487 CD1 ILE B 85 7.449 10.335 35.716 1.00 35.90 C ATOM 0 H ILE B 85 7.272 9.777 31.356 1.00 33.99 H new ATOM 0 HA ILE B 85 5.482 8.286 32.779 1.00 34.03 H new ATOM 0 HB ILE B 85 6.232 10.955 33.376 1.00 33.83 H new ATOM 0 HG12 ILE B 85 6.797 8.617 34.864 1.00 34.69 H new ATOM 0 HG13 ILE B 85 7.866 9.349 33.996 1.00 34.69 H new ATOM 0 HG21 ILE B 85 4.799 10.778 35.205 1.00 33.76 H new ATOM 0 HG22 ILE B 85 3.983 10.582 33.862 1.00 33.76 H new ATOM 0 HG23 ILE B 85 4.376 9.324 34.740 1.00 33.76 H new ATOM 0 HD11 ILE B 85 8.155 9.900 36.219 1.00 35.90 H new ATOM 0 HD12 ILE B 85 7.760 11.200 35.405 1.00 35.90 H new ATOM 0 HD13 ILE B 85 6.674 10.456 36.287 1.00 35.90 H new ATOM 1488 N LYS B 86 3.683 8.944 31.225 1.00 34.71 N ATOM 1489 CA LYS B 86 2.628 9.365 30.317 1.00 36.61 C ATOM 1490 C LYS B 86 1.720 10.472 30.840 1.00 35.24 C ATOM 1491 O LYS B 86 1.462 11.446 30.138 1.00 36.42 O ATOM 1492 CB LYS B 86 1.783 8.149 29.914 0.50 36.40 C ATOM 1493 CG LYS B 86 0.689 8.439 28.893 0.50 36.76 C ATOM 1494 CD LYS B 86 -0.039 7.159 28.501 0.50 38.45 C ATOM 1495 CE LYS B 86 -1.243 7.432 27.609 0.50 37.76 C ATOM 1496 NZ LYS B 86 -0.863 8.008 26.293 0.50 39.51 N ATOM 0 H LYS B 86 3.583 8.152 31.545 1.00 34.71 H new ATOM 0 HA LYS B 86 3.084 9.751 29.553 1.00 36.61 H new ATOM 0 HB2 LYS B 86 2.372 7.467 29.553 0.50 36.40 H new ATOM 0 HB3 LYS B 86 1.374 7.777 30.711 0.50 36.40 H new ATOM 0 HG2 LYS B 86 0.057 9.075 29.262 0.50 36.76 H new ATOM 0 HG3 LYS B 86 1.077 8.850 28.105 0.50 36.76 H new ATOM 0 HD2 LYS B 86 0.576 6.568 28.040 0.50 38.45 H new ATOM 0 HD3 LYS B 86 -0.330 6.696 29.302 0.50 38.45 H new ATOM 0 HE2 LYS B 86 -1.730 6.605 27.467 0.50 37.76 H new ATOM 0 HE3 LYS B 86 -1.845 8.042 28.063 0.50 37.76 H new ATOM 0 HZ1 LYS B 86 -1.594 8.137 25.803 0.50 39.51 H new ATOM 0 HZ2 LYS B 86 -0.449 8.786 26.418 0.50 39.51 H new ATOM 0 HZ3 LYS B 86 -0.317 7.447 25.869 0.50 39.51 H new ATOM 1497 N LYS B 87 1.244 10.332 32.071 1.00 35.98 N ATOM 1498 CA LYS B 87 0.325 11.316 32.645 1.00 35.35 C ATOM 1499 C LYS B 87 0.920 12.688 32.977 1.00 34.15 C ATOM 1500 O LYS B 87 1.823 12.808 33.806 1.00 32.60 O ATOM 1501 CB LYS B 87 -0.344 10.728 33.892 0.50 35.87 C ATOM 1502 CG LYS B 87 -1.037 9.393 33.641 0.50 36.67 C ATOM 1503 CD LYS B 87 -1.805 8.918 34.864 0.50 37.74 C ATOM 1504 CE LYS B 87 -2.981 9.831 35.166 0.50 38.28 C ATOM 1505 NZ LYS B 87 -3.955 9.853 34.039 0.50 38.70 N ATOM 0 H LYS B 87 1.438 9.676 32.593 1.00 35.98 H new ATOM 0 HA LYS B 87 -0.316 11.493 31.939 1.00 35.35 H new ATOM 0 HB2 LYS B 87 0.325 10.611 34.584 0.50 35.87 H new ATOM 0 HB3 LYS B 87 -0.995 11.363 34.231 0.50 35.87 H new ATOM 0 HG2 LYS B 87 -1.645 9.480 32.891 0.50 36.67 H new ATOM 0 HG3 LYS B 87 -0.376 8.727 33.395 0.50 36.67 H new ATOM 0 HD2 LYS B 87 -2.124 8.014 34.717 0.50 37.74 H new ATOM 0 HD3 LYS B 87 -1.211 8.888 35.630 0.50 37.74 H new ATOM 0 HE2 LYS B 87 -3.426 9.532 35.974 0.50 38.28 H new ATOM 0 HE3 LYS B 87 -2.659 10.730 35.335 0.50 38.28 H new ATOM 0 HZ1 LYS B 87 -4.736 10.169 34.327 0.50 38.70 H new ATOM 0 HZ2 LYS B 87 -3.646 10.376 33.389 0.50 38.70 H new ATOM 0 HZ3 LYS B 87 -4.066 9.027 33.726 0.50 38.70 H new ATOM 1506 N LYS B 88 0.380 13.719 32.331 1.00 32.54 N ATOM 1507 CA LYS B 88 0.829 15.094 32.533 1.00 32.40 C ATOM 1508 C LYS B 88 0.831 15.499 34.011 1.00 30.88 C ATOM 1509 O LYS B 88 1.820 16.022 34.510 1.00 29.16 O ATOM 1510 CB LYS B 88 -0.056 16.047 31.724 1.00 31.95 C ATOM 1511 CG LYS B 88 0.352 17.515 31.773 1.00 32.63 C ATOM 1512 CD LYS B 88 -0.335 18.285 30.645 1.00 33.83 C ATOM 1513 CE LYS B 88 -0.082 19.780 30.715 1.00 33.63 C ATOM 1514 NZ LYS B 88 -0.783 20.369 31.884 1.00 36.31 N ATOM 0 H LYS B 88 -0.259 13.640 31.761 1.00 32.54 H new ATOM 0 HA LYS B 88 1.747 15.151 32.224 1.00 32.40 H new ATOM 0 HB2 LYS B 88 -0.056 15.757 30.798 1.00 31.95 H new ATOM 0 HB3 LYS B 88 -0.968 15.969 32.045 1.00 31.95 H new ATOM 0 HG2 LYS B 88 0.110 17.898 32.631 1.00 32.63 H new ATOM 0 HG3 LYS B 88 1.315 17.594 31.689 1.00 32.63 H new ATOM 0 HD2 LYS B 88 -0.022 17.948 29.791 1.00 33.83 H new ATOM 0 HD3 LYS B 88 -1.290 18.121 30.682 1.00 33.83 H new ATOM 0 HE2 LYS B 88 0.871 19.950 30.782 1.00 33.63 H new ATOM 0 HE3 LYS B 88 -0.389 20.205 29.899 1.00 33.63 H new ATOM 0 HZ1 LYS B 88 -0.800 21.255 31.805 1.00 36.31 H new ATOM 0 HZ2 LYS B 88 -1.616 20.059 31.918 1.00 36.31 H new ATOM 0 HZ3 LYS B 88 -0.354 20.146 32.631 1.00 36.31 H new ATOM 1515 N THR B 89 -0.265 15.249 34.716 1.00 30.58 N ATOM 1516 CA THR B 89 -0.325 15.612 36.129 1.00 32.11 C ATOM 1517 C THR B 89 0.717 14.841 36.930 1.00 32.44 C ATOM 1518 O THR B 89 1.235 15.336 37.928 1.00 34.09 O ATOM 1519 CB THR B 89 -1.720 15.343 36.727 1.00 32.33 C ATOM 1520 OG1 THR B 89 -2.035 13.956 36.591 1.00 34.12 O ATOM 1521 CG2 THR B 89 -2.783 16.173 36.006 1.00 30.72 C ATOM 0 H THR B 89 -0.974 14.877 34.404 1.00 30.58 H new ATOM 0 HA THR B 89 -0.141 16.563 36.184 1.00 32.11 H new ATOM 0 HB THR B 89 -1.710 15.592 37.664 1.00 32.33 H new ATOM 0 HG1 THR B 89 -2.794 13.808 36.918 1.00 34.12 H new ATOM 0 HG21 THR B 89 -3.653 15.992 36.394 1.00 30.72 H new ATOM 0 HG22 THR B 89 -2.577 17.116 36.101 1.00 30.72 H new ATOM 0 HG23 THR B 89 -2.794 15.938 35.065 1.00 30.72 H new ATOM 1522 N GLU B 90 1.031 13.630 36.486 1.00 32.73 N ATOM 1523 CA GLU B 90 2.028 12.815 37.170 1.00 32.52 C ATOM 1524 C GLU B 90 3.384 13.510 37.074 1.00 29.71 C ATOM 1525 O GLU B 90 4.144 13.559 38.042 1.00 27.36 O ATOM 1526 CB GLU B 90 2.093 11.423 36.532 1.00 36.61 C ATOM 1527 CG GLU B 90 1.932 10.274 37.521 1.00 42.31 C ATOM 1528 CD GLU B 90 1.735 8.922 36.846 1.00 46.27 C ATOM 1529 OE1 GLU B 90 1.668 7.909 37.573 1.00 49.22 O ATOM 1530 OE2 GLU B 90 1.642 8.865 35.597 1.00 48.37 O ATOM 0 H GLU B 90 0.680 13.262 35.793 1.00 32.73 H new ATOM 0 HA GLU B 90 1.785 12.711 38.103 1.00 32.52 H new ATOM 0 HB2 GLU B 90 1.400 11.355 35.857 1.00 36.61 H new ATOM 0 HB3 GLU B 90 2.944 11.327 36.076 1.00 36.61 H new ATOM 0 HG2 GLU B 90 2.716 10.233 38.090 1.00 42.31 H new ATOM 0 HG3 GLU B 90 1.173 10.455 38.097 1.00 42.31 H new ATOM 1531 N ARG B 91 3.677 14.063 35.903 1.00 29.69 N ATOM 1532 CA ARG B 91 4.938 14.769 35.695 1.00 27.87 C ATOM 1533 C ARG B 91 4.982 16.081 36.469 1.00 27.71 C ATOM 1534 O ARG B 91 6.026 16.466 36.995 1.00 26.30 O ATOM 1535 CB ARG B 91 5.162 15.012 34.197 1.00 26.30 C ATOM 1536 CG ARG B 91 5.539 13.731 33.457 1.00 25.50 C ATOM 1537 CD ARG B 91 5.895 13.951 31.992 1.00 23.04 C ATOM 1538 NE ARG B 91 4.739 13.734 31.132 1.00 31.37 N ATOM 1539 CZ ARG B 91 4.039 14.704 30.562 1.00 32.15 C ATOM 1540 NH1 ARG B 91 4.384 15.965 30.758 1.00 35.66 N ATOM 1541 NH2 ARG B 91 2.989 14.412 29.808 1.00 33.56 N ATOM 0 H ARG B 91 3.161 14.042 35.216 1.00 29.69 H new ATOM 0 HA ARG B 91 5.655 14.211 36.035 1.00 27.87 H new ATOM 0 HB2 ARG B 91 4.356 15.384 33.807 1.00 26.30 H new ATOM 0 HB3 ARG B 91 5.864 15.671 34.079 1.00 26.30 H new ATOM 0 HG2 ARG B 91 6.293 13.318 33.906 1.00 25.50 H new ATOM 0 HG3 ARG B 91 4.799 13.106 33.511 1.00 25.50 H new ATOM 0 HD2 ARG B 91 6.228 14.854 31.869 1.00 23.04 H new ATOM 0 HD3 ARG B 91 6.610 13.348 31.736 1.00 23.04 H new ATOM 0 HE ARG B 91 4.495 12.923 30.985 1.00 31.37 H new ATOM 0 HH11 ARG B 91 5.061 16.154 31.254 1.00 35.66 H new ATOM 0 HH12 ARG B 91 3.932 16.597 30.389 1.00 35.66 H new ATOM 0 HH21 ARG B 91 2.761 13.592 29.688 1.00 33.56 H new ATOM 0 HH22 ARG B 91 2.536 15.043 29.439 1.00 33.56 H new ATOM 1542 N GLU B 92 3.845 16.768 36.545 1.00 29.14 N ATOM 1543 CA GLU B 92 3.765 18.028 37.277 1.00 30.04 C ATOM 1544 C GLU B 92 4.068 17.809 38.753 1.00 30.10 C ATOM 1545 O GLU B 92 4.824 18.564 39.363 1.00 30.66 O ATOM 1546 CB GLU B 92 2.370 18.630 37.131 1.00 32.98 C ATOM 1547 CG GLU B 92 2.041 19.093 35.721 1.00 36.39 C ATOM 1548 CD GLU B 92 0.568 19.392 35.548 1.00 38.86 C ATOM 1549 OE1 GLU B 92 0.182 19.910 34.478 1.00 41.56 O ATOM 1550 OE2 GLU B 92 -0.206 19.099 36.485 1.00 40.92 O ATOM 0 H GLU B 92 3.107 16.521 36.179 1.00 29.14 H new ATOM 0 HA GLU B 92 4.422 18.638 36.907 1.00 30.04 H new ATOM 0 HB2 GLU B 92 1.713 17.972 37.407 1.00 32.98 H new ATOM 0 HB3 GLU B 92 2.288 19.383 37.736 1.00 32.98 H new ATOM 0 HG2 GLU B 92 2.557 19.888 35.514 1.00 36.39 H new ATOM 0 HG3 GLU B 92 2.307 18.409 35.087 1.00 36.39 H new ATOM 1551 N ASP B 93 3.474 16.771 39.327 1.00 31.12 N ATOM 1552 CA ASP B 93 3.692 16.464 40.735 1.00 32.78 C ATOM 1553 C ASP B 93 5.153 16.106 40.954 1.00 31.61 C ATOM 1554 O ASP B 93 5.805 16.636 41.845 1.00 31.94 O ATOM 1555 CB ASP B 93 2.789 15.301 41.163 1.00 32.77 C ATOM 1556 CG ASP B 93 1.320 15.681 41.167 1.00 35.30 C ATOM 1557 OD1 ASP B 93 0.461 14.785 41.338 1.00 37.31 O ATOM 1558 OD2 ASP B 93 1.027 16.882 41.001 1.00 32.84 O ATOM 0 H ASP B 93 2.941 16.232 38.920 1.00 31.12 H new ATOM 0 HA ASP B 93 3.471 17.240 41.273 1.00 32.78 H new ATOM 0 HB2 ASP B 93 2.925 14.551 40.563 1.00 32.77 H new ATOM 0 HB3 ASP B 93 3.046 15.004 42.050 1.00 32.77 H new ATOM 1559 N LEU B 94 5.671 15.214 40.118 1.00 31.84 N ATOM 1560 CA LEU B 94 7.060 14.792 40.240 1.00 31.63 C ATOM 1561 C LEU B 94 8.008 15.985 40.225 1.00 30.25 C ATOM 1562 O LEU B 94 8.895 16.092 41.069 1.00 31.62 O ATOM 1563 CB LEU B 94 7.414 13.833 39.107 1.00 29.77 C ATOM 1564 CG LEU B 94 8.849 13.306 39.071 1.00 32.17 C ATOM 1565 CD1 LEU B 94 9.199 12.621 40.387 1.00 32.09 C ATOM 1566 CD2 LEU B 94 8.983 12.338 37.901 1.00 32.16 C ATOM 0 H LEU B 94 5.237 14.842 39.475 1.00 31.84 H new ATOM 0 HA LEU B 94 7.161 14.339 41.092 1.00 31.63 H new ATOM 0 HB2 LEU B 94 6.814 13.072 39.156 1.00 29.77 H new ATOM 0 HB3 LEU B 94 7.235 14.281 38.265 1.00 29.77 H new ATOM 0 HG LEU B 94 9.468 14.043 38.952 1.00 32.17 H new ATOM 0 HD11 LEU B 94 10.111 12.293 40.349 1.00 32.09 H new ATOM 0 HD12 LEU B 94 9.115 13.256 41.115 1.00 32.09 H new ATOM 0 HD13 LEU B 94 8.594 11.877 40.536 1.00 32.09 H new ATOM 0 HD21 LEU B 94 9.890 11.996 37.866 1.00 32.16 H new ATOM 0 HD22 LEU B 94 8.364 11.601 38.018 1.00 32.16 H new ATOM 0 HD23 LEU B 94 8.781 12.801 37.073 1.00 32.16 H new ATOM 1567 N ILE B 95 7.804 16.883 39.267 1.00 28.18 N ATOM 1568 CA ILE B 95 8.637 18.067 39.121 1.00 25.55 C ATOM 1569 C ILE B 95 8.504 19.015 40.315 1.00 26.97 C ATOM 1570 O ILE B 95 9.486 19.631 40.740 1.00 25.73 O ATOM 1571 CB ILE B 95 8.292 18.792 37.798 1.00 25.49 C ATOM 1572 CG1 ILE B 95 8.651 17.869 36.616 1.00 25.43 C ATOM 1573 CG2 ILE B 95 9.023 20.129 37.714 1.00 22.71 C ATOM 1574 CD1 ILE B 95 8.188 18.354 35.235 1.00 24.57 C ATOM 0 H ILE B 95 7.176 16.821 38.682 1.00 28.18 H new ATOM 0 HA ILE B 95 9.563 17.779 39.094 1.00 25.55 H new ATOM 0 HB ILE B 95 7.342 18.986 37.764 1.00 25.49 H new ATOM 0 HG12 ILE B 95 9.614 17.755 36.596 1.00 25.43 H new ATOM 0 HG13 ILE B 95 8.266 16.994 36.780 1.00 25.43 H new ATOM 0 HG21 ILE B 95 8.796 20.570 36.880 1.00 22.71 H new ATOM 0 HG22 ILE B 95 8.757 20.691 38.459 1.00 22.71 H new ATOM 0 HG23 ILE B 95 9.980 19.977 37.749 1.00 22.71 H new ATOM 0 HD11 ILE B 95 8.458 17.712 34.559 1.00 24.57 H new ATOM 0 HD12 ILE B 95 7.222 18.442 35.230 1.00 24.57 H new ATOM 0 HD13 ILE B 95 8.591 19.215 35.042 1.00 24.57 H new ATOM 1575 N ALA B 96 7.294 19.139 40.852 1.00 26.30 N ATOM 1576 CA ALA B 96 7.075 19.990 42.021 1.00 29.33 C ATOM 1577 C ALA B 96 7.965 19.419 43.126 1.00 30.01 C ATOM 1578 O ALA B 96 8.697 20.144 43.807 1.00 28.13 O ATOM 1579 CB ALA B 96 5.602 19.938 42.449 1.00 28.62 C ATOM 0 H ALA B 96 6.590 18.742 40.558 1.00 26.30 H new ATOM 0 HA ALA B 96 7.289 20.917 41.832 1.00 29.33 H new ATOM 0 HB1 ALA B 96 5.470 20.506 43.224 1.00 28.62 H new ATOM 0 HB2 ALA B 96 5.042 20.250 41.721 1.00 28.62 H new ATOM 0 HB3 ALA B 96 5.362 19.025 42.673 1.00 28.62 H new ATOM 1580 N TYR B 97 7.909 18.102 43.285 1.00 30.91 N ATOM 1581 CA TYR B 97 8.723 17.446 44.294 1.00 32.54 C ATOM 1582 C TYR B 97 10.198 17.703 44.000 1.00 31.26 C ATOM 1583 O TYR B 97 10.942 18.163 44.869 1.00 32.09 O ATOM 1584 CB TYR B 97 8.458 15.939 44.314 1.00 33.42 C ATOM 1585 CG TYR B 97 9.432 15.203 45.202 1.00 37.27 C ATOM 1586 CD1 TYR B 97 9.419 15.389 46.585 1.00 37.72 C ATOM 1587 CD2 TYR B 97 10.416 14.382 44.658 1.00 37.35 C ATOM 1588 CE1 TYR B 97 10.365 14.782 47.402 1.00 38.62 C ATOM 1589 CE2 TYR B 97 11.368 13.770 45.468 1.00 38.84 C ATOM 1590 CZ TYR B 97 11.338 13.977 46.838 1.00 39.90 C ATOM 1591 OH TYR B 97 12.297 13.400 47.641 1.00 40.64 O ATOM 0 H TYR B 97 7.410 17.576 42.822 1.00 30.91 H new ATOM 0 HA TYR B 97 8.491 17.809 45.163 1.00 32.54 H new ATOM 0 HB2 TYR B 97 7.553 15.775 44.623 1.00 33.42 H new ATOM 0 HB3 TYR B 97 8.517 15.589 43.411 1.00 33.42 H new ATOM 0 HD1 TYR B 97 8.765 15.929 46.967 1.00 37.72 H new ATOM 0 HD2 TYR B 97 10.437 14.240 43.739 1.00 37.35 H new ATOM 0 HE1 TYR B 97 10.344 14.916 48.322 1.00 38.62 H new ATOM 0 HE2 TYR B 97 12.021 13.225 45.092 1.00 38.84 H new ATOM 0 HH TYR B 97 12.818 12.940 47.169 1.00 40.64 H new ATOM 1592 N LEU B 98 10.612 17.414 42.768 1.00 31.08 N ATOM 1593 CA LEU B 98 12.002 17.607 42.367 1.00 30.99 C ATOM 1594 C LEU B 98 12.468 19.028 42.612 1.00 30.50 C ATOM 1595 O LEU B 98 13.595 19.245 43.056 1.00 30.82 O ATOM 1596 CB LEU B 98 12.201 17.256 40.885 1.00 31.55 C ATOM 1597 CG LEU B 98 12.161 15.778 40.489 1.00 33.42 C ATOM 1598 CD1 LEU B 98 12.354 15.639 38.985 1.00 30.76 C ATOM 1599 CD2 LEU B 98 13.259 15.032 41.227 1.00 32.69 C ATOM 0 H LEU B 98 10.102 17.104 42.149 1.00 31.08 H new ATOM 0 HA LEU B 98 12.536 17.010 42.914 1.00 30.99 H new ATOM 0 HB2 LEU B 98 11.519 17.720 40.375 1.00 31.55 H new ATOM 0 HB3 LEU B 98 13.057 17.616 40.606 1.00 31.55 H new ATOM 0 HG LEU B 98 11.300 15.401 40.728 1.00 33.42 H new ATOM 0 HD11 LEU B 98 12.328 14.701 38.741 1.00 30.76 H new ATOM 0 HD12 LEU B 98 11.645 16.113 38.522 1.00 30.76 H new ATOM 0 HD13 LEU B 98 13.212 16.014 38.733 1.00 30.76 H new ATOM 0 HD21 LEU B 98 13.237 14.095 40.979 1.00 32.69 H new ATOM 0 HD22 LEU B 98 14.121 15.408 40.991 1.00 32.69 H new ATOM 0 HD23 LEU B 98 13.121 15.116 42.183 1.00 32.69 H new ATOM 1600 N LYS B 99 11.605 19.997 42.322 1.00 30.78 N ATOM 1601 CA LYS B 99 11.954 21.405 42.512 1.00 31.93 C ATOM 1602 C LYS B 99 12.260 21.691 43.983 1.00 32.09 C ATOM 1603 O LYS B 99 13.160 22.466 44.306 1.00 31.26 O ATOM 1604 CB LYS B 99 10.803 22.301 42.040 1.00 31.82 C ATOM 1605 CG LYS B 99 11.178 23.758 41.817 1.00 33.63 C ATOM 1606 CD LYS B 99 10.014 24.504 41.185 1.00 36.21 C ATOM 1607 CE LYS B 99 10.378 25.940 40.834 1.00 41.35 C ATOM 1608 NZ LYS B 99 9.215 26.660 40.217 1.00 42.32 N ATOM 0 H LYS B 99 10.813 19.863 42.015 1.00 30.78 H new ATOM 0 HA LYS B 99 12.746 21.597 41.986 1.00 31.93 H new ATOM 0 HB2 LYS B 99 10.449 21.941 41.212 1.00 31.82 H new ATOM 0 HB3 LYS B 99 10.089 22.261 42.695 1.00 31.82 H new ATOM 0 HG2 LYS B 99 11.416 24.171 42.662 1.00 33.63 H new ATOM 0 HG3 LYS B 99 11.958 23.815 41.243 1.00 33.63 H new ATOM 0 HD2 LYS B 99 9.730 24.038 40.383 1.00 36.21 H new ATOM 0 HD3 LYS B 99 9.260 24.503 41.796 1.00 36.21 H new ATOM 0 HE2 LYS B 99 10.664 26.408 41.634 1.00 41.35 H new ATOM 0 HE3 LYS B 99 11.128 25.945 40.219 1.00 41.35 H new ATOM 0 HZ1 LYS B 99 9.511 27.360 39.753 1.00 42.32 H new ATOM 0 HZ2 LYS B 99 8.778 26.107 39.673 1.00 42.32 H new ATOM 0 HZ3 LYS B 99 8.665 26.941 40.858 1.00 42.32 H new ATOM 1609 N LYS B 100 11.500 21.052 44.865 1.00 33.82 N ATOM 1610 CA LYS B 100 11.665 21.219 46.305 1.00 34.61 C ATOM 1611 C LYS B 100 12.888 20.454 46.814 1.00 33.85 C ATOM 1612 O LYS B 100 13.851 21.045 47.297 1.00 33.19 O ATOM 1613 CB LYS B 100 10.415 20.705 47.024 1.00 36.66 C ATOM 1614 CG LYS B 100 10.434 20.874 48.535 1.00 39.88 C ATOM 1615 CD LYS B 100 10.041 22.287 48.935 1.00 45.50 C ATOM 1616 CE LYS B 100 8.594 22.590 48.533 1.00 48.05 C ATOM 1617 NZ LYS B 100 8.169 23.978 48.885 1.00 48.93 N ATOM 0 H LYS B 100 10.872 20.507 44.645 1.00 33.82 H new ATOM 0 HA LYS B 100 11.794 22.163 46.488 1.00 34.61 H new ATOM 0 HB2 LYS B 100 9.640 21.168 46.669 1.00 36.66 H new ATOM 0 HB3 LYS B 100 10.303 19.764 46.818 1.00 36.66 H new ATOM 0 HG2 LYS B 100 9.824 20.239 48.942 1.00 39.88 H new ATOM 0 HG3 LYS B 100 11.320 20.674 48.874 1.00 39.88 H new ATOM 0 HD2 LYS B 100 10.143 22.396 49.893 1.00 45.50 H new ATOM 0 HD3 LYS B 100 10.638 22.924 48.512 1.00 45.50 H new ATOM 0 HE2 LYS B 100 8.495 22.460 47.577 1.00 48.05 H new ATOM 0 HE3 LYS B 100 8.003 21.956 48.968 1.00 48.05 H new ATOM 0 HZ1 LYS B 100 7.325 24.103 48.632 1.00 48.93 H new ATOM 0 HZ2 LYS B 100 8.235 24.095 49.765 1.00 48.93 H new ATOM 0 HZ3 LYS B 100 8.693 24.564 48.468 1.00 48.93 H new ATOM 1618 N ALA B 101 12.830 19.132 46.686 1.00 33.32 N ATOM 1619 CA ALA B 101 13.880 18.232 47.145 1.00 32.67 C ATOM 1620 C ALA B 101 15.291 18.468 46.603 1.00 33.06 C ATOM 1621 O ALA B 101 16.266 18.223 47.312 1.00 33.88 O ATOM 1622 CB ALA B 101 13.461 16.791 46.879 1.00 31.72 C ATOM 0 H ALA B 101 12.165 18.726 46.322 1.00 33.32 H new ATOM 0 HA ALA B 101 13.962 18.427 48.092 1.00 32.67 H new ATOM 0 HB1 ALA B 101 14.158 16.190 47.184 1.00 31.72 H new ATOM 0 HB2 ALA B 101 12.638 16.600 47.356 1.00 31.72 H new ATOM 0 HB3 ALA B 101 13.319 16.665 45.928 1.00 31.72 H new ATOM 1623 N THR B 102 15.418 18.927 45.361 1.00 32.78 N ATOM 1624 CA THR B 102 16.749 19.167 44.805 1.00 33.52 C ATOM 1625 C THR B 102 17.281 20.548 45.169 1.00 36.36 C ATOM 1626 O THR B 102 18.316 20.979 44.650 1.00 36.05 O ATOM 1627 CB THR B 102 16.773 19.034 43.263 1.00 32.72 C ATOM 1628 OG1 THR B 102 15.929 20.034 42.678 1.00 30.30 O ATOM 1629 CG2 THR B 102 16.301 17.646 42.840 1.00 30.67 C ATOM 0 H THR B 102 14.763 19.103 44.833 1.00 32.78 H new ATOM 0 HA THR B 102 17.316 18.485 45.197 1.00 33.52 H new ATOM 0 HB THR B 102 17.684 19.160 42.953 1.00 32.72 H new ATOM 0 HG1 THR B 102 15.208 19.682 42.429 1.00 30.30 H new ATOM 0 HG21 THR B 102 16.321 17.578 41.873 1.00 30.67 H new ATOM 0 HG22 THR B 102 16.886 16.974 43.223 1.00 30.67 H new ATOM 0 HG23 THR B 102 15.395 17.502 43.155 1.00 30.67 H new ATOM 1630 N ASN B 103 16.577 21.237 46.064 1.00 39.79 N ATOM 1631 CA ASN B 103 16.986 22.569 46.491 1.00 44.49 C ATOM 1632 C ASN B 103 16.946 22.755 48.012 1.00 47.25 C ATOM 1633 O ASN B 103 17.223 23.843 48.520 1.00 47.88 O ATOM 1634 CB ASN B 103 16.096 23.617 45.828 1.00 44.55 C ATOM 1635 CG ASN B 103 16.605 25.023 46.044 1.00 48.31 C ATOM 1636 OD1 ASN B 103 17.735 25.343 45.676 1.00 50.09 O ATOM 1637 ND2 ASN B 103 15.775 25.875 46.645 1.00 49.08 N ATOM 0 H ASN B 103 15.857 20.948 46.436 1.00 39.79 H new ATOM 0 HA ASN B 103 17.910 22.679 46.216 1.00 44.49 H new ATOM 0 HB2 ASN B 103 16.043 23.437 44.876 1.00 44.55 H new ATOM 0 HB3 ASN B 103 15.196 23.544 46.181 1.00 44.55 H new ATOM 0 HD21 ASN B 103 16.022 26.686 46.790 1.00 49.08 H new ATOM 0 HD22 ASN B 103 14.992 25.614 46.888 1.00 49.08 H new ATOM 1638 N GLU B 104 16.598 21.696 48.736 1.00 49.84 N ATOM 1639 CA GLU B 104 16.520 21.758 50.193 1.00 52.27 C ATOM 1640 C GLU B 104 17.652 20.959 50.842 1.00 53.85 C ATOM 1641 O GLU B 104 18.547 20.497 50.097 1.00 54.93 O ATOM 1642 CB GLU B 104 15.164 21.227 50.669 1.00 52.68 C ATOM 1643 CG GLU B 104 14.917 19.757 50.350 1.00 54.77 C ATOM 1644 CD GLU B 104 13.483 19.332 50.616 1.00 55.10 C ATOM 1645 OE1 GLU B 104 13.155 18.145 50.384 1.00 55.59 O ATOM 1646 OE2 GLU B 104 12.684 20.189 51.051 1.00 55.63 O ATOM 1647 OXT GLU B 104 17.637 20.811 52.085 1.00 54.66 O ATOM 0 H GLU B 104 16.402 20.928 48.401 1.00 49.84 H new ATOM 0 HA GLU B 104 16.613 22.686 50.461 1.00 52.27 H new ATOM 0 HB2 GLU B 104 15.098 21.354 51.628 1.00 52.68 H new ATOM 0 HB3 GLU B 104 14.461 21.757 50.263 1.00 52.68 H new ATOM 0 HG2 GLU B 104 15.132 19.592 49.419 1.00 54.77 H new ATOM 0 HG3 GLU B 104 15.516 19.210 50.881 1.00 54.77 H new TER 1648 GLU B 104 ATOM 1649 N GLY C 1 47.168 -0.981 37.005 1.00 39.82 N ATOM 1650 CA GLY C 1 45.881 -0.400 37.473 1.00 40.93 C ATOM 1651 C GLY C 1 45.797 -0.349 38.987 1.00 41.74 C ATOM 1652 O GLY C 1 46.429 -1.147 39.674 1.00 41.87 O ATOM 0 H1 GLY C 1 47.009 -1.577 36.363 1.00 39.82 H new ATOM 0 H2 GLY C 1 47.688 -0.333 36.686 1.00 39.82 H new ATOM 0 H3 GLY C 1 47.578 -1.381 37.686 1.00 39.82 H new ATOM 0 HA2 GLY C 1 45.782 0.496 37.114 1.00 40.93 H new ATOM 0 HA3 GLY C 1 45.144 -0.927 37.127 1.00 40.93 H new ATOM 1653 N ASP C 2 45.007 0.582 39.511 1.00 42.62 N ATOM 1654 CA ASP C 2 44.856 0.728 40.953 1.00 42.32 C ATOM 1655 C ASP C 2 43.696 -0.101 41.495 1.00 41.93 C ATOM 1656 O ASP C 2 42.529 0.223 41.278 1.00 40.26 O ATOM 1657 CB ASP C 2 44.646 2.198 41.312 1.00 44.85 C ATOM 1658 CG ASP C 2 44.824 2.465 42.796 1.00 46.75 C ATOM 1659 OD1 ASP C 2 44.069 1.892 43.611 1.00 47.47 O ATOM 1660 OD2 ASP C 2 45.729 3.250 43.145 1.00 50.82 O ATOM 0 H ASP C 2 44.548 1.141 39.046 1.00 42.62 H new ATOM 0 HA ASP C 2 45.672 0.401 41.363 1.00 42.32 H new ATOM 0 HB2 ASP C 2 45.273 2.743 40.811 1.00 44.85 H new ATOM 0 HB3 ASP C 2 43.755 2.470 41.042 1.00 44.85 H new ATOM 1661 N VAL C 3 44.033 -1.166 42.213 1.00 41.77 N ATOM 1662 CA VAL C 3 43.040 -2.061 42.796 1.00 43.20 C ATOM 1663 C VAL C 3 42.037 -1.353 43.706 1.00 43.08 C ATOM 1664 O VAL C 3 40.852 -1.691 43.719 1.00 41.72 O ATOM 1665 CB VAL C 3 43.730 -3.184 43.599 1.00 44.56 C ATOM 1666 CG1 VAL C 3 42.695 -4.030 44.324 1.00 45.50 C ATOM 1667 CG2 VAL C 3 44.563 -4.049 42.659 1.00 45.47 C ATOM 0 H VAL C 3 44.847 -1.391 42.377 1.00 41.77 H new ATOM 0 HA VAL C 3 42.546 -2.427 42.046 1.00 43.20 H new ATOM 0 HB VAL C 3 44.315 -2.786 44.263 1.00 44.56 H new ATOM 0 HG11 VAL C 3 43.142 -4.731 44.824 1.00 45.50 H new ATOM 0 HG12 VAL C 3 42.189 -3.471 44.934 1.00 45.50 H new ATOM 0 HG13 VAL C 3 42.092 -4.429 43.677 1.00 45.50 H new ATOM 0 HG21 VAL C 3 44.996 -4.754 43.166 1.00 45.47 H new ATOM 0 HG22 VAL C 3 43.987 -4.443 41.985 1.00 45.47 H new ATOM 0 HG23 VAL C 3 45.237 -3.501 42.227 1.00 45.47 H new ATOM 1668 N GLU C 4 42.514 -0.371 44.465 1.00 43.77 N ATOM 1669 CA GLU C 4 41.660 0.366 45.388 1.00 44.77 C ATOM 1670 C GLU C 4 40.598 1.174 44.654 1.00 44.62 C ATOM 1671 O GLU C 4 39.415 1.116 44.988 1.00 44.25 O ATOM 1672 CB GLU C 4 42.507 1.302 46.248 1.00 47.49 C ATOM 1673 CG GLU C 4 41.974 1.459 47.650 1.00 51.16 C ATOM 1674 CD GLU C 4 42.107 0.181 48.453 1.00 54.16 C ATOM 1675 OE1 GLU C 4 41.583 0.134 49.589 1.00 56.69 O ATOM 1676 OE2 GLU C 4 42.740 -0.776 47.951 1.00 55.34 O ATOM 0 H GLU C 4 43.335 -0.115 44.459 1.00 43.77 H new ATOM 0 HA GLU C 4 41.209 -0.283 45.950 1.00 44.77 H new ATOM 0 HB2 GLU C 4 43.415 0.963 46.289 1.00 47.49 H new ATOM 0 HB3 GLU C 4 42.549 2.173 45.824 1.00 47.49 H new ATOM 0 HG2 GLU C 4 42.452 2.174 48.099 1.00 51.16 H new ATOM 0 HG3 GLU C 4 41.041 1.721 47.613 1.00 51.16 H new ATOM 1677 N LYS C 5 41.038 1.934 43.657 1.00 44.98 N ATOM 1678 CA LYS C 5 40.145 2.754 42.850 1.00 44.61 C ATOM 1679 C LYS C 5 39.166 1.821 42.143 1.00 44.27 C ATOM 1680 O LYS C 5 37.954 2.053 42.139 1.00 42.54 O ATOM 1681 CB LYS C 5 40.958 3.531 41.812 1.00 45.95 C ATOM 1682 CG LYS C 5 42.173 4.243 42.391 1.00 48.34 C ATOM 1683 CD LYS C 5 41.817 5.585 42.999 1.00 49.09 C ATOM 1684 CE LYS C 5 41.968 6.696 41.975 1.00 49.51 C ATOM 1685 NZ LYS C 5 41.187 6.429 40.741 1.00 50.81 N ATOM 0 H LYS C 5 41.866 1.988 43.429 1.00 44.98 H new ATOM 0 HA LYS C 5 39.667 3.387 43.408 1.00 44.61 H new ATOM 0 HB2 LYS C 5 41.252 2.919 41.119 1.00 45.95 H new ATOM 0 HB3 LYS C 5 40.382 4.186 41.386 1.00 45.95 H new ATOM 0 HG2 LYS C 5 42.582 3.682 43.068 1.00 48.34 H new ATOM 0 HG3 LYS C 5 42.833 4.372 41.692 1.00 48.34 H new ATOM 0 HD2 LYS C 5 40.905 5.564 43.328 1.00 49.09 H new ATOM 0 HD3 LYS C 5 42.390 5.762 43.762 1.00 49.09 H new ATOM 0 HE2 LYS C 5 41.677 7.535 42.365 1.00 49.51 H new ATOM 0 HE3 LYS C 5 42.905 6.799 41.747 1.00 49.51 H new ATOM 0 HZ1 LYS C 5 41.218 7.142 40.210 1.00 50.81 H new ATOM 0 HZ2 LYS C 5 41.533 5.728 40.316 1.00 50.81 H new ATOM 0 HZ3 LYS C 5 40.341 6.256 40.956 1.00 50.81 H new ATOM 1686 N GLY C 6 39.710 0.760 41.551 1.00 43.60 N ATOM 1687 CA GLY C 6 38.885 -0.206 40.849 1.00 42.45 C ATOM 1688 C GLY C 6 37.775 -0.761 41.722 1.00 41.46 C ATOM 1689 O GLY C 6 36.669 -1.012 41.244 1.00 40.52 O ATOM 0 H GLY C 6 40.552 0.586 41.547 1.00 43.60 H new ATOM 0 HA2 GLY C 6 38.497 0.213 40.065 1.00 42.45 H new ATOM 0 HA3 GLY C 6 39.442 -0.936 40.535 1.00 42.45 H new ATOM 1690 N LYS C 7 38.070 -0.957 43.004 1.00 40.52 N ATOM 1691 CA LYS C 7 37.087 -1.482 43.942 1.00 41.68 C ATOM 1692 C LYS C 7 35.905 -0.528 44.062 1.00 41.32 C ATOM 1693 O LYS C 7 34.750 -0.944 44.005 1.00 41.03 O ATOM 1694 CB LYS C 7 37.724 -1.685 45.318 1.00 42.32 C ATOM 1695 CG LYS C 7 36.781 -2.263 46.354 1.00 45.20 C ATOM 1696 CD LYS C 7 37.521 -2.571 47.647 1.00 47.64 C ATOM 1697 CE LYS C 7 36.634 -3.334 48.621 1.00 50.19 C ATOM 1698 NZ LYS C 7 37.397 -3.832 49.803 1.00 50.67 N ATOM 0 H LYS C 7 38.839 -0.791 43.351 1.00 40.52 H new ATOM 0 HA LYS C 7 36.771 -2.336 43.608 1.00 41.68 H new ATOM 0 HB2 LYS C 7 38.489 -2.274 45.226 1.00 42.32 H new ATOM 0 HB3 LYS C 7 38.059 -0.833 45.638 1.00 42.32 H new ATOM 0 HG2 LYS C 7 36.063 -1.635 46.529 1.00 45.20 H new ATOM 0 HG3 LYS C 7 36.373 -3.073 46.010 1.00 45.20 H new ATOM 0 HD2 LYS C 7 38.315 -3.093 47.452 1.00 47.64 H new ATOM 0 HD3 LYS C 7 37.819 -1.744 48.057 1.00 47.64 H new ATOM 0 HE2 LYS C 7 35.915 -2.757 48.922 1.00 50.19 H new ATOM 0 HE3 LYS C 7 36.223 -4.084 48.163 1.00 50.19 H new ATOM 0 HZ1 LYS C 7 36.847 -4.271 50.348 1.00 50.67 H new ATOM 0 HZ2 LYS C 7 38.044 -4.379 49.530 1.00 50.67 H new ATOM 0 HZ3 LYS C 7 37.756 -3.143 50.237 1.00 50.67 H new ATOM 1699 N LYS C 8 36.204 0.755 44.229 1.00 41.61 N ATOM 1700 CA LYS C 8 35.163 1.767 44.350 1.00 42.09 C ATOM 1701 C LYS C 8 34.323 1.804 43.083 1.00 40.73 C ATOM 1702 O LYS C 8 33.103 1.936 43.142 1.00 39.95 O ATOM 1703 CB LYS C 8 35.786 3.142 44.594 1.00 44.33 C ATOM 1704 CG LYS C 8 36.473 3.282 45.943 1.00 48.24 C ATOM 1705 CD LYS C 8 37.190 4.628 46.070 1.00 51.73 C ATOM 1706 CE LYS C 8 36.230 5.811 45.940 1.00 52.94 C ATOM 1707 NZ LYS C 8 35.183 5.829 47.003 1.00 55.42 N ATOM 0 H LYS C 8 37.006 1.061 44.275 1.00 41.61 H new ATOM 0 HA LYS C 8 34.596 1.539 45.103 1.00 42.09 H new ATOM 0 HB2 LYS C 8 36.431 3.323 43.893 1.00 44.33 H new ATOM 0 HB3 LYS C 8 35.093 3.817 44.523 1.00 44.33 H new ATOM 0 HG2 LYS C 8 35.817 3.195 46.652 1.00 48.24 H new ATOM 0 HG3 LYS C 8 37.112 2.561 46.058 1.00 48.24 H new ATOM 0 HD2 LYS C 8 37.641 4.672 46.928 1.00 51.73 H new ATOM 0 HD3 LYS C 8 37.875 4.693 45.386 1.00 51.73 H new ATOM 0 HE2 LYS C 8 36.736 6.638 45.977 1.00 52.94 H new ATOM 0 HE3 LYS C 8 35.801 5.779 45.071 1.00 52.94 H new ATOM 0 HZ1 LYS C 8 34.706 6.577 46.937 1.00 55.42 H new ATOM 0 HZ2 LYS C 8 34.647 5.126 46.904 1.00 55.42 H new ATOM 0 HZ3 LYS C 8 35.571 5.794 47.803 1.00 55.42 H new ATOM 1708 N ILE C 9 34.982 1.699 41.932 1.00 39.82 N ATOM 1709 CA ILE C 9 34.264 1.712 40.664 1.00 36.95 C ATOM 1710 C ILE C 9 33.288 0.545 40.666 1.00 34.87 C ATOM 1711 O ILE C 9 32.100 0.711 40.388 1.00 33.61 O ATOM 1712 CB ILE C 9 35.227 1.557 39.464 1.00 37.46 C ATOM 1713 CG1 ILE C 9 36.216 2.720 39.440 1.00 37.81 C ATOM 1714 CG2 ILE C 9 34.441 1.523 38.152 1.00 34.45 C ATOM 1715 CD1 ILE C 9 37.363 2.515 38.475 1.00 38.43 C ATOM 0 H ILE C 9 35.836 1.620 41.865 1.00 39.82 H new ATOM 0 HA ILE C 9 33.805 2.561 40.571 1.00 36.95 H new ATOM 0 HB ILE C 9 35.713 0.723 39.561 1.00 37.46 H new ATOM 0 HG12 ILE C 9 35.743 3.533 39.202 1.00 37.81 H new ATOM 0 HG13 ILE C 9 36.573 2.851 40.333 1.00 37.81 H new ATOM 0 HG21 ILE C 9 35.056 1.426 37.408 1.00 34.45 H new ATOM 0 HG22 ILE C 9 33.826 0.773 38.162 1.00 34.45 H new ATOM 0 HG23 ILE C 9 33.942 2.349 38.052 1.00 34.45 H new ATOM 0 HD11 ILE C 9 37.953 3.284 38.506 1.00 38.43 H new ATOM 0 HD12 ILE C 9 37.857 1.718 38.724 1.00 38.43 H new ATOM 0 HD13 ILE C 9 37.015 2.411 37.576 1.00 38.43 H new ATOM 1716 N PHE C 10 33.796 -0.633 41.009 1.00 33.07 N ATOM 1717 CA PHE C 10 32.973 -1.831 41.033 1.00 33.60 C ATOM 1718 C PHE C 10 31.728 -1.688 41.900 1.00 33.69 C ATOM 1719 O PHE C 10 30.616 -1.921 41.435 1.00 35.30 O ATOM 1720 CB PHE C 10 33.777 -3.030 41.529 1.00 32.05 C ATOM 1721 CG PHE C 10 33.037 -4.328 41.417 1.00 31.12 C ATOM 1722 CD1 PHE C 10 33.087 -5.068 40.242 1.00 28.80 C ATOM 1723 CD2 PHE C 10 32.252 -4.789 42.469 1.00 29.70 C ATOM 1724 CE1 PHE C 10 32.366 -6.250 40.111 1.00 29.89 C ATOM 1725 CE2 PHE C 10 31.524 -5.974 42.347 1.00 31.67 C ATOM 1726 CZ PHE C 10 31.583 -6.705 41.162 1.00 27.63 C ATOM 0 H PHE C 10 34.617 -0.758 41.232 1.00 33.07 H new ATOM 0 HA PHE C 10 32.685 -1.969 40.117 1.00 33.60 H new ATOM 0 HB2 PHE C 10 34.602 -3.090 41.022 1.00 32.05 H new ATOM 0 HB3 PHE C 10 34.024 -2.885 42.456 1.00 32.05 H new ATOM 0 HD1 PHE C 10 33.610 -4.769 39.533 1.00 28.80 H new ATOM 0 HD2 PHE C 10 32.212 -4.303 43.261 1.00 29.70 H new ATOM 0 HE1 PHE C 10 32.409 -6.735 39.319 1.00 29.89 H new ATOM 0 HE2 PHE C 10 31.001 -6.275 43.055 1.00 31.67 H new ATOM 0 HZ PHE C 10 31.099 -7.495 41.076 1.00 27.63 H new ATOM 1727 N VAL C 11 31.917 -1.311 43.159 1.00 32.57 N ATOM 1728 CA VAL C 11 30.798 -1.166 44.080 1.00 35.13 C ATOM 1729 C VAL C 11 29.697 -0.224 43.584 1.00 34.88 C ATOM 1730 O VAL C 11 28.511 -0.503 43.762 1.00 35.80 O ATOM 1731 CB VAL C 11 31.285 -0.701 45.482 1.00 34.97 C ATOM 1732 CG1 VAL C 11 32.111 -1.801 46.137 1.00 35.20 C ATOM 1733 CG2 VAL C 11 32.123 0.550 45.357 1.00 37.40 C ATOM 0 H VAL C 11 32.687 -1.134 43.500 1.00 32.57 H new ATOM 0 HA VAL C 11 30.404 -2.051 44.139 1.00 35.13 H new ATOM 0 HB VAL C 11 30.509 -0.510 46.031 1.00 34.97 H new ATOM 0 HG11 VAL C 11 32.411 -1.504 47.010 1.00 35.20 H new ATOM 0 HG12 VAL C 11 31.568 -2.598 46.236 1.00 35.20 H new ATOM 0 HG13 VAL C 11 32.881 -2.002 45.582 1.00 35.20 H new ATOM 0 HG21 VAL C 11 32.420 0.830 46.237 1.00 37.40 H new ATOM 0 HG22 VAL C 11 32.895 0.368 44.798 1.00 37.40 H new ATOM 0 HG23 VAL C 11 31.593 1.256 44.956 1.00 37.40 H new ATOM 1734 N GLN C 12 30.084 0.871 42.941 1.00 35.96 N ATOM 1735 CA GLN C 12 29.114 1.842 42.440 1.00 37.62 C ATOM 1736 C GLN C 12 28.525 1.558 41.056 1.00 36.42 C ATOM 1737 O GLN C 12 27.472 2.097 40.711 1.00 38.05 O ATOM 1738 CB GLN C 12 29.738 3.237 42.406 1.00 40.18 C ATOM 1739 CG GLN C 12 28.757 4.334 42.014 1.00 44.69 C ATOM 1740 CD GLN C 12 29.449 5.570 41.481 1.00 48.62 C ATOM 1741 OE1 GLN C 12 29.970 5.569 40.363 1.00 50.34 O ATOM 1742 NE2 GLN C 12 29.467 6.634 42.282 1.00 51.27 N ATOM 0 H GLN C 12 30.905 1.072 42.783 1.00 35.96 H new ATOM 0 HA GLN C 12 28.376 1.775 43.066 1.00 37.62 H new ATOM 0 HB2 GLN C 12 30.106 3.440 43.280 1.00 40.18 H new ATOM 0 HB3 GLN C 12 30.479 3.237 41.780 1.00 40.18 H new ATOM 0 HG2 GLN C 12 28.148 3.993 41.341 1.00 44.69 H new ATOM 0 HG3 GLN C 12 28.221 4.575 42.786 1.00 44.69 H new ATOM 0 HE21 GLN C 12 29.093 6.596 43.055 1.00 51.27 H new ATOM 0 HE22 GLN C 12 29.853 7.359 42.026 1.00 51.27 H new ATOM 1743 N LYS C 13 29.181 0.722 40.260 1.00 33.81 N ATOM 1744 CA LYS C 13 28.675 0.464 38.914 1.00 32.20 C ATOM 1745 C LYS C 13 28.430 -0.992 38.533 1.00 31.61 C ATOM 1746 O LYS C 13 27.765 -1.267 37.533 1.00 29.36 O ATOM 1747 CB LYS C 13 29.620 1.094 37.889 1.00 32.41 C ATOM 1748 CG LYS C 13 29.832 2.586 38.092 1.00 32.04 C ATOM 1749 CD LYS C 13 30.640 3.203 36.962 1.00 32.00 C ATOM 1750 CE LYS C 13 30.747 4.716 37.138 1.00 33.34 C ATOM 1751 NZ LYS C 13 31.541 5.373 36.061 1.00 33.56 N ATOM 0 H LYS C 13 29.902 0.303 40.470 1.00 33.81 H new ATOM 0 HA LYS C 13 27.792 0.867 38.912 1.00 32.20 H new ATOM 0 HB2 LYS C 13 30.478 0.644 37.933 1.00 32.41 H new ATOM 0 HB3 LYS C 13 29.266 0.944 36.999 1.00 32.41 H new ATOM 0 HG2 LYS C 13 28.971 3.029 38.153 1.00 32.04 H new ATOM 0 HG3 LYS C 13 30.289 2.736 38.935 1.00 32.04 H new ATOM 0 HD2 LYS C 13 31.527 2.812 36.942 1.00 32.00 H new ATOM 0 HD3 LYS C 13 30.221 3.001 36.111 1.00 32.00 H new ATOM 0 HE2 LYS C 13 29.856 5.098 37.155 1.00 33.34 H new ATOM 0 HE3 LYS C 13 31.155 4.909 37.997 1.00 33.34 H new ATOM 0 HZ1 LYS C 13 31.364 6.245 36.051 1.00 33.56 H new ATOM 0 HZ2 LYS C 13 32.409 5.249 36.214 1.00 33.56 H new ATOM 0 HZ3 LYS C 13 31.325 5.018 35.274 1.00 33.56 H new ATOM 1752 N CYS C 14 28.945 -1.924 39.325 1.00 30.33 N ATOM 1753 CA CYS C 14 28.783 -3.337 39.004 1.00 29.77 C ATOM 1754 C CYS C 14 28.128 -4.126 40.127 1.00 29.77 C ATOM 1755 O CYS C 14 27.330 -5.034 39.878 1.00 28.88 O ATOM 1756 CB CYS C 14 30.155 -3.948 38.695 1.00 26.76 C ATOM 1757 SG CYS C 14 31.244 -2.848 37.738 1.00 27.58 S ATOM 0 H CYS C 14 29.387 -1.763 40.045 1.00 30.33 H new ATOM 0 HA CYS C 14 28.197 -3.390 38.233 1.00 29.77 H new ATOM 0 HB2 CYS C 14 30.593 -4.179 39.529 1.00 26.76 H new ATOM 0 HB3 CYS C 14 30.029 -4.774 38.203 1.00 26.76 H new ATOM 1758 N ALA C 15 28.483 -3.777 41.360 1.00 29.41 N ATOM 1759 CA ALA C 15 27.971 -4.454 42.551 1.00 30.56 C ATOM 1760 C ALA C 15 26.476 -4.761 42.525 1.00 29.25 C ATOM 1761 O ALA C 15 26.058 -5.852 42.920 1.00 29.56 O ATOM 1762 CB ALA C 15 28.318 -3.635 43.799 1.00 29.50 C ATOM 0 H ALA C 15 29.031 -3.137 41.532 1.00 29.41 H new ATOM 0 HA ALA C 15 28.409 -5.319 42.570 1.00 30.56 H new ATOM 0 HB1 ALA C 15 27.977 -4.086 44.587 1.00 29.50 H new ATOM 0 HB2 ALA C 15 29.281 -3.545 43.870 1.00 29.50 H new ATOM 0 HB3 ALA C 15 27.915 -2.755 43.731 1.00 29.50 H new ATOM 1763 N GLN C 16 25.668 -3.813 42.062 1.00 31.79 N ATOM 1764 CA GLN C 16 24.225 -4.036 42.011 1.00 34.20 C ATOM 1765 C GLN C 16 23.812 -5.275 41.218 1.00 34.62 C ATOM 1766 O GLN C 16 22.750 -5.839 41.469 1.00 38.12 O ATOM 1767 CB GLN C 16 23.496 -2.803 41.454 1.00 36.27 C ATOM 1768 CG GLN C 16 24.015 -2.276 40.121 1.00 41.23 C ATOM 1769 CD GLN C 16 25.061 -1.187 40.286 1.00 43.94 C ATOM 1770 OE1 GLN C 16 26.068 -1.372 40.981 1.00 45.84 O ATOM 1771 NE2 GLN C 16 24.828 -0.043 39.647 1.00 42.61 N ATOM 0 H GLN C 16 25.928 -3.045 41.776 1.00 31.79 H new ATOM 0 HA GLN C 16 23.961 -4.193 42.931 1.00 34.20 H new ATOM 0 HB2 GLN C 16 22.556 -3.021 41.353 1.00 36.27 H new ATOM 0 HB3 GLN C 16 23.553 -2.090 42.109 1.00 36.27 H new ATOM 0 HG2 GLN C 16 24.396 -3.010 39.614 1.00 41.23 H new ATOM 0 HG3 GLN C 16 23.272 -1.929 39.604 1.00 41.23 H new ATOM 0 HE21 GLN C 16 24.116 0.048 39.173 1.00 42.61 H new ATOM 0 HE22 GLN C 16 25.389 0.606 39.708 1.00 42.61 H new ATOM 1772 N CYS C 17 24.638 -5.715 40.272 1.00 33.94 N ATOM 1773 CA CYS C 17 24.291 -6.893 39.474 1.00 32.88 C ATOM 1774 C CYS C 17 25.288 -8.042 39.572 1.00 32.55 C ATOM 1775 O CYS C 17 24.996 -9.150 39.127 1.00 34.82 O ATOM 1776 CB CYS C 17 24.171 -6.527 37.993 1.00 31.72 C ATOM 1777 SG CYS C 17 22.979 -5.227 37.566 1.00 29.66 S ATOM 0 H CYS C 17 25.394 -5.353 40.077 1.00 33.94 H new ATOM 0 HA CYS C 17 23.447 -7.194 39.846 1.00 32.88 H new ATOM 0 HB2 CYS C 17 25.046 -6.250 37.678 1.00 31.72 H new ATOM 0 HB3 CYS C 17 23.933 -7.329 37.502 1.00 31.72 H new ATOM 1778 N HIS C 18 26.456 -7.788 40.149 1.00 31.06 N ATOM 1779 CA HIS C 18 27.488 -8.820 40.216 1.00 31.27 C ATOM 1780 C HIS C 18 28.167 -9.017 41.570 1.00 32.80 C ATOM 1781 O HIS C 18 28.389 -8.059 42.316 1.00 31.19 O ATOM 1782 CB HIS C 18 28.602 -8.506 39.207 1.00 28.51 C ATOM 1783 CG HIS C 18 28.177 -8.553 37.770 1.00 26.40 C ATOM 1784 ND1 HIS C 18 27.993 -9.735 37.085 1.00 24.93 N ATOM 1785 CD2 HIS C 18 27.971 -7.560 36.871 1.00 23.72 C ATOM 1786 CE1 HIS C 18 27.697 -9.469 35.824 1.00 26.44 C ATOM 1787 NE2 HIS C 18 27.677 -8.156 35.668 1.00 23.13 N ATOM 0 H HIS C 18 26.671 -7.035 40.504 1.00 31.06 H new ATOM 0 HA HIS C 18 27.003 -9.638 40.024 1.00 31.27 H new ATOM 0 HB2 HIS C 18 28.956 -7.623 39.398 1.00 28.51 H new ATOM 0 HB3 HIS C 18 29.327 -9.137 39.338 1.00 28.51 H new ATOM 0 HD1 HIS C 18 28.060 -10.522 37.425 1.00 24.93 H new ATOM 0 HD2 HIS C 18 28.020 -6.646 37.037 1.00 23.72 H new ATOM 0 HE1 HIS C 18 27.531 -10.098 35.160 1.00 26.44 H new ATOM 1788 N THR C 19 28.512 -10.275 41.848 1.00 32.80 N ATOM 1789 CA THR C 19 29.244 -10.666 43.051 1.00 35.07 C ATOM 1790 C THR C 19 30.583 -11.191 42.513 1.00 36.26 C ATOM 1791 O THR C 19 30.685 -11.527 41.325 1.00 34.67 O ATOM 1792 CB THR C 19 28.548 -11.810 43.819 1.00 34.10 C ATOM 1793 OG1 THR C 19 28.460 -12.972 42.981 1.00 36.49 O ATOM 1794 CG2 THR C 19 27.150 -11.388 44.259 1.00 38.07 C ATOM 0 H THR C 19 28.323 -10.937 41.332 1.00 32.80 H new ATOM 0 HA THR C 19 29.317 -9.921 43.668 1.00 35.07 H new ATOM 0 HB THR C 19 29.073 -12.017 44.608 1.00 34.10 H new ATOM 0 HG1 THR C 19 27.685 -13.292 43.026 1.00 36.49 H new ATOM 0 HG21 THR C 19 26.728 -12.117 44.739 1.00 38.07 H new ATOM 0 HG22 THR C 19 27.213 -10.613 44.839 1.00 38.07 H new ATOM 0 HG23 THR C 19 26.619 -11.165 43.479 1.00 38.07 H new ATOM 1795 N VAL C 20 31.600 -11.268 43.367 1.00 36.57 N ATOM 1796 CA VAL C 20 32.913 -11.745 42.928 1.00 38.30 C ATOM 1797 C VAL C 20 33.529 -12.857 43.779 1.00 39.39 C ATOM 1798 O VAL C 20 34.351 -13.636 43.285 1.00 35.62 O ATOM 1799 CB VAL C 20 33.925 -10.586 42.860 1.00 38.74 C ATOM 1800 CG1 VAL C 20 33.479 -9.568 41.825 1.00 39.52 C ATOM 1801 CG2 VAL C 20 34.058 -9.936 44.224 1.00 38.57 C ATOM 0 H VAL C 20 31.554 -11.051 44.198 1.00 36.57 H new ATOM 0 HA VAL C 20 32.737 -12.124 42.053 1.00 38.30 H new ATOM 0 HB VAL C 20 34.792 -10.934 42.597 1.00 38.74 H new ATOM 0 HG11 VAL C 20 34.121 -8.842 41.788 1.00 39.52 H new ATOM 0 HG12 VAL C 20 33.423 -9.994 40.955 1.00 39.52 H new ATOM 0 HG13 VAL C 20 32.608 -9.217 42.070 1.00 39.52 H new ATOM 0 HG21 VAL C 20 34.696 -9.207 44.175 1.00 38.57 H new ATOM 0 HG22 VAL C 20 33.196 -9.591 44.504 1.00 38.57 H new ATOM 0 HG23 VAL C 20 34.367 -10.593 44.867 1.00 38.57 H new ATOM 1802 N GLU C 21 33.137 -12.929 45.049 1.00 40.80 N ATOM 1803 CA GLU C 21 33.670 -13.941 45.956 1.00 43.25 C ATOM 1804 C GLU C 21 33.346 -15.360 45.491 1.00 45.23 C ATOM 1805 O GLU C 21 32.305 -15.597 44.871 1.00 45.43 O ATOM 1806 CB GLU C 21 33.115 -13.731 47.370 1.00 45.82 C ATOM 1807 CG GLU C 21 31.597 -13.860 47.482 1.00 47.74 C ATOM 1808 CD GLU C 21 30.873 -12.541 47.255 1.00 50.88 C ATOM 1809 OE1 GLU C 21 31.154 -11.862 46.243 1.00 51.29 O ATOM 1810 OE2 GLU C 21 30.014 -12.182 48.094 1.00 52.19 O ATOM 0 H GLU C 21 32.561 -12.399 45.406 1.00 40.80 H new ATOM 0 HA GLU C 21 34.635 -13.840 45.960 1.00 43.25 H new ATOM 0 HB2 GLU C 21 33.528 -14.376 47.966 1.00 45.82 H new ATOM 0 HB3 GLU C 21 33.377 -12.850 47.680 1.00 45.82 H new ATOM 0 HG2 GLU C 21 31.284 -14.511 46.835 1.00 47.74 H new ATOM 0 HG3 GLU C 21 31.370 -14.201 48.361 1.00 47.74 H new ATOM 1811 N LYS C 22 34.240 -16.302 45.784 1.00 46.20 N ATOM 1812 CA LYS C 22 34.014 -17.693 45.406 1.00 46.39 C ATOM 1813 C LYS C 22 32.730 -18.136 46.110 1.00 46.36 C ATOM 1814 O LYS C 22 32.593 -17.979 47.323 1.00 44.68 O ATOM 1815 CB LYS C 22 35.184 -18.576 45.855 1.00 48.10 C ATOM 1816 CG LYS C 22 35.111 -20.013 45.338 1.00 50.52 C ATOM 1817 CD LYS C 22 36.082 -20.940 46.069 1.00 53.97 C ATOM 1818 CE LYS C 22 37.541 -20.540 45.866 1.00 56.42 C ATOM 1819 NZ LYS C 22 37.997 -20.707 44.455 1.00 57.46 N ATOM 0 H LYS C 22 34.979 -16.157 46.199 1.00 46.20 H new ATOM 0 HA LYS C 22 33.939 -17.777 44.443 1.00 46.39 H new ATOM 0 HB2 LYS C 22 36.014 -18.175 45.553 1.00 48.10 H new ATOM 0 HB3 LYS C 22 35.212 -18.592 46.824 1.00 48.10 H new ATOM 0 HG2 LYS C 22 34.206 -20.347 45.443 1.00 50.52 H new ATOM 0 HG3 LYS C 22 35.309 -20.024 44.388 1.00 50.52 H new ATOM 0 HD2 LYS C 22 35.878 -20.934 47.017 1.00 53.97 H new ATOM 0 HD3 LYS C 22 35.953 -21.849 45.757 1.00 53.97 H new ATOM 0 HE2 LYS C 22 37.658 -19.614 46.132 1.00 56.42 H new ATOM 0 HE3 LYS C 22 38.103 -21.075 46.448 1.00 56.42 H new ATOM 0 HZ1 LYS C 22 38.870 -20.878 44.443 1.00 57.46 H new ATOM 0 HZ2 LYS C 22 37.558 -21.383 44.079 1.00 57.46 H new ATOM 0 HZ3 LYS C 22 37.835 -19.959 44.000 1.00 57.46 H new ATOM 1820 N GLY C 23 31.788 -18.681 45.349 1.00 45.61 N ATOM 1821 CA GLY C 23 30.537 -19.107 45.946 1.00 44.64 C ATOM 1822 C GLY C 23 29.519 -17.981 45.949 1.00 44.46 C ATOM 1823 O GLY C 23 28.344 -18.197 46.257 1.00 43.16 O ATOM 0 H GLY C 23 31.853 -18.810 44.501 1.00 45.61 H new ATOM 0 HA2 GLY C 23 30.183 -19.865 45.455 1.00 44.64 H new ATOM 0 HA3 GLY C 23 30.695 -19.406 46.855 1.00 44.64 H new ATOM 1824 N GLY C 24 29.974 -16.773 45.615 1.00 42.93 N ATOM 1825 CA GLY C 24 29.079 -15.633 45.560 1.00 40.95 C ATOM 1826 C GLY C 24 27.865 -16.007 44.734 1.00 41.20 C ATOM 1827 O GLY C 24 27.987 -16.701 43.726 1.00 40.32 O ATOM 0 H GLY C 24 30.793 -16.599 45.419 1.00 42.93 H new ATOM 0 HA2 GLY C 24 28.810 -15.374 46.455 1.00 40.95 H new ATOM 0 HA3 GLY C 24 29.531 -14.870 45.167 1.00 40.95 H new ATOM 1828 N LYS C 25 26.694 -15.549 45.162 1.00 41.54 N ATOM 1829 CA LYS C 25 25.444 -15.863 44.482 1.00 42.04 C ATOM 1830 C LYS C 25 25.222 -15.075 43.196 1.00 40.95 C ATOM 1831 O LYS C 25 25.806 -14.011 42.991 1.00 40.00 O ATOM 1832 CB LYS C 25 24.270 -15.607 45.431 1.00 44.20 C ATOM 1833 CG LYS C 25 24.297 -16.445 46.711 1.00 47.14 C ATOM 1834 CD LYS C 25 23.856 -17.884 46.468 1.00 50.13 C ATOM 1835 CE LYS C 25 22.332 -17.995 46.362 1.00 52.87 C ATOM 1836 NZ LYS C 25 21.730 -17.097 45.327 1.00 52.18 N ATOM 0 H LYS C 25 26.602 -15.048 45.855 1.00 41.54 H new ATOM 0 HA LYS C 25 25.501 -16.798 44.230 1.00 42.04 H new ATOM 0 HB2 LYS C 25 24.263 -14.668 45.673 1.00 44.20 H new ATOM 0 HB3 LYS C 25 23.442 -15.785 44.958 1.00 44.20 H new ATOM 0 HG2 LYS C 25 25.195 -16.441 47.079 1.00 47.14 H new ATOM 0 HG3 LYS C 25 23.717 -16.038 47.374 1.00 47.14 H new ATOM 0 HD2 LYS C 25 24.263 -18.215 45.652 1.00 50.13 H new ATOM 0 HD3 LYS C 25 24.173 -18.447 47.191 1.00 50.13 H new ATOM 0 HE2 LYS C 25 22.097 -18.913 46.157 1.00 52.87 H new ATOM 0 HE3 LYS C 25 21.940 -17.788 47.225 1.00 52.87 H new ATOM 0 HZ1 LYS C 25 20.877 -17.318 45.202 1.00 52.18 H new ATOM 0 HZ2 LYS C 25 21.780 -16.252 45.602 1.00 52.18 H new ATOM 0 HZ3 LYS C 25 22.175 -17.186 44.561 1.00 52.18 H new ATOM 1837 N HIS C 26 24.379 -15.621 42.326 1.00 40.29 N ATOM 1838 CA HIS C 26 24.032 -14.957 41.082 1.00 39.44 C ATOM 1839 C HIS C 26 22.970 -13.928 41.447 1.00 39.87 C ATOM 1840 O HIS C 26 22.160 -14.156 42.348 1.00 40.04 O ATOM 1841 CB HIS C 26 23.421 -15.935 40.082 1.00 39.18 C ATOM 1842 CG HIS C 26 24.362 -16.992 39.601 1.00 38.53 C ATOM 1843 ND1 HIS C 26 25.602 -16.701 39.076 1.00 39.43 N ATOM 1844 CD2 HIS C 26 24.218 -18.334 39.508 1.00 37.54 C ATOM 1845 CE1 HIS C 26 26.180 -17.820 38.676 1.00 40.36 C ATOM 1846 NE2 HIS C 26 25.360 -18.825 38.926 1.00 39.03 N ATOM 0 H HIS C 26 23.996 -16.382 42.442 1.00 40.29 H new ATOM 0 HA HIS C 26 24.822 -14.568 40.676 1.00 39.44 H new ATOM 0 HB2 HIS C 26 22.653 -16.363 40.492 1.00 39.18 H new ATOM 0 HB3 HIS C 26 23.093 -15.436 39.317 1.00 39.18 H new ATOM 0 HD2 HIS C 26 23.483 -18.831 39.786 1.00 37.54 H new ATOM 0 HE1 HIS C 26 27.021 -17.888 38.285 1.00 40.36 H new ATOM 0 HE2 HIS C 26 25.516 -19.653 38.752 1.00 39.03 H new ATOM 1847 N LYS C 27 22.979 -12.796 40.757 1.00 37.86 N ATOM 1848 CA LYS C 27 21.995 -11.748 40.989 1.00 37.30 C ATOM 1849 C LYS C 27 21.453 -11.429 39.598 1.00 36.55 C ATOM 1850 O LYS C 27 21.231 -12.347 38.807 1.00 37.33 O ATOM 1851 CB LYS C 27 22.678 -10.539 41.633 1.00 37.96 C ATOM 1852 CG LYS C 27 23.384 -10.893 42.949 1.00 38.83 C ATOM 1853 CD LYS C 27 24.098 -9.703 43.570 1.00 38.22 C ATOM 1854 CE LYS C 27 23.127 -8.646 44.049 1.00 39.44 C ATOM 1855 NZ LYS C 27 23.845 -7.489 44.649 1.00 41.89 N ATOM 0 H LYS C 27 23.553 -12.613 40.143 1.00 37.86 H new ATOM 0 HA LYS C 27 21.282 -12.008 41.593 1.00 37.30 H new ATOM 0 HB2 LYS C 27 23.325 -10.168 41.012 1.00 37.96 H new ATOM 0 HB3 LYS C 27 22.017 -9.849 41.800 1.00 37.96 H new ATOM 0 HG2 LYS C 27 22.732 -11.239 43.579 1.00 38.83 H new ATOM 0 HG3 LYS C 27 24.026 -11.602 42.787 1.00 38.83 H new ATOM 0 HD2 LYS C 27 24.640 -10.005 44.316 1.00 38.22 H new ATOM 0 HD3 LYS C 27 24.703 -9.314 42.919 1.00 38.22 H new ATOM 0 HE2 LYS C 27 22.583 -8.342 43.306 1.00 39.44 H new ATOM 0 HE3 LYS C 27 22.523 -9.030 44.704 1.00 39.44 H new ATOM 0 HZ1 LYS C 27 23.258 -6.857 44.870 1.00 41.89 H new ATOM 0 HZ2 LYS C 27 24.281 -7.756 45.377 1.00 41.89 H new ATOM 0 HZ3 LYS C 27 24.425 -7.161 44.059 1.00 41.89 H new ATOM 1856 N THR C 28 21.231 -10.158 39.278 1.00 36.03 N ATOM 1857 CA THR C 28 20.756 -9.837 37.936 1.00 33.27 C ATOM 1858 C THR C 28 21.748 -10.427 36.935 1.00 33.81 C ATOM 1859 O THR C 28 21.359 -10.997 35.910 1.00 32.82 O ATOM 1860 CB THR C 28 20.675 -8.327 37.712 1.00 32.19 C ATOM 1861 OG1 THR C 28 19.697 -7.772 38.600 1.00 30.41 O ATOM 1862 CG2 THR C 28 20.281 -8.024 36.266 1.00 31.36 C ATOM 0 H THR C 28 21.344 -9.486 39.803 1.00 36.03 H new ATOM 0 HA THR C 28 19.866 -10.205 37.822 1.00 33.27 H new ATOM 0 HB THR C 28 21.544 -7.933 37.888 1.00 32.19 H new ATOM 0 HG1 THR C 28 19.650 -6.942 38.482 1.00 30.41 H new ATOM 0 HG21 THR C 28 20.233 -7.064 36.138 1.00 31.36 H new ATOM 0 HG22 THR C 28 20.944 -8.398 35.665 1.00 31.36 H new ATOM 0 HG23 THR C 28 19.415 -8.418 36.077 1.00 31.36 H new ATOM 1863 N GLY C 29 23.032 -10.286 37.257 1.00 34.30 N ATOM 1864 CA GLY C 29 24.098 -10.805 36.417 1.00 35.58 C ATOM 1865 C GLY C 29 24.801 -11.971 37.094 1.00 36.51 C ATOM 1866 O GLY C 29 24.534 -12.262 38.262 1.00 36.76 O ATOM 0 H GLY C 29 23.305 -9.887 37.968 1.00 34.30 H new ATOM 0 HA2 GLY C 29 23.733 -11.092 35.565 1.00 35.58 H new ATOM 0 HA3 GLY C 29 24.738 -10.101 36.228 1.00 35.58 H new ATOM 1867 N PRO C 30 25.719 -12.656 36.394 1.00 35.18 N ATOM 1868 CA PRO C 30 26.434 -13.798 36.973 1.00 33.90 C ATOM 1869 C PRO C 30 27.560 -13.473 37.946 1.00 33.11 C ATOM 1870 O PRO C 30 28.124 -12.376 37.934 1.00 34.47 O ATOM 1871 CB PRO C 30 26.959 -14.521 35.742 1.00 34.47 C ATOM 1872 CG PRO C 30 27.307 -13.363 34.837 1.00 33.66 C ATOM 1873 CD PRO C 30 26.073 -12.486 34.973 1.00 32.95 C ATOM 0 HA PRO C 30 25.838 -14.314 37.538 1.00 33.90 H new ATOM 0 HB2 PRO C 30 27.732 -15.071 35.944 1.00 34.47 H new ATOM 0 HB3 PRO C 30 26.291 -15.104 35.348 1.00 34.47 H new ATOM 0 HG2 PRO C 30 28.113 -12.905 35.124 1.00 33.66 H new ATOM 0 HG3 PRO C 30 27.453 -13.647 33.921 1.00 33.66 H new ATOM 0 HD2 PRO C 30 26.262 -11.560 34.756 1.00 32.95 H new ATOM 0 HD3 PRO C 30 25.358 -12.775 34.385 1.00 32.95 H new ATOM 1874 N ASN C 31 27.872 -14.444 38.796 1.00 33.32 N ATOM 1875 CA ASN C 31 28.966 -14.314 39.746 1.00 32.01 C ATOM 1876 C ASN C 31 30.240 -14.268 38.895 1.00 31.49 C ATOM 1877 O ASN C 31 30.381 -15.029 37.932 1.00 30.44 O ATOM 1878 CB ASN C 31 28.992 -15.521 40.686 1.00 31.73 C ATOM 1879 CG ASN C 31 30.273 -15.603 41.483 1.00 32.02 C ATOM 1880 OD1 ASN C 31 31.238 -16.244 41.066 1.00 30.39 O ATOM 1881 ND2 ASN C 31 30.300 -14.929 42.624 1.00 30.58 N ATOM 0 H ASN C 31 27.456 -15.195 38.837 1.00 33.32 H new ATOM 0 HA ASN C 31 28.876 -13.523 40.300 1.00 32.01 H new ATOM 0 HB2 ASN C 31 28.238 -15.470 41.294 1.00 31.73 H new ATOM 0 HB3 ASN C 31 28.884 -16.334 40.168 1.00 31.73 H new ATOM 0 HD21 ASN C 31 31.012 -14.928 43.106 1.00 30.58 H new ATOM 0 HD22 ASN C 31 29.605 -14.493 42.882 1.00 30.58 H new ATOM 1882 N LEU C 32 31.166 -13.383 39.239 1.00 30.54 N ATOM 1883 CA LEU C 32 32.380 -13.246 38.446 1.00 31.17 C ATOM 1884 C LEU C 32 33.645 -13.945 38.947 1.00 32.11 C ATOM 1885 O LEU C 32 34.718 -13.751 38.379 1.00 30.62 O ATOM 1886 CB LEU C 32 32.674 -11.762 38.228 1.00 31.04 C ATOM 1887 CG LEU C 32 31.519 -10.978 37.597 1.00 30.86 C ATOM 1888 CD1 LEU C 32 31.906 -9.514 37.463 1.00 31.08 C ATOM 1889 CD2 LEU C 32 31.163 -11.578 36.242 1.00 30.95 C ATOM 0 H LEU C 32 31.113 -12.858 39.918 1.00 30.54 H new ATOM 0 HA LEU C 32 32.171 -13.719 37.625 1.00 31.17 H new ATOM 0 HB2 LEU C 32 32.897 -11.358 39.081 1.00 31.04 H new ATOM 0 HB3 LEU C 32 33.456 -11.678 37.661 1.00 31.04 H new ATOM 0 HG LEU C 32 30.737 -11.036 38.168 1.00 30.86 H new ATOM 0 HD11 LEU C 32 31.173 -9.021 37.063 1.00 31.08 H new ATOM 0 HD12 LEU C 32 32.101 -9.149 38.340 1.00 31.08 H new ATOM 0 HD13 LEU C 32 32.692 -9.437 36.900 1.00 31.08 H new ATOM 0 HD21 LEU C 32 30.431 -11.077 35.848 1.00 30.95 H new ATOM 0 HD22 LEU C 32 31.935 -11.536 35.656 1.00 30.95 H new ATOM 0 HD23 LEU C 32 30.895 -12.503 36.358 1.00 30.95 H new ATOM 1890 N HIS C 33 33.535 -14.764 39.990 1.00 33.17 N ATOM 1891 CA HIS C 33 34.722 -15.450 40.498 1.00 33.17 C ATOM 1892 C HIS C 33 35.343 -16.379 39.452 1.00 32.22 C ATOM 1893 O HIS C 33 34.642 -17.163 38.807 1.00 31.52 O ATOM 1894 CB HIS C 33 34.407 -16.271 41.754 1.00 33.14 C ATOM 1895 CG HIS C 33 35.628 -16.853 42.394 1.00 35.58 C ATOM 1896 ND1 HIS C 33 36.498 -16.098 43.153 1.00 35.83 N ATOM 1897 CD2 HIS C 33 36.180 -18.086 42.305 1.00 36.96 C ATOM 1898 CE1 HIS C 33 37.534 -16.840 43.500 1.00 36.31 C ATOM 1899 NE2 HIS C 33 37.367 -18.050 42.998 1.00 38.51 N ATOM 0 H HIS C 33 32.803 -14.934 40.409 1.00 33.17 H new ATOM 0 HA HIS C 33 35.357 -14.751 40.718 1.00 33.17 H new ATOM 0 HB2 HIS C 33 33.949 -15.707 42.397 1.00 33.14 H new ATOM 0 HB3 HIS C 33 33.797 -16.988 41.521 1.00 33.14 H new ATOM 0 HD1 HIS C 33 36.384 -15.273 43.367 1.00 35.83 H new ATOM 0 HD2 HIS C 33 35.823 -18.820 41.859 1.00 36.96 H new ATOM 0 HE1 HIS C 33 38.258 -16.558 44.011 1.00 36.31 H new ATOM 1900 N GLY C 34 36.659 -16.281 39.293 1.00 30.48 N ATOM 1901 CA GLY C 34 37.360 -17.123 38.342 1.00 30.47 C ATOM 1902 C GLY C 34 37.177 -16.674 36.907 1.00 31.14 C ATOM 1903 O GLY C 34 37.382 -17.460 35.985 1.00 30.55 O ATOM 0 H GLY C 34 37.160 -15.733 39.727 1.00 30.48 H new ATOM 0 HA2 GLY C 34 38.306 -17.126 38.556 1.00 30.47 H new ATOM 0 HA3 GLY C 34 37.045 -18.036 38.433 1.00 30.47 H new ATOM 1904 N LEU C 35 36.807 -15.407 36.724 1.00 30.44 N ATOM 1905 CA LEU C 35 36.574 -14.821 35.399 1.00 29.44 C ATOM 1906 C LEU C 35 37.766 -14.893 34.444 1.00 28.76 C ATOM 1907 O LEU C 35 37.618 -15.292 33.285 1.00 28.50 O ATOM 1908 CB LEU C 35 36.146 -13.353 35.546 1.00 29.32 C ATOM 1909 CG LEU C 35 35.730 -12.631 34.259 1.00 29.02 C ATOM 1910 CD1 LEU C 35 34.420 -13.222 33.740 1.00 27.81 C ATOM 1911 CD2 LEU C 35 35.567 -11.140 34.531 1.00 28.19 C ATOM 0 H LEU C 35 36.682 -14.856 37.372 1.00 30.44 H new ATOM 0 HA LEU C 35 35.873 -15.362 35.002 1.00 29.44 H new ATOM 0 HB2 LEU C 35 35.404 -13.314 36.170 1.00 29.32 H new ATOM 0 HB3 LEU C 35 36.880 -12.861 35.947 1.00 29.32 H new ATOM 0 HG LEU C 35 36.418 -12.751 33.586 1.00 29.02 H new ATOM 0 HD11 LEU C 35 34.158 -12.764 32.926 1.00 27.81 H new ATOM 0 HD12 LEU C 35 34.542 -14.166 33.555 1.00 27.81 H new ATOM 0 HD13 LEU C 35 33.727 -13.111 34.410 1.00 27.81 H new ATOM 0 HD21 LEU C 35 35.304 -10.689 33.714 1.00 28.19 H new ATOM 0 HD22 LEU C 35 34.885 -11.007 35.207 1.00 28.19 H new ATOM 0 HD23 LEU C 35 36.409 -10.774 34.845 1.00 28.19 H new ATOM 1912 N PHE C 36 38.942 -14.490 34.923 1.00 27.59 N ATOM 1913 CA PHE C 36 40.144 -14.504 34.090 1.00 27.67 C ATOM 1914 C PHE C 36 40.555 -15.909 33.664 1.00 26.76 C ATOM 1915 O PHE C 36 40.725 -16.797 34.493 1.00 25.50 O ATOM 1916 CB PHE C 36 41.313 -13.827 34.819 1.00 29.53 C ATOM 1917 CG PHE C 36 41.139 -12.343 34.994 1.00 31.31 C ATOM 1918 CD1 PHE C 36 40.126 -11.837 35.806 1.00 30.84 C ATOM 1919 CD2 PHE C 36 41.968 -11.450 34.320 1.00 31.04 C ATOM 1920 CE1 PHE C 36 39.940 -10.461 35.941 1.00 33.71 C ATOM 1921 CE2 PHE C 36 41.791 -10.078 34.449 1.00 33.98 C ATOM 1922 CZ PHE C 36 40.775 -9.580 35.260 1.00 31.57 C ATOM 0 H PHE C 36 39.065 -14.206 35.725 1.00 27.59 H new ATOM 0 HA PHE C 36 39.924 -14.009 33.285 1.00 27.67 H new ATOM 0 HB2 PHE C 36 41.421 -14.237 35.691 1.00 29.53 H new ATOM 0 HB3 PHE C 36 42.131 -13.993 34.325 1.00 29.53 H new ATOM 0 HD1 PHE C 36 39.567 -12.423 36.263 1.00 30.84 H new ATOM 0 HD2 PHE C 36 42.649 -11.776 33.777 1.00 31.04 H new ATOM 0 HE1 PHE C 36 39.260 -10.133 36.484 1.00 33.71 H new ATOM 0 HE2 PHE C 36 42.351 -9.492 33.993 1.00 33.98 H new ATOM 0 HZ PHE C 36 40.655 -8.662 35.346 1.00 31.57 H new ATOM 1923 N GLY C 37 40.704 -16.096 32.359 1.00 25.70 N ATOM 1924 CA GLY C 37 41.099 -17.388 31.832 1.00 26.37 C ATOM 1925 C GLY C 37 39.912 -18.216 31.398 1.00 25.86 C ATOM 1926 O GLY C 37 40.069 -19.246 30.749 1.00 26.64 O ATOM 0 H GLY C 37 40.581 -15.487 31.765 1.00 25.70 H new ATOM 0 HA2 GLY C 37 41.694 -17.259 31.077 1.00 26.37 H new ATOM 0 HA3 GLY C 37 41.599 -17.872 32.508 1.00 26.37 H new ATOM 1927 N ARG C 38 38.717 -17.755 31.747 1.00 25.96 N ATOM 1928 CA ARG C 38 37.493 -18.457 31.395 1.00 25.37 C ATOM 1929 C ARG C 38 36.765 -17.845 30.192 1.00 24.89 C ATOM 1930 O ARG C 38 36.748 -16.624 30.010 1.00 23.01 O ATOM 1931 CB ARG C 38 36.559 -18.481 32.601 1.00 27.80 C ATOM 1932 CG ARG C 38 35.328 -19.334 32.391 1.00 31.17 C ATOM 1933 CD ARG C 38 34.574 -19.507 33.686 1.00 33.80 C ATOM 1934 NE ARG C 38 34.001 -18.258 34.171 1.00 35.47 N ATOM 1935 CZ ARG C 38 33.807 -17.991 35.458 1.00 38.38 C ATOM 1936 NH1 ARG C 38 33.273 -16.835 35.824 1.00 39.72 N ATOM 1937 NH2 ARG C 38 34.166 -18.878 36.380 1.00 38.60 N ATOM 0 H ARG C 38 38.594 -17.030 32.192 1.00 25.96 H new ATOM 0 HA ARG C 38 37.748 -19.357 31.137 1.00 25.37 H new ATOM 0 HB2 ARG C 38 37.046 -18.812 33.372 1.00 27.80 H new ATOM 0 HB3 ARG C 38 36.284 -17.574 32.807 1.00 27.80 H new ATOM 0 HG2 ARG C 38 34.752 -18.922 31.728 1.00 31.17 H new ATOM 0 HG3 ARG C 38 35.585 -20.202 32.043 1.00 31.17 H new ATOM 0 HD2 ARG C 38 33.865 -20.157 33.559 1.00 33.80 H new ATOM 0 HD3 ARG C 38 35.172 -19.868 34.359 1.00 33.80 H new ATOM 0 HE ARG C 38 33.776 -17.662 33.593 1.00 35.47 H new ATOM 0 HH11 ARG C 38 33.051 -16.256 35.228 1.00 39.72 H new ATOM 0 HH12 ARG C 38 33.148 -16.664 36.657 1.00 39.72 H new ATOM 0 HH21 ARG C 38 34.523 -19.624 36.143 1.00 38.60 H new ATOM 0 HH22 ARG C 38 34.041 -18.706 37.213 1.00 38.60 H new ATOM 1938 N LYS C 39 36.177 -18.707 29.369 1.00 24.56 N ATOM 1939 CA LYS C 39 35.437 -18.269 28.195 1.00 26.05 C ATOM 1940 C LYS C 39 34.170 -17.563 28.631 1.00 28.36 C ATOM 1941 O LYS C 39 33.681 -17.772 29.747 1.00 28.42 O ATOM 1942 CB LYS C 39 35.047 -19.457 27.316 1.00 26.30 C ATOM 1943 CG LYS C 39 36.088 -19.861 26.283 1.00 29.72 C ATOM 1944 CD LYS C 39 35.568 -21.006 25.429 1.00 31.28 C ATOM 1945 CE LYS C 39 36.536 -21.345 24.305 1.00 36.38 C ATOM 1946 NZ LYS C 39 36.103 -22.547 23.529 1.00 38.67 N ATOM 0 H LYS C 39 36.197 -19.560 29.476 1.00 24.56 H new ATOM 0 HA LYS C 39 36.007 -17.671 27.687 1.00 26.05 H new ATOM 0 HB2 LYS C 39 34.865 -20.219 27.888 1.00 26.30 H new ATOM 0 HB3 LYS C 39 34.220 -19.244 26.856 1.00 26.30 H new ATOM 0 HG2 LYS C 39 36.305 -19.102 25.720 1.00 29.72 H new ATOM 0 HG3 LYS C 39 36.908 -20.128 26.728 1.00 29.72 H new ATOM 0 HD2 LYS C 39 35.428 -21.789 25.985 1.00 31.28 H new ATOM 0 HD3 LYS C 39 34.706 -20.767 25.054 1.00 31.28 H new ATOM 0 HE2 LYS C 39 36.612 -20.586 23.706 1.00 36.38 H new ATOM 0 HE3 LYS C 39 37.418 -21.503 24.677 1.00 36.38 H new ATOM 0 HZ1 LYS C 39 36.693 -22.712 22.883 1.00 38.67 H new ATOM 0 HZ2 LYS C 39 36.054 -23.250 24.073 1.00 38.67 H new ATOM 0 HZ3 LYS C 39 35.304 -22.396 23.168 1.00 38.67 H new ATOM 1947 N THR C 40 33.638 -16.740 27.736 1.00 28.75 N ATOM 1948 CA THR C 40 32.415 -16.002 27.997 1.00 28.30 C ATOM 1949 C THR C 40 31.269 -16.941 28.318 1.00 29.79 C ATOM 1950 O THR C 40 31.167 -18.029 27.744 1.00 31.42 O ATOM 1951 CB THR C 40 32.004 -15.156 26.779 1.00 29.53 C ATOM 1952 OG1 THR C 40 32.012 -15.975 25.602 1.00 29.47 O ATOM 1953 CG2 THR C 40 32.956 -13.987 26.594 1.00 27.60 C ATOM 0 H THR C 40 33.978 -16.595 26.960 1.00 28.75 H new ATOM 0 HA THR C 40 32.596 -15.425 28.755 1.00 28.30 H new ATOM 0 HB THR C 40 31.111 -14.807 26.929 1.00 29.53 H new ATOM 0 HG1 THR C 40 32.649 -15.745 25.105 1.00 29.47 H new ATOM 0 HG21 THR C 40 32.682 -13.465 25.823 1.00 27.60 H new ATOM 0 HG22 THR C 40 32.939 -13.427 27.386 1.00 27.60 H new ATOM 0 HG23 THR C 40 33.856 -14.321 26.455 1.00 27.60 H new ATOM 1954 N GLY C 41 30.418 -16.508 29.243 1.00 29.44 N ATOM 1955 CA GLY C 41 29.252 -17.280 29.636 1.00 32.37 C ATOM 1956 C GLY C 41 29.467 -18.682 30.175 1.00 34.37 C ATOM 1957 O GLY C 41 28.794 -19.613 29.732 1.00 35.30 O ATOM 0 H GLY C 41 30.503 -15.760 29.658 1.00 29.44 H new ATOM 0 HA2 GLY C 41 28.775 -16.773 30.312 1.00 32.37 H new ATOM 0 HA3 GLY C 41 28.667 -17.346 28.865 1.00 32.37 H new ATOM 1958 N GLN C 42 30.366 -18.849 31.141 1.00 34.37 N ATOM 1959 CA GLN C 42 30.615 -20.182 31.679 1.00 36.58 C ATOM 1960 C GLN C 42 30.258 -20.348 33.150 1.00 36.04 C ATOM 1961 O GLN C 42 30.399 -21.438 33.699 1.00 40.81 O ATOM 1962 CB GLN C 42 32.077 -20.585 31.457 1.00 35.55 C ATOM 1963 CG GLN C 42 32.495 -20.673 29.997 1.00 41.52 C ATOM 1964 CD GLN C 42 31.573 -21.555 29.161 1.00 45.90 C ATOM 1965 OE1 GLN C 42 31.267 -22.687 29.537 1.00 47.19 O ATOM 1966 NE2 GLN C 42 31.135 -21.037 28.013 1.00 46.21 N ATOM 0 H GLN C 42 30.833 -18.218 31.492 1.00 34.37 H new ATOM 0 HA GLN C 42 30.020 -20.770 31.188 1.00 36.58 H new ATOM 0 HB2 GLN C 42 32.649 -19.943 31.907 1.00 35.55 H new ATOM 0 HB3 GLN C 42 32.230 -21.446 31.878 1.00 35.55 H new ATOM 0 HG2 GLN C 42 32.512 -19.781 29.617 1.00 41.52 H new ATOM 0 HG3 GLN C 42 33.399 -21.020 29.946 1.00 41.52 H new ATOM 0 HE21 GLN C 42 31.370 -20.242 27.783 1.00 46.21 H new ATOM 0 HE22 GLN C 42 30.618 -21.498 27.503 1.00 46.21 H new ATOM 1967 N ALA C 43 29.803 -19.280 33.794 1.00 35.78 N ATOM 1968 CA ALA C 43 29.428 -19.364 35.199 1.00 35.46 C ATOM 1969 C ALA C 43 28.317 -20.407 35.360 1.00 37.78 C ATOM 1970 O ALA C 43 27.249 -20.298 34.753 1.00 35.05 O ATOM 1971 CB ALA C 43 28.957 -18.018 35.694 1.00 35.94 C ATOM 0 H ALA C 43 29.704 -18.503 33.439 1.00 35.78 H new ATOM 0 HA ALA C 43 30.199 -19.630 35.725 1.00 35.46 H new ATOM 0 HB1 ALA C 43 28.710 -18.085 36.630 1.00 35.94 H new ATOM 0 HB2 ALA C 43 29.671 -17.369 35.594 1.00 35.94 H new ATOM 0 HB3 ALA C 43 28.187 -17.734 35.177 1.00 35.94 H new ATOM 1972 N PRO C 44 28.563 -21.444 36.179 1.00 39.23 N ATOM 1973 CA PRO C 44 27.562 -22.492 36.393 1.00 39.52 C ATOM 1974 C PRO C 44 26.325 -21.952 37.102 1.00 37.62 C ATOM 1975 O PRO C 44 26.439 -21.154 38.033 1.00 37.68 O ATOM 1976 CB PRO C 44 28.320 -23.509 37.244 1.00 41.47 C ATOM 1977 CG PRO C 44 29.167 -22.630 38.110 1.00 41.36 C ATOM 1978 CD PRO C 44 29.700 -21.608 37.107 1.00 41.16 C ATOM 0 HA PRO C 44 27.216 -22.871 35.570 1.00 39.52 H new ATOM 0 HB2 PRO C 44 27.719 -24.062 37.767 1.00 41.47 H new ATOM 0 HB3 PRO C 44 28.856 -24.107 36.701 1.00 41.47 H new ATOM 0 HG2 PRO C 44 28.650 -22.210 38.816 1.00 41.36 H new ATOM 0 HG3 PRO C 44 29.883 -23.125 38.539 1.00 41.36 H new ATOM 0 HD2 PRO C 44 29.939 -20.772 37.537 1.00 41.16 H new ATOM 0 HD3 PRO C 44 30.494 -21.930 36.652 1.00 41.16 H new ATOM 1979 N GLY C 45 25.146 -22.366 36.649 1.00 36.40 N ATOM 1980 CA GLY C 45 23.922 -21.914 37.292 1.00 36.85 C ATOM 1981 C GLY C 45 23.308 -20.622 36.779 1.00 37.21 C ATOM 1982 O GLY C 45 22.247 -20.214 37.255 1.00 35.39 O ATOM 0 H GLY C 45 25.035 -22.899 35.983 1.00 36.40 H new ATOM 0 HA2 GLY C 45 23.259 -22.617 37.206 1.00 36.85 H new ATOM 0 HA3 GLY C 45 24.101 -21.807 38.239 1.00 36.85 H new ATOM 1983 N PHE C 46 23.958 -19.977 35.814 1.00 35.38 N ATOM 1984 CA PHE C 46 23.431 -18.734 35.264 1.00 33.49 C ATOM 1985 C PHE C 46 23.062 -18.902 33.795 1.00 33.23 C ATOM 1986 O PHE C 46 23.845 -19.430 33.005 1.00 33.68 O ATOM 1987 CB PHE C 46 24.456 -17.605 35.400 1.00 33.26 C ATOM 1988 CG PHE C 46 23.915 -16.250 35.025 1.00 32.61 C ATOM 1989 CD1 PHE C 46 23.320 -15.435 35.981 1.00 31.61 C ATOM 1990 CD2 PHE C 46 23.959 -15.809 33.700 1.00 32.47 C ATOM 1991 CE1 PHE C 46 22.771 -14.195 35.626 1.00 31.39 C ATOM 1992 CE2 PHE C 46 23.413 -14.574 33.335 1.00 31.11 C ATOM 1993 CZ PHE C 46 22.819 -13.768 34.303 1.00 30.84 C ATOM 0 H PHE C 46 24.700 -20.240 35.467 1.00 35.38 H new ATOM 0 HA PHE C 46 22.634 -18.506 35.767 1.00 33.49 H new ATOM 0 HB2 PHE C 46 24.774 -17.576 36.316 1.00 33.26 H new ATOM 0 HB3 PHE C 46 25.222 -17.805 34.840 1.00 33.26 H new ATOM 0 HD1 PHE C 46 23.286 -15.716 36.867 1.00 31.61 H new ATOM 0 HD2 PHE C 46 24.357 -16.344 33.052 1.00 32.47 H new ATOM 0 HE1 PHE C 46 22.375 -13.658 36.274 1.00 31.39 H new ATOM 0 HE2 PHE C 46 23.447 -14.292 32.449 1.00 31.11 H new ATOM 0 HZ PHE C 46 22.455 -12.946 34.065 1.00 30.84 H new ATOM 1994 N THR C 47 21.864 -18.455 33.434 1.00 31.90 N ATOM 1995 CA THR C 47 21.401 -18.537 32.055 1.00 31.59 C ATOM 1996 C THR C 47 21.764 -17.228 31.371 1.00 27.56 C ATOM 1997 O THR C 47 21.294 -16.166 31.755 1.00 27.57 O ATOM 1998 CB THR C 47 19.865 -18.739 31.962 1.00 32.38 C ATOM 1999 OG1 THR C 47 19.498 -19.969 32.603 1.00 34.52 O ATOM 2000 CG2 THR C 47 19.426 -18.784 30.503 1.00 33.18 C ATOM 0 H THR C 47 21.301 -18.098 33.977 1.00 31.90 H new ATOM 0 HA THR C 47 21.822 -19.301 31.631 1.00 31.59 H new ATOM 0 HB THR C 47 19.427 -17.995 32.405 1.00 32.38 H new ATOM 0 HG1 THR C 47 18.666 -20.074 32.552 1.00 34.52 H new ATOM 0 HG21 THR C 47 18.465 -18.910 30.458 1.00 33.18 H new ATOM 0 HG22 THR C 47 19.663 -17.950 30.068 1.00 33.18 H new ATOM 0 HG23 THR C 47 19.870 -19.520 30.054 1.00 33.18 H new ATOM 2001 N TYR C 48 22.616 -17.327 30.365 1.00 27.13 N ATOM 2002 CA TYR C 48 23.084 -16.177 29.599 1.00 27.40 C ATOM 2003 C TYR C 48 22.253 -16.034 28.337 1.00 25.50 C ATOM 2004 O TYR C 48 21.448 -16.899 28.022 1.00 24.79 O ATOM 2005 CB TYR C 48 24.528 -16.406 29.161 1.00 26.61 C ATOM 2006 CG TYR C 48 25.550 -16.451 30.266 1.00 29.00 C ATOM 2007 CD1 TYR C 48 26.296 -15.319 30.586 1.00 29.05 C ATOM 2008 CD2 TYR C 48 25.820 -17.640 30.953 1.00 29.24 C ATOM 2009 CE1 TYR C 48 27.296 -15.363 31.550 1.00 30.55 C ATOM 2010 CE2 TYR C 48 26.824 -17.693 31.929 1.00 29.24 C ATOM 2011 CZ TYR C 48 27.559 -16.553 32.212 1.00 29.69 C ATOM 2012 OH TYR C 48 28.616 -16.605 33.090 1.00 30.71 O ATOM 0 H TYR C 48 22.947 -18.076 30.101 1.00 27.13 H new ATOM 0 HA TYR C 48 23.011 -15.386 30.155 1.00 27.40 H new ATOM 0 HB2 TYR C 48 24.570 -17.242 28.670 1.00 26.61 H new ATOM 0 HB3 TYR C 48 24.776 -15.701 28.543 1.00 26.61 H new ATOM 0 HD1 TYR C 48 26.121 -14.518 30.146 1.00 29.05 H new ATOM 0 HD2 TYR C 48 25.327 -18.404 30.759 1.00 29.24 H new ATOM 0 HE1 TYR C 48 27.786 -14.599 31.750 1.00 30.55 H new ATOM 0 HE2 TYR C 48 26.996 -18.486 32.383 1.00 29.24 H new ATOM 0 HH TYR C 48 29.225 -16.090 32.827 1.00 30.71 H new ATOM 2013 N THR C 49 22.456 -14.938 27.613 1.00 26.31 N ATOM 2014 CA THR C 49 21.771 -14.766 26.342 1.00 24.84 C ATOM 2015 C THR C 49 22.578 -15.702 25.452 1.00 23.67 C ATOM 2016 O THR C 49 23.699 -16.067 25.797 1.00 20.31 O ATOM 2017 CB THR C 49 21.929 -13.336 25.758 1.00 23.98 C ATOM 2018 OG1 THR C 49 23.322 -12.994 25.702 1.00 23.84 O ATOM 2019 CG2 THR C 49 21.171 -12.316 26.594 1.00 19.88 C ATOM 0 H THR C 49 22.978 -14.293 27.837 1.00 26.31 H new ATOM 0 HA THR C 49 20.818 -14.929 26.417 1.00 24.84 H new ATOM 0 HB THR C 49 21.555 -13.324 24.863 1.00 23.98 H new ATOM 0 HG1 THR C 49 23.514 -12.493 26.348 1.00 23.84 H new ATOM 0 HG21 THR C 49 21.285 -11.433 26.209 1.00 19.88 H new ATOM 0 HG22 THR C 49 20.228 -12.544 26.606 1.00 19.88 H new ATOM 0 HG23 THR C 49 21.516 -12.320 27.501 1.00 19.88 H new ATOM 2020 N ASP C 50 22.018 -16.109 24.324 1.00 22.93 N ATOM 2021 CA ASP C 50 22.767 -16.969 23.419 1.00 25.52 C ATOM 2022 C ASP C 50 24.009 -16.191 22.968 1.00 26.14 C ATOM 2023 O ASP C 50 25.062 -16.773 22.695 1.00 24.68 O ATOM 2024 CB ASP C 50 21.892 -17.339 22.221 1.00 28.44 C ATOM 2025 CG ASP C 50 20.713 -18.210 22.619 1.00 31.54 C ATOM 2026 OD1 ASP C 50 19.723 -18.279 21.856 1.00 30.26 O ATOM 2027 OD2 ASP C 50 20.788 -18.831 23.701 1.00 32.47 O ATOM 0 H ASP C 50 21.223 -15.905 24.066 1.00 22.93 H new ATOM 0 HA ASP C 50 23.033 -17.792 23.858 1.00 25.52 H new ATOM 0 HB2 ASP C 50 21.566 -16.529 21.798 1.00 28.44 H new ATOM 0 HB3 ASP C 50 22.429 -17.806 21.562 1.00 28.44 H new ATOM 2028 N ALA C 51 23.880 -14.866 22.913 1.00 26.67 N ATOM 2029 CA ALA C 51 24.985 -14.006 22.504 1.00 26.61 C ATOM 2030 C ALA C 51 26.176 -14.080 23.470 1.00 25.50 C ATOM 2031 O ALA C 51 27.313 -14.267 23.040 1.00 24.86 O ATOM 2032 CB ALA C 51 24.500 -12.560 22.373 1.00 26.31 C ATOM 0 H ALA C 51 23.156 -14.445 23.110 1.00 26.67 H new ATOM 0 HA ALA C 51 25.297 -14.327 21.643 1.00 26.61 H new ATOM 0 HB1 ALA C 51 25.239 -11.994 22.101 1.00 26.31 H new ATOM 0 HB2 ALA C 51 23.796 -12.514 21.707 1.00 26.31 H new ATOM 0 HB3 ALA C 51 24.157 -12.255 23.228 1.00 26.31 H new ATOM 2033 N ASN C 52 25.917 -13.939 24.769 1.00 24.89 N ATOM 2034 CA ASN C 52 26.990 -13.985 25.773 1.00 25.90 C ATOM 2035 C ASN C 52 27.495 -15.432 25.904 1.00 28.20 C ATOM 2036 O ASN C 52 28.688 -15.684 26.107 1.00 27.79 O ATOM 2037 CB ASN C 52 26.460 -13.451 27.120 1.00 22.72 C ATOM 2038 CG ASN C 52 27.572 -13.055 28.095 1.00 22.13 C ATOM 2039 OD1 ASN C 52 27.375 -12.197 28.962 1.00 23.64 O ATOM 2040 ND2 ASN C 52 28.726 -13.686 27.973 1.00 20.64 N ATOM 0 H ASN C 52 25.130 -13.816 25.093 1.00 24.89 H new ATOM 0 HA ASN C 52 27.732 -13.424 25.499 1.00 25.90 H new ATOM 0 HB2 ASN C 52 25.894 -12.681 26.955 1.00 22.72 H new ATOM 0 HB3 ASN C 52 25.903 -14.129 27.533 1.00 22.72 H new ATOM 0 HD21 ASN C 52 29.374 -13.505 28.509 1.00 20.64 H new ATOM 0 HD22 ASN C 52 28.829 -14.278 27.358 1.00 20.64 H new ATOM 2041 N LYS C 53 26.579 -16.384 25.765 1.00 29.39 N ATOM 2042 CA LYS C 53 26.940 -17.792 25.856 1.00 29.45 C ATOM 2043 C LYS C 53 27.863 -18.199 24.709 1.00 30.44 C ATOM 2044 O LYS C 53 28.811 -18.957 24.906 1.00 31.40 O ATOM 2045 CB LYS C 53 25.687 -18.667 25.823 0.50 28.93 C ATOM 2046 CG LYS C 53 25.976 -20.160 25.701 0.50 27.44 C ATOM 2047 CD LYS C 53 25.592 -20.919 26.962 0.50 27.38 C ATOM 2048 CE LYS C 53 26.338 -20.408 28.181 0.50 25.76 C ATOM 2049 NZ LYS C 53 26.042 -21.237 29.380 0.50 29.26 N ATOM 0 H LYS C 53 25.745 -16.236 25.618 1.00 29.39 H new ATOM 0 HA LYS C 53 27.406 -17.921 26.697 1.00 29.45 H new ATOM 0 HB2 LYS C 53 25.174 -18.511 26.631 0.50 28.93 H new ATOM 0 HB3 LYS C 53 25.132 -18.392 25.077 0.50 28.93 H new ATOM 0 HG2 LYS C 53 25.488 -20.522 24.945 0.50 27.44 H new ATOM 0 HG3 LYS C 53 26.920 -20.292 25.519 0.50 27.44 H new ATOM 0 HD2 LYS C 53 24.637 -20.837 27.110 0.50 27.38 H new ATOM 0 HD3 LYS C 53 25.780 -21.863 26.841 0.50 27.38 H new ATOM 0 HE2 LYS C 53 27.292 -20.417 28.006 0.50 25.76 H new ATOM 0 HE3 LYS C 53 26.089 -19.486 28.353 0.50 25.76 H new ATOM 0 HZ1 LYS C 53 26.632 -21.053 30.021 0.50 29.26 H new ATOM 0 HZ2 LYS C 53 25.221 -21.055 29.672 0.50 29.26 H new ATOM 0 HZ3 LYS C 53 26.096 -22.099 29.166 0.50 29.26 H new ATOM 2050 N ASN C 54 27.596 -17.679 23.518 1.00 30.42 N ATOM 2051 CA ASN C 54 28.389 -18.044 22.354 1.00 31.84 C ATOM 2052 C ASN C 54 29.375 -17.018 21.794 1.00 30.84 C ATOM 2053 O ASN C 54 29.796 -17.142 20.639 1.00 31.19 O ATOM 2054 CB ASN C 54 27.452 -18.507 21.236 1.00 34.31 C ATOM 2055 CG ASN C 54 26.579 -19.668 21.662 1.00 38.13 C ATOM 2056 OD1 ASN C 54 27.011 -20.535 22.425 1.00 41.21 O ATOM 2057 ND2 ASN C 54 25.350 -19.701 21.164 1.00 40.46 N ATOM 0 H ASN C 54 26.964 -17.117 23.363 1.00 30.42 H new ATOM 0 HA ASN C 54 28.969 -18.745 22.690 1.00 31.84 H new ATOM 0 HB2 ASN C 54 26.890 -17.766 20.961 1.00 34.31 H new ATOM 0 HB3 ASN C 54 27.978 -18.767 20.463 1.00 34.31 H new ATOM 0 HD21 ASN C 54 24.819 -20.345 21.371 1.00 40.46 H new ATOM 0 HD22 ASN C 54 25.084 -19.078 20.634 1.00 40.46 H new ATOM 2058 N LYS C 55 29.747 -16.014 22.585 1.00 27.95 N ATOM 2059 CA LYS C 55 30.697 -15.016 22.111 1.00 27.67 C ATOM 2060 C LYS C 55 31.982 -15.754 21.740 1.00 28.84 C ATOM 2061 O LYS C 55 32.628 -15.443 20.738 1.00 29.72 O ATOM 2062 CB LYS C 55 30.978 -13.970 23.196 1.00 27.32 C ATOM 2063 CG LYS C 55 32.048 -12.950 22.811 1.00 26.50 C ATOM 2064 CD LYS C 55 31.722 -12.230 21.493 1.00 26.39 C ATOM 2065 CE LYS C 55 32.808 -11.220 21.131 1.00 25.09 C ATOM 2066 NZ LYS C 55 32.579 -10.526 19.813 1.00 23.41 N ATOM 0 H LYS C 55 29.465 -15.895 23.388 1.00 27.95 H new ATOM 0 HA LYS C 55 30.335 -14.545 21.344 1.00 27.67 H new ATOM 0 HB2 LYS C 55 30.155 -13.500 23.401 1.00 27.32 H new ATOM 0 HB3 LYS C 55 31.254 -14.425 24.007 1.00 27.32 H new ATOM 0 HG2 LYS C 55 32.138 -12.295 23.521 1.00 26.50 H new ATOM 0 HG3 LYS C 55 32.904 -13.398 22.729 1.00 26.50 H new ATOM 0 HD2 LYS C 55 31.632 -12.881 20.780 1.00 26.39 H new ATOM 0 HD3 LYS C 55 30.868 -11.776 21.572 1.00 26.39 H new ATOM 0 HE2 LYS C 55 32.864 -10.553 21.833 1.00 25.09 H new ATOM 0 HE3 LYS C 55 33.664 -11.675 21.103 1.00 25.09 H new ATOM 0 HZ1 LYS C 55 33.341 -10.161 19.533 1.00 23.41 H new ATOM 0 HZ2 LYS C 55 32.295 -11.117 19.211 1.00 23.41 H new ATOM 0 HZ3 LYS C 55 31.966 -9.889 19.915 1.00 23.41 H new ATOM 2067 N GLY C 56 32.351 -16.726 22.564 1.00 28.77 N ATOM 2068 CA GLY C 56 33.525 -17.532 22.282 1.00 30.61 C ATOM 2069 C GLY C 56 34.896 -17.024 22.691 1.00 30.67 C ATOM 2070 O GLY C 56 35.884 -17.721 22.482 1.00 33.70 O ATOM 0 H GLY C 56 31.936 -16.933 23.288 1.00 28.77 H new ATOM 0 HA2 GLY C 56 33.395 -18.394 22.708 1.00 30.61 H new ATOM 0 HA3 GLY C 56 33.547 -17.689 21.325 1.00 30.61 H new ATOM 2071 N ILE C 57 34.986 -15.835 23.273 1.00 28.30 N ATOM 2072 CA ILE C 57 36.296 -15.322 23.667 1.00 27.13 C ATOM 2073 C ILE C 57 36.628 -15.658 25.116 1.00 25.36 C ATOM 2074 O ILE C 57 35.752 -16.043 25.891 1.00 25.83 O ATOM 2075 CB ILE C 57 36.388 -13.789 23.457 1.00 25.72 C ATOM 2076 CG1 ILE C 57 35.428 -13.056 24.399 1.00 24.83 C ATOM 2077 CG2 ILE C 57 36.064 -13.454 22.007 1.00 25.48 C ATOM 2078 CD1 ILE C 57 36.004 -12.760 25.782 1.00 25.08 C ATOM 0 H ILE C 57 34.320 -15.319 23.446 1.00 28.30 H new ATOM 0 HA ILE C 57 36.946 -15.760 23.095 1.00 27.13 H new ATOM 0 HB ILE C 57 37.291 -13.497 23.659 1.00 25.72 H new ATOM 0 HG12 ILE C 57 35.162 -12.220 23.986 1.00 24.83 H new ATOM 0 HG13 ILE C 57 34.624 -13.589 24.503 1.00 24.83 H new ATOM 0 HG21 ILE C 57 36.122 -12.495 21.876 1.00 25.48 H new ATOM 0 HG22 ILE C 57 36.698 -13.899 21.423 1.00 25.48 H new ATOM 0 HG23 ILE C 57 35.166 -13.755 21.798 1.00 25.48 H new ATOM 0 HD11 ILE C 57 35.340 -12.297 26.317 1.00 25.08 H new ATOM 0 HD12 ILE C 57 36.246 -13.593 26.217 1.00 25.08 H new ATOM 0 HD13 ILE C 57 36.792 -12.202 25.692 1.00 25.08 H new ATOM 2079 N THR C 58 37.901 -15.524 25.471 1.00 22.72 N ATOM 2080 CA THR C 58 38.327 -15.795 26.833 1.00 25.48 C ATOM 2081 C THR C 58 38.530 -14.472 27.562 1.00 24.53 C ATOM 2082 O THR C 58 39.214 -13.574 27.074 1.00 24.56 O ATOM 2083 CB THR C 58 39.642 -16.618 26.860 1.00 27.19 C ATOM 2084 OG1 THR C 58 39.445 -17.852 26.153 1.00 29.03 O ATOM 2085 CG2 THR C 58 40.055 -16.933 28.302 1.00 26.90 C ATOM 0 H THR C 58 38.530 -15.278 24.939 1.00 22.72 H new ATOM 0 HA THR C 58 37.640 -16.319 27.275 1.00 25.48 H new ATOM 0 HB THR C 58 40.342 -16.095 26.438 1.00 27.19 H new ATOM 0 HG1 THR C 58 39.285 -17.690 25.344 1.00 29.03 H new ATOM 0 HG21 THR C 58 40.878 -17.447 28.298 1.00 26.90 H new ATOM 0 HG22 THR C 58 40.194 -16.105 28.787 1.00 26.90 H new ATOM 0 HG23 THR C 58 39.355 -17.447 28.734 1.00 26.90 H new ATOM 2086 N TRP C 59 37.919 -14.342 28.732 1.00 25.32 N ATOM 2087 CA TRP C 59 38.062 -13.118 29.496 1.00 24.55 C ATOM 2088 C TRP C 59 39.480 -12.958 30.009 1.00 25.85 C ATOM 2089 O TRP C 59 40.040 -13.870 30.625 1.00 24.84 O ATOM 2090 CB TRP C 59 37.078 -13.097 30.664 1.00 22.70 C ATOM 2091 CG TRP C 59 35.674 -12.857 30.224 1.00 22.37 C ATOM 2092 CD1 TRP C 59 34.572 -13.611 30.531 1.00 23.89 C ATOM 2093 CD2 TRP C 59 35.206 -11.772 29.420 1.00 22.70 C ATOM 2094 NE1 TRP C 59 33.446 -13.057 29.970 1.00 24.24 N ATOM 2095 CE2 TRP C 59 33.805 -11.927 29.282 1.00 23.62 C ATOM 2096 CE3 TRP C 59 35.832 -10.680 28.802 1.00 21.13 C ATOM 2097 CZ2 TRP C 59 33.020 -11.033 28.554 1.00 21.80 C ATOM 2098 CZ3 TRP C 59 35.052 -9.789 28.076 1.00 22.09 C ATOM 2099 CH2 TRP C 59 33.657 -9.973 27.959 1.00 22.70 C ATOM 0 H TRP C 59 37.424 -14.944 29.096 1.00 25.32 H new ATOM 0 HA TRP C 59 37.865 -12.374 28.905 1.00 24.55 H new ATOM 0 HB2 TRP C 59 37.125 -13.942 31.138 1.00 22.70 H new ATOM 0 HB3 TRP C 59 37.340 -12.405 31.291 1.00 22.70 H new ATOM 0 HD1 TRP C 59 34.584 -14.386 31.045 1.00 23.89 H new ATOM 0 HE1 TRP C 59 32.647 -13.368 30.039 1.00 24.24 H new ATOM 0 HE3 TRP C 59 36.751 -10.555 28.877 1.00 21.13 H new ATOM 0 HZ2 TRP C 59 32.101 -11.151 28.475 1.00 21.80 H new ATOM 0 HZ3 TRP C 59 35.454 -9.061 27.661 1.00 22.09 H new ATOM 0 HH2 TRP C 59 33.158 -9.361 27.467 1.00 22.70 H new ATOM 2100 N LYS C 60 40.047 -11.790 29.730 1.00 24.74 N ATOM 2101 CA LYS C 60 41.392 -11.432 30.144 1.00 28.60 C ATOM 2102 C LYS C 60 41.485 -9.914 30.046 1.00 27.98 C ATOM 2103 O LYS C 60 40.506 -9.256 29.692 1.00 27.50 O ATOM 2104 CB LYS C 60 42.427 -12.101 29.237 1.00 29.99 C ATOM 2105 CG LYS C 60 42.264 -11.775 27.762 1.00 34.28 C ATOM 2106 CD LYS C 60 43.147 -12.658 26.895 1.00 38.39 C ATOM 2107 CE LYS C 60 42.658 -14.098 26.882 1.00 41.38 C ATOM 2108 NZ LYS C 60 43.541 -14.987 26.063 1.00 44.10 N ATOM 0 H LYS C 60 39.649 -11.171 29.284 1.00 24.74 H new ATOM 0 HA LYS C 60 41.573 -11.732 31.049 1.00 28.60 H new ATOM 0 HB2 LYS C 60 43.314 -11.831 29.522 1.00 29.99 H new ATOM 0 HB3 LYS C 60 42.372 -13.062 29.354 1.00 29.99 H new ATOM 0 HG2 LYS C 60 41.336 -11.891 27.504 1.00 34.28 H new ATOM 0 HG3 LYS C 60 42.486 -10.843 27.609 1.00 34.28 H new ATOM 0 HD2 LYS C 60 43.161 -12.312 25.989 1.00 38.39 H new ATOM 0 HD3 LYS C 60 44.059 -12.628 27.225 1.00 38.39 H new ATOM 0 HE2 LYS C 60 42.619 -14.433 27.792 1.00 41.38 H new ATOM 0 HE3 LYS C 60 41.755 -14.128 26.529 1.00 41.38 H new ATOM 0 HZ1 LYS C 60 43.223 -15.818 26.080 1.00 44.10 H new ATOM 0 HZ2 LYS C 60 43.560 -14.694 25.223 1.00 44.10 H new ATOM 0 HZ3 LYS C 60 44.365 -14.978 26.399 1.00 44.10 H new ATOM 2109 N GLU C 61 42.651 -9.357 30.356 1.00 28.17 N ATOM 2110 CA GLU C 61 42.826 -7.913 30.315 1.00 28.66 C ATOM 2111 C GLU C 61 42.330 -7.251 29.029 1.00 28.53 C ATOM 2112 O GLU C 61 41.486 -6.351 29.077 1.00 24.42 O ATOM 2113 CB GLU C 61 44.298 -7.541 30.550 1.00 29.89 C ATOM 2114 CG GLU C 61 44.723 -7.605 32.011 1.00 33.44 C ATOM 2115 CD GLU C 61 45.280 -8.961 32.428 1.00 37.17 C ATOM 2116 OE1 GLU C 61 44.923 -9.989 31.810 1.00 37.05 O ATOM 2117 OE2 GLU C 61 46.072 -8.995 33.398 1.00 37.24 O ATOM 0 H GLU C 61 43.351 -9.798 30.592 1.00 28.17 H new ATOM 0 HA GLU C 61 42.269 -7.569 31.031 1.00 28.66 H new ATOM 0 HB2 GLU C 61 44.860 -8.138 30.032 1.00 29.89 H new ATOM 0 HB3 GLU C 61 44.453 -6.644 30.216 1.00 29.89 H new ATOM 0 HG2 GLU C 61 45.394 -6.924 32.174 1.00 33.44 H new ATOM 0 HG3 GLU C 61 43.960 -7.391 32.571 1.00 33.44 H new ATOM 2118 N GLU C 62 42.839 -7.715 27.888 1.00 28.10 N ATOM 2119 CA GLU C 62 42.482 -7.147 26.592 1.00 29.23 C ATOM 2120 C GLU C 62 41.010 -7.253 26.209 1.00 27.24 C ATOM 2121 O GLU C 62 40.437 -6.295 25.698 1.00 26.22 O ATOM 2122 CB GLU C 62 43.335 -7.774 25.484 1.00 32.60 C ATOM 2123 CG GLU C 62 44.799 -7.956 25.869 1.00 39.66 C ATOM 2124 CD GLU C 62 45.059 -9.304 26.518 1.00 42.02 C ATOM 2125 OE1 GLU C 62 45.100 -10.314 25.783 1.00 46.03 O ATOM 2126 OE2 GLU C 62 45.209 -9.358 27.756 1.00 43.74 O ATOM 0 H GLU C 62 43.399 -8.366 27.845 1.00 28.10 H new ATOM 0 HA GLU C 62 42.661 -6.198 26.686 1.00 29.23 H new ATOM 0 HB2 GLU C 62 42.961 -8.637 25.248 1.00 32.60 H new ATOM 0 HB3 GLU C 62 43.284 -7.216 24.692 1.00 32.60 H new ATOM 0 HG2 GLU C 62 45.353 -7.868 25.078 1.00 39.66 H new ATOM 0 HG3 GLU C 62 45.061 -7.249 26.479 1.00 39.66 H new ATOM 2127 N THR C 63 40.396 -8.407 26.438 1.00 25.91 N ATOM 2128 CA THR C 63 38.986 -8.569 26.081 1.00 23.90 C ATOM 2129 C THR C 63 38.063 -7.781 27.005 1.00 22.88 C ATOM 2130 O THR C 63 37.063 -7.228 26.555 1.00 19.88 O ATOM 2131 CB THR C 63 38.577 -10.042 26.086 1.00 22.15 C ATOM 2132 OG1 THR C 63 38.981 -10.638 27.320 1.00 21.07 O ATOM 2133 CG2 THR C 63 39.233 -10.782 24.912 1.00 22.07 C ATOM 0 H THR C 63 40.766 -9.098 26.792 1.00 25.91 H new ATOM 0 HA THR C 63 38.890 -8.215 25.183 1.00 23.90 H new ATOM 0 HB THR C 63 37.614 -10.105 25.992 1.00 22.15 H new ATOM 0 HG1 THR C 63 39.065 -11.467 27.217 1.00 21.07 H new ATOM 0 HG21 THR C 63 38.966 -11.714 24.927 1.00 22.07 H new ATOM 0 HG22 THR C 63 38.951 -10.378 24.076 1.00 22.07 H new ATOM 0 HG23 THR C 63 40.198 -10.722 24.990 1.00 22.07 H new ATOM 2134 N LEU C 64 38.405 -7.727 28.292 1.00 22.75 N ATOM 2135 CA LEU C 64 37.612 -6.972 29.267 1.00 21.51 C ATOM 2136 C LEU C 64 37.705 -5.476 28.989 1.00 20.98 C ATOM 2137 O LEU C 64 36.732 -4.743 29.172 1.00 21.70 O ATOM 2138 CB LEU C 64 38.108 -7.229 30.696 1.00 20.98 C ATOM 2139 CG LEU C 64 37.769 -8.574 31.337 1.00 22.26 C ATOM 2140 CD1 LEU C 64 38.525 -8.718 32.662 1.00 20.12 C ATOM 2141 CD2 LEU C 64 36.254 -8.667 31.537 1.00 19.99 C ATOM 0 H LEU C 64 39.094 -8.121 28.623 1.00 22.75 H new ATOM 0 HA LEU C 64 36.692 -7.269 29.184 1.00 21.51 H new ATOM 0 HB2 LEU C 64 39.073 -7.133 30.698 1.00 20.98 H new ATOM 0 HB3 LEU C 64 37.752 -6.529 31.265 1.00 20.98 H new ATOM 0 HG LEU C 64 38.044 -9.302 30.759 1.00 22.26 H new ATOM 0 HD11 LEU C 64 38.308 -9.572 33.067 1.00 20.12 H new ATOM 0 HD12 LEU C 64 39.480 -8.672 32.497 1.00 20.12 H new ATOM 0 HD13 LEU C 64 38.266 -8.001 33.262 1.00 20.12 H new ATOM 0 HD21 LEU C 64 36.033 -9.519 31.944 1.00 19.99 H new ATOM 0 HD22 LEU C 64 35.959 -7.947 32.116 1.00 19.99 H new ATOM 0 HD23 LEU C 64 35.809 -8.594 30.678 1.00 19.99 H new ATOM 2142 N MET C 65 38.881 -5.024 28.567 1.00 22.00 N ATOM 2143 CA MET C 65 39.081 -3.612 28.269 1.00 24.08 C ATOM 2144 C MET C 65 38.120 -3.167 27.172 1.00 24.48 C ATOM 2145 O MET C 65 37.481 -2.127 27.294 1.00 23.12 O ATOM 2146 CB MET C 65 40.526 -3.339 27.826 1.00 25.00 C ATOM 2147 CG MET C 65 41.530 -3.198 28.974 1.00 26.33 C ATOM 2148 SD MET C 65 41.211 -1.750 30.032 1.00 29.21 S ATOM 2149 CE MET C 65 41.721 -0.409 28.945 1.00 29.41 C ATOM 0 H MET C 65 39.575 -5.518 28.447 1.00 22.00 H new ATOM 0 HA MET C 65 38.906 -3.108 29.079 1.00 24.08 H new ATOM 0 HB2 MET C 65 40.816 -4.060 27.246 1.00 25.00 H new ATOM 0 HB3 MET C 65 40.541 -2.526 27.297 1.00 25.00 H new ATOM 0 HG2 MET C 65 41.505 -4.001 29.518 1.00 26.33 H new ATOM 0 HG3 MET C 65 42.425 -3.132 28.607 1.00 26.33 H new ATOM 0 HE1 MET C 65 41.272 0.409 29.208 1.00 29.41 H new ATOM 0 HE2 MET C 65 42.681 -0.286 29.011 1.00 29.41 H new ATOM 0 HE3 MET C 65 41.486 -0.627 28.030 1.00 29.41 H new ATOM 2150 N GLU C 66 38.017 -3.964 26.110 1.00 24.12 N ATOM 2151 CA GLU C 66 37.134 -3.637 24.997 1.00 24.31 C ATOM 2152 C GLU C 66 35.663 -3.760 25.400 1.00 23.69 C ATOM 2153 O GLU C 66 34.869 -2.841 25.187 1.00 22.58 O ATOM 2154 CB GLU C 66 37.414 -4.559 23.807 1.00 27.67 C ATOM 2155 CG GLU C 66 36.911 -3.976 22.488 1.00 29.98 C ATOM 2156 CD GLU C 66 37.186 -4.869 21.293 1.00 30.47 C ATOM 2157 OE1 GLU C 66 38.282 -5.468 21.233 1.00 31.54 O ATOM 2158 OE2 GLU C 66 36.308 -4.956 20.408 1.00 29.54 O ATOM 0 H GLU C 66 38.452 -4.700 26.016 1.00 24.12 H new ATOM 0 HA GLU C 66 37.309 -2.717 24.744 1.00 24.31 H new ATOM 0 HB2 GLU C 66 38.368 -4.720 23.743 1.00 27.67 H new ATOM 0 HB3 GLU C 66 36.991 -5.418 23.960 1.00 27.67 H new ATOM 0 HG2 GLU C 66 35.956 -3.820 22.554 1.00 29.98 H new ATOM 0 HG3 GLU C 66 37.330 -3.113 22.342 1.00 29.98 H new ATOM 2159 N TYR C 67 35.315 -4.905 25.984 1.00 23.01 N ATOM 2160 CA TYR C 67 33.953 -5.179 26.434 1.00 22.80 C ATOM 2161 C TYR C 67 33.421 -4.094 27.367 1.00 22.61 C ATOM 2162 O TYR C 67 32.349 -3.535 27.133 1.00 20.92 O ATOM 2163 CB TYR C 67 33.911 -6.533 27.151 1.00 23.00 C ATOM 2164 CG TYR C 67 32.594 -6.847 27.823 1.00 22.57 C ATOM 2165 CD1 TYR C 67 31.473 -7.218 27.074 1.00 22.81 C ATOM 2166 CD2 TYR C 67 32.468 -6.771 29.210 1.00 22.42 C ATOM 2167 CE1 TYR C 67 30.256 -7.508 27.689 1.00 22.74 C ATOM 2168 CE2 TYR C 67 31.256 -7.057 29.842 1.00 25.33 C ATOM 2169 CZ TYR C 67 30.154 -7.425 29.077 1.00 25.07 C ATOM 2170 OH TYR C 67 28.957 -7.699 29.705 1.00 24.99 O ATOM 0 H TYR C 67 35.867 -5.548 26.131 1.00 23.01 H new ATOM 0 HA TYR C 67 33.385 -5.194 25.648 1.00 22.80 H new ATOM 0 HB2 TYR C 67 34.108 -7.232 26.508 1.00 23.00 H new ATOM 0 HB3 TYR C 67 34.615 -6.555 27.818 1.00 23.00 H new ATOM 0 HD1 TYR C 67 31.541 -7.272 26.148 1.00 22.81 H new ATOM 0 HD2 TYR C 67 33.204 -6.526 29.723 1.00 22.42 H new ATOM 0 HE1 TYR C 67 29.519 -7.755 27.178 1.00 22.74 H new ATOM 0 HE2 TYR C 67 31.186 -7.002 30.768 1.00 25.33 H new ATOM 0 HH TYR C 67 29.097 -8.184 30.377 1.00 24.99 H new ATOM 2171 N LEU C 68 34.166 -3.798 28.430 1.00 23.05 N ATOM 2172 CA LEU C 68 33.720 -2.791 29.386 1.00 23.78 C ATOM 2173 C LEU C 68 33.583 -1.409 28.762 1.00 25.62 C ATOM 2174 O LEU C 68 32.834 -0.571 29.261 1.00 24.48 O ATOM 2175 CB LEU C 68 34.659 -2.743 30.591 1.00 22.09 C ATOM 2176 CG LEU C 68 34.547 -4.012 31.442 1.00 23.05 C ATOM 2177 CD1 LEU C 68 35.645 -4.042 32.488 1.00 24.22 C ATOM 2178 CD2 LEU C 68 33.162 -4.078 32.080 1.00 23.32 C ATOM 0 H LEU C 68 34.922 -4.164 28.613 1.00 23.05 H new ATOM 0 HA LEU C 68 32.835 -3.056 29.681 1.00 23.78 H new ATOM 0 HB2 LEU C 68 35.574 -2.637 30.286 1.00 22.09 H new ATOM 0 HB3 LEU C 68 34.449 -1.968 31.135 1.00 22.09 H new ATOM 0 HG LEU C 68 34.660 -4.793 30.878 1.00 23.05 H new ATOM 0 HD11 LEU C 68 35.564 -4.849 33.020 1.00 24.22 H new ATOM 0 HD12 LEU C 68 36.510 -4.030 32.050 1.00 24.22 H new ATOM 0 HD13 LEU C 68 35.564 -3.266 33.064 1.00 24.22 H new ATOM 0 HD21 LEU C 68 33.092 -4.882 32.619 1.00 23.32 H new ATOM 0 HD22 LEU C 68 33.027 -3.299 32.643 1.00 23.32 H new ATOM 0 HD23 LEU C 68 32.486 -4.095 31.385 1.00 23.32 H new ATOM 2179 N GLU C 69 34.290 -1.171 27.662 1.00 25.28 N ATOM 2180 CA GLU C 69 34.193 0.124 27.007 1.00 26.60 C ATOM 2181 C GLU C 69 32.805 0.283 26.402 1.00 25.79 C ATOM 2182 O GLU C 69 32.207 1.356 26.471 1.00 27.43 O ATOM 2183 CB GLU C 69 35.238 0.260 25.905 1.00 27.95 C ATOM 2184 CG GLU C 69 35.409 1.689 25.447 1.00 33.66 C ATOM 2185 CD GLU C 69 36.276 1.816 24.214 1.00 38.08 C ATOM 2186 OE1 GLU C 69 36.722 2.946 23.936 1.00 39.46 O ATOM 2187 OE2 GLU C 69 36.501 0.795 23.522 1.00 39.66 O ATOM 0 H GLU C 69 34.821 -1.734 27.287 1.00 25.28 H new ATOM 0 HA GLU C 69 34.351 0.814 27.670 1.00 26.60 H new ATOM 0 HB2 GLU C 69 36.089 -0.078 26.226 1.00 27.95 H new ATOM 0 HB3 GLU C 69 34.981 -0.291 25.149 1.00 27.95 H new ATOM 0 HG2 GLU C 69 34.536 2.071 25.263 1.00 33.66 H new ATOM 0 HG3 GLU C 69 35.800 2.209 26.166 1.00 33.66 H new ATOM 2188 N ASN C 70 32.297 -0.793 25.812 1.00 24.38 N ATOM 2189 CA ASN C 70 30.977 -0.779 25.193 1.00 23.88 C ATOM 2190 C ASN C 70 30.504 -2.223 25.072 1.00 23.30 C ATOM 2191 O ASN C 70 30.714 -2.874 24.038 1.00 23.66 O ATOM 2192 CB ASN C 70 31.059 -0.144 23.805 1.00 24.54 C ATOM 2193 CG ASN C 70 29.698 0.114 23.206 1.00 27.71 C ATOM 2194 OD1 ASN C 70 28.719 -0.536 23.560 1.00 27.60 O ATOM 2195 ND2 ASN C 70 29.632 1.061 22.279 1.00 28.31 N ATOM 0 H ASN C 70 32.705 -1.548 25.759 1.00 24.38 H new ATOM 0 HA ASN C 70 30.357 -0.262 25.731 1.00 23.88 H new ATOM 0 HB2 ASN C 70 31.547 0.692 23.864 1.00 24.54 H new ATOM 0 HB3 ASN C 70 31.563 -0.726 23.216 1.00 24.54 H new ATOM 0 HD21 ASN C 70 28.881 1.240 21.900 1.00 28.31 H new ATOM 0 HD22 ASN C 70 30.340 1.496 22.057 1.00 28.31 H new ATOM 2196 N PRO C 71 29.841 -2.739 26.123 1.00 22.50 N ATOM 2197 CA PRO C 71 29.322 -4.109 26.196 1.00 21.44 C ATOM 2198 C PRO C 71 28.492 -4.577 25.002 1.00 21.65 C ATOM 2199 O PRO C 71 28.811 -5.585 24.387 1.00 21.94 O ATOM 2200 CB PRO C 71 28.515 -4.099 27.488 1.00 21.88 C ATOM 2201 CG PRO C 71 29.235 -3.087 28.323 1.00 24.29 C ATOM 2202 CD PRO C 71 29.488 -1.988 27.341 1.00 21.75 C ATOM 0 HA PRO C 71 30.049 -4.750 26.179 1.00 21.44 H new ATOM 0 HB2 PRO C 71 27.591 -3.846 27.333 1.00 21.88 H new ATOM 0 HB3 PRO C 71 28.503 -4.972 27.911 1.00 21.88 H new ATOM 0 HG2 PRO C 71 28.697 -2.787 29.072 1.00 24.29 H new ATOM 0 HG3 PRO C 71 30.060 -3.441 28.690 1.00 24.29 H new ATOM 0 HD2 PRO C 71 28.705 -1.431 27.210 1.00 21.75 H new ATOM 0 HD3 PRO C 71 30.207 -1.403 27.628 1.00 21.75 H new ATOM 2203 N LYS C 72 27.433 -3.846 24.672 1.00 20.99 N ATOM 2204 CA LYS C 72 26.570 -4.234 23.562 1.00 22.93 C ATOM 2205 C LYS C 72 27.289 -4.246 22.210 1.00 21.89 C ATOM 2206 O LYS C 72 26.899 -4.980 21.300 1.00 25.11 O ATOM 2207 CB LYS C 72 25.339 -3.326 23.514 0.50 22.14 C ATOM 2208 CG LYS C 72 24.442 -3.483 24.738 0.50 23.67 C ATOM 2209 CD LYS C 72 23.138 -2.711 24.594 0.50 24.58 C ATOM 2210 CE LYS C 72 22.138 -3.109 25.669 0.50 25.61 C ATOM 2211 NZ LYS C 72 22.640 -2.799 27.031 0.50 28.78 N ATOM 0 H LYS C 72 27.197 -3.124 25.076 1.00 20.99 H new ATOM 0 HA LYS C 72 26.294 -5.149 23.727 1.00 22.93 H new ATOM 0 HB2 LYS C 72 25.626 -2.402 23.445 0.50 22.14 H new ATOM 0 HB3 LYS C 72 24.827 -3.525 22.715 0.50 22.14 H new ATOM 0 HG2 LYS C 72 24.247 -4.423 24.876 0.50 23.67 H new ATOM 0 HG3 LYS C 72 24.915 -3.173 25.526 0.50 23.67 H new ATOM 0 HD2 LYS C 72 23.315 -1.759 24.651 0.50 24.58 H new ATOM 0 HD3 LYS C 72 22.757 -2.877 23.718 0.50 24.58 H new ATOM 0 HE2 LYS C 72 21.300 -2.644 25.519 0.50 25.61 H new ATOM 0 HE3 LYS C 72 21.951 -4.058 25.601 0.50 25.61 H new ATOM 0 HZ1 LYS C 72 22.010 -2.990 27.630 0.50 28.78 H new ATOM 0 HZ2 LYS C 72 23.366 -3.287 27.198 0.50 28.78 H new ATOM 0 HZ3 LYS C 72 22.846 -1.935 27.082 0.50 28.78 H new ATOM 2212 N LYS C 73 28.339 -3.442 22.080 1.00 20.33 N ATOM 2213 CA LYS C 73 29.108 -3.409 20.842 1.00 21.78 C ATOM 2214 C LYS C 73 29.996 -4.665 20.737 1.00 22.86 C ATOM 2215 O LYS C 73 30.152 -5.231 19.654 1.00 23.23 O ATOM 2216 CB LYS C 73 29.981 -2.152 20.792 0.50 18.05 C ATOM 2217 CG LYS C 73 30.800 -2.005 19.523 0.50 17.34 C ATOM 2218 CD LYS C 73 31.581 -0.696 19.523 0.50 19.61 C ATOM 2219 CE LYS C 73 32.334 -0.489 18.217 0.50 18.40 C ATOM 2220 NZ LYS C 73 33.246 -1.622 17.926 0.50 21.68 N ATOM 0 H LYS C 73 28.622 -2.910 22.694 1.00 20.33 H new ATOM 0 HA LYS C 73 28.490 -3.393 20.094 1.00 21.78 H new ATOM 0 HB2 LYS C 73 29.412 -1.373 20.888 0.50 18.05 H new ATOM 0 HB3 LYS C 73 30.583 -2.159 21.553 0.50 18.05 H new ATOM 0 HG2 LYS C 73 31.414 -2.752 19.443 0.50 17.34 H new ATOM 0 HG3 LYS C 73 30.214 -2.035 18.751 0.50 17.34 H new ATOM 0 HD2 LYS C 73 30.971 0.045 19.666 0.50 19.61 H new ATOM 0 HD3 LYS C 73 32.209 -0.694 20.263 0.50 19.61 H new ATOM 0 HE2 LYS C 73 31.700 -0.388 17.490 0.50 18.40 H new ATOM 0 HE3 LYS C 73 32.845 0.334 18.264 0.50 18.40 H new ATOM 0 HZ1 LYS C 73 33.803 -1.394 17.270 0.50 21.68 H new ATOM 0 HZ2 LYS C 73 33.714 -1.822 18.656 0.50 21.68 H new ATOM 0 HZ3 LYS C 73 32.769 -2.331 17.677 0.50 21.68 H new ATOM 2221 N TYR C 74 30.574 -5.090 21.860 1.00 21.51 N ATOM 2222 CA TYR C 74 31.445 -6.273 21.886 1.00 21.99 C ATOM 2223 C TYR C 74 30.634 -7.559 21.767 1.00 21.87 C ATOM 2224 O TYR C 74 31.043 -8.507 21.089 1.00 19.41 O ATOM 2225 CB TYR C 74 32.257 -6.310 23.177 1.00 22.65 C ATOM 2226 CG TYR C 74 33.387 -7.318 23.180 1.00 21.95 C ATOM 2227 CD1 TYR C 74 34.424 -7.237 22.246 1.00 22.35 C ATOM 2228 CD2 TYR C 74 33.453 -8.313 24.153 1.00 20.68 C ATOM 2229 CE1 TYR C 74 35.508 -8.120 22.286 1.00 20.78 C ATOM 2230 CE2 TYR C 74 34.530 -9.200 24.207 1.00 23.25 C ATOM 2231 CZ TYR C 74 35.556 -9.095 23.274 1.00 23.32 C ATOM 2232 OH TYR C 74 36.642 -9.938 23.354 1.00 20.77 O ATOM 0 H TYR C 74 30.475 -4.707 22.624 1.00 21.51 H new ATOM 0 HA TYR C 74 32.045 -6.210 21.126 1.00 21.99 H new ATOM 0 HB2 TYR C 74 32.626 -5.428 23.339 1.00 22.65 H new ATOM 0 HB3 TYR C 74 31.660 -6.508 23.915 1.00 22.65 H new ATOM 0 HD1 TYR C 74 34.393 -6.583 21.585 1.00 22.35 H new ATOM 0 HD2 TYR C 74 32.768 -8.388 24.777 1.00 20.68 H new ATOM 0 HE1 TYR C 74 36.190 -8.055 21.657 1.00 20.78 H new ATOM 0 HE2 TYR C 74 34.561 -9.858 24.864 1.00 23.25 H new ATOM 0 HH TYR C 74 37.214 -9.713 22.781 1.00 20.77 H new ATOM 2233 N ILE C 75 29.475 -7.571 22.421 1.00 20.98 N ATOM 2234 CA ILE C 75 28.587 -8.722 22.397 1.00 20.76 C ATOM 2235 C ILE C 75 27.160 -8.310 22.011 1.00 22.15 C ATOM 2236 O ILE C 75 26.262 -8.259 22.854 1.00 21.48 O ATOM 2237 CB ILE C 75 28.550 -9.428 23.779 1.00 20.51 C ATOM 2238 CG1 ILE C 75 29.980 -9.756 24.242 1.00 18.52 C ATOM 2239 CG2 ILE C 75 27.727 -10.706 23.677 1.00 22.05 C ATOM 2240 CD1 ILE C 75 30.045 -10.519 25.563 1.00 20.64 C ATOM 0 H ILE C 75 29.184 -6.911 22.890 1.00 20.98 H new ATOM 0 HA ILE C 75 28.935 -9.336 21.732 1.00 20.76 H new ATOM 0 HB ILE C 75 28.141 -8.836 24.429 1.00 20.51 H new ATOM 0 HG12 ILE C 75 30.421 -10.280 23.555 1.00 18.52 H new ATOM 0 HG13 ILE C 75 30.479 -8.929 24.332 1.00 18.52 H new ATOM 0 HG21 ILE C 75 27.704 -11.146 24.541 1.00 22.05 H new ATOM 0 HG22 ILE C 75 26.823 -10.488 23.402 1.00 22.05 H new ATOM 0 HG23 ILE C 75 28.129 -11.299 23.023 1.00 22.05 H new ATOM 0 HD11 ILE C 75 30.972 -10.691 25.792 1.00 20.64 H new ATOM 0 HD12 ILE C 75 29.632 -9.990 26.263 1.00 20.64 H new ATOM 0 HD13 ILE C 75 29.573 -11.362 25.474 1.00 20.64 H new ATOM 2241 N PRO C 76 26.932 -8.016 20.720 1.00 22.21 N ATOM 2242 CA PRO C 76 25.589 -7.618 20.292 1.00 21.77 C ATOM 2243 C PRO C 76 24.576 -8.646 20.778 1.00 20.57 C ATOM 2244 O PRO C 76 24.816 -9.844 20.674 1.00 22.00 O ATOM 2245 CB PRO C 76 25.697 -7.597 18.766 1.00 21.70 C ATOM 2246 CG PRO C 76 27.132 -7.267 18.527 1.00 23.31 C ATOM 2247 CD PRO C 76 27.851 -8.106 19.573 1.00 21.99 C ATOM 0 HA PRO C 76 25.294 -6.764 20.645 1.00 21.77 H new ATOM 0 HB2 PRO C 76 25.457 -8.453 18.379 1.00 21.70 H new ATOM 0 HB3 PRO C 76 25.107 -6.934 18.375 1.00 21.70 H new ATOM 0 HG2 PRO C 76 27.409 -7.499 17.627 1.00 23.31 H new ATOM 0 HG3 PRO C 76 27.307 -6.320 18.643 1.00 23.31 H new ATOM 0 HD2 PRO C 76 27.978 -9.022 19.280 1.00 21.99 H new ATOM 0 HD3 PRO C 76 28.729 -7.751 19.782 1.00 21.99 H new ATOM 2248 N GLY C 77 23.454 -8.176 21.313 1.00 19.69 N ATOM 2249 CA GLY C 77 22.434 -9.087 21.797 1.00 20.15 C ATOM 2250 C GLY C 77 22.485 -9.327 23.301 1.00 22.22 C ATOM 2251 O GLY C 77 21.548 -9.881 23.882 1.00 19.62 O ATOM 0 H GLY C 77 23.268 -7.341 21.403 1.00 19.69 H new ATOM 0 HA2 GLY C 77 21.561 -8.735 21.564 1.00 20.15 H new ATOM 0 HA3 GLY C 77 22.528 -9.937 21.339 1.00 20.15 H new ATOM 2252 N THR C 78 23.569 -8.914 23.949 1.00 22.47 N ATOM 2253 CA THR C 78 23.660 -9.131 25.388 1.00 23.52 C ATOM 2254 C THR C 78 22.609 -8.283 26.104 1.00 23.08 C ATOM 2255 O THR C 78 22.293 -7.179 25.671 1.00 21.96 O ATOM 2256 CB THR C 78 25.064 -8.784 25.929 1.00 22.85 C ATOM 2257 OG1 THR C 78 25.104 -9.036 27.338 1.00 22.70 O ATOM 2258 CG2 THR C 78 25.395 -7.319 25.669 1.00 22.27 C ATOM 0 H THR C 78 24.243 -8.519 23.589 1.00 22.47 H new ATOM 0 HA THR C 78 23.499 -10.072 25.558 1.00 23.52 H new ATOM 0 HB THR C 78 25.718 -9.336 25.473 1.00 22.85 H new ATOM 0 HG1 THR C 78 25.060 -9.863 27.476 1.00 22.70 H new ATOM 0 HG21 THR C 78 26.279 -7.120 26.015 1.00 22.27 H new ATOM 0 HG22 THR C 78 25.376 -7.147 24.715 1.00 22.27 H new ATOM 0 HG23 THR C 78 24.741 -6.756 26.112 1.00 22.27 H new ATOM 2259 N LYS C 79 22.063 -8.808 27.194 1.00 23.39 N ATOM 2260 CA LYS C 79 21.043 -8.092 27.947 1.00 26.20 C ATOM 2261 C LYS C 79 21.463 -7.884 29.394 1.00 27.16 C ATOM 2262 O LYS C 79 21.829 -8.835 30.085 1.00 27.05 O ATOM 2263 CB LYS C 79 19.724 -8.864 27.904 1.00 26.53 C ATOM 2264 CG LYS C 79 19.236 -9.146 26.503 1.00 28.11 C ATOM 2265 CD LYS C 79 18.986 -7.848 25.750 1.00 32.51 C ATOM 2266 CE LYS C 79 18.356 -8.118 24.394 1.00 34.53 C ATOM 2267 NZ LYS C 79 17.967 -6.856 23.704 1.00 37.39 N ATOM 0 H LYS C 79 22.270 -9.579 27.514 1.00 23.39 H new ATOM 0 HA LYS C 79 20.928 -7.221 27.536 1.00 26.20 H new ATOM 0 HB2 LYS C 79 19.834 -9.704 28.376 1.00 26.53 H new ATOM 0 HB3 LYS C 79 19.046 -8.359 28.379 1.00 26.53 H new ATOM 0 HG2 LYS C 79 19.892 -9.680 26.028 1.00 28.11 H new ATOM 0 HG3 LYS C 79 18.419 -9.667 26.539 1.00 28.11 H new ATOM 0 HD2 LYS C 79 18.404 -7.274 26.272 1.00 32.51 H new ATOM 0 HD3 LYS C 79 19.823 -7.372 25.633 1.00 32.51 H new ATOM 0 HE2 LYS C 79 18.981 -8.611 23.839 1.00 34.53 H new ATOM 0 HE3 LYS C 79 17.573 -8.680 24.507 1.00 34.53 H new ATOM 0 HZ1 LYS C 79 17.602 -7.049 22.915 1.00 37.39 H new ATOM 0 HZ2 LYS C 79 17.377 -6.414 24.203 1.00 37.39 H new ATOM 0 HZ3 LYS C 79 18.689 -6.350 23.581 1.00 37.39 H new ATOM 2268 N MET C 80 21.386 -6.635 29.844 1.00 27.67 N ATOM 2269 CA MET C 80 21.759 -6.264 31.204 1.00 29.06 C ATOM 2270 C MET C 80 20.639 -6.460 32.226 1.00 28.90 C ATOM 2271 O MET C 80 20.903 -6.584 33.421 1.00 27.11 O ATOM 2272 CB MET C 80 22.207 -4.799 31.236 1.00 30.51 C ATOM 2273 CG MET C 80 23.615 -4.585 31.753 1.00 35.78 C ATOM 2274 SD MET C 80 24.880 -4.865 30.512 1.00 35.66 S ATOM 2275 CE MET C 80 24.774 -6.629 30.293 1.00 31.44 C ATOM 0 H MET C 80 21.114 -5.975 29.365 1.00 27.67 H new ATOM 0 HA MET C 80 22.482 -6.860 31.457 1.00 29.06 H new ATOM 0 HB2 MET C 80 22.145 -4.434 30.340 1.00 30.51 H new ATOM 0 HB3 MET C 80 21.591 -4.296 31.791 1.00 30.51 H new ATOM 0 HG2 MET C 80 23.695 -3.678 32.088 1.00 35.78 H new ATOM 0 HG3 MET C 80 23.771 -5.179 32.504 1.00 35.78 H new ATOM 0 HE1 MET C 80 25.628 -6.969 29.983 1.00 31.44 H new ATOM 0 HE2 MET C 80 24.548 -7.047 31.138 1.00 31.44 H new ATOM 0 HE3 MET C 80 24.088 -6.833 29.638 1.00 31.44 H new ATOM 2276 N ILE C 81 19.392 -6.476 31.763 1.00 27.75 N ATOM 2277 CA ILE C 81 18.259 -6.642 32.666 1.00 28.11 C ATOM 2278 C ILE C 81 17.298 -7.716 32.173 1.00 27.68 C ATOM 2279 O ILE C 81 17.422 -8.192 31.045 1.00 27.37 O ATOM 2280 CB ILE C 81 17.500 -5.302 32.871 1.00 31.91 C ATOM 2281 CG1 ILE C 81 17.017 -4.754 31.529 1.00 31.97 C ATOM 2282 CG2 ILE C 81 18.418 -4.288 33.565 1.00 30.78 C ATOM 2283 CD1 ILE C 81 16.151 -3.528 31.658 1.00 34.17 C ATOM 0 H ILE C 81 19.182 -6.393 30.933 1.00 27.75 H new ATOM 0 HA ILE C 81 18.620 -6.928 33.520 1.00 28.11 H new ATOM 0 HB ILE C 81 16.725 -5.460 33.432 1.00 31.91 H new ATOM 0 HG12 ILE C 81 17.787 -4.541 30.979 1.00 31.97 H new ATOM 0 HG13 ILE C 81 16.519 -5.446 31.065 1.00 31.97 H new ATOM 0 HG21 ILE C 81 17.941 -3.453 33.691 1.00 30.78 H new ATOM 0 HG22 ILE C 81 18.692 -4.637 34.428 1.00 30.78 H new ATOM 0 HG23 ILE C 81 19.202 -4.132 33.016 1.00 30.78 H new ATOM 0 HD11 ILE C 81 15.878 -3.230 30.776 1.00 34.17 H new ATOM 0 HD12 ILE C 81 15.365 -3.741 32.185 1.00 34.17 H new ATOM 0 HD13 ILE C 81 16.652 -2.822 32.096 1.00 34.17 H new ATOM 2284 N PHE C 82 16.342 -8.100 33.019 1.00 26.27 N ATOM 2285 CA PHE C 82 15.400 -9.156 32.658 1.00 27.61 C ATOM 2286 C PHE C 82 14.921 -9.101 31.213 1.00 26.45 C ATOM 2287 O PHE C 82 14.362 -8.106 30.762 1.00 27.32 O ATOM 2288 CB PHE C 82 14.175 -9.162 33.576 1.00 26.17 C ATOM 2289 CG PHE C 82 13.246 -10.306 33.305 1.00 27.68 C ATOM 2290 CD1 PHE C 82 13.692 -11.618 33.440 1.00 30.05 C ATOM 2291 CD2 PHE C 82 11.943 -10.084 32.882 1.00 28.81 C ATOM 2292 CE1 PHE C 82 12.857 -12.698 33.156 1.00 30.92 C ATOM 2293 CE2 PHE C 82 11.096 -11.156 32.595 1.00 28.76 C ATOM 2294 CZ PHE C 82 11.553 -12.464 32.733 1.00 30.80 C ATOM 0 H PHE C 82 16.223 -7.764 33.801 1.00 26.27 H new ATOM 0 HA PHE C 82 15.909 -9.974 32.768 1.00 27.61 H new ATOM 0 HB2 PHE C 82 14.469 -9.203 34.499 1.00 26.17 H new ATOM 0 HB3 PHE C 82 13.692 -8.327 33.468 1.00 26.17 H new ATOM 0 HD1 PHE C 82 14.563 -11.777 33.725 1.00 30.05 H new ATOM 0 HD2 PHE C 82 11.631 -9.213 32.789 1.00 28.81 H new ATOM 0 HE1 PHE C 82 13.170 -13.569 33.249 1.00 30.92 H new ATOM 0 HE2 PHE C 82 10.225 -10.996 32.311 1.00 28.76 H new ATOM 0 HZ PHE C 82 10.989 -13.178 32.543 1.00 30.80 H new ATOM 2295 N ALA C 83 15.130 -10.197 30.501 1.00 27.85 N ATOM 2296 CA ALA C 83 14.732 -10.284 29.107 1.00 27.41 C ATOM 2297 C ALA C 83 14.063 -11.620 28.836 1.00 27.12 C ATOM 2298 O ALA C 83 13.894 -12.015 27.680 1.00 25.66 O ATOM 2299 CB ALA C 83 15.950 -10.119 28.218 1.00 29.45 C ATOM 0 H ALA C 83 15.504 -10.907 30.810 1.00 27.85 H new ATOM 0 HA ALA C 83 14.098 -9.576 28.912 1.00 27.41 H new ATOM 0 HB1 ALA C 83 15.682 -10.177 27.288 1.00 29.45 H new ATOM 0 HB2 ALA C 83 16.357 -9.254 28.383 1.00 29.45 H new ATOM 0 HB3 ALA C 83 16.591 -10.820 28.414 1.00 29.45 H new ATOM 2300 N GLY C 84 13.690 -12.319 29.907 1.00 26.66 N ATOM 2301 CA GLY C 84 13.031 -13.605 29.754 1.00 27.41 C ATOM 2302 C GLY C 84 13.735 -14.775 30.417 1.00 28.24 C ATOM 2303 O GLY C 84 14.894 -14.671 30.822 1.00 29.52 O ATOM 0 H GLY C 84 13.809 -12.066 30.720 1.00 26.66 H new ATOM 0 HA2 GLY C 84 12.134 -13.538 30.117 1.00 27.41 H new ATOM 0 HA3 GLY C 84 12.940 -13.795 28.807 1.00 27.41 H new ATOM 2304 N ILE C 85 13.018 -15.891 30.524 1.00 27.73 N ATOM 2305 CA ILE C 85 13.528 -17.119 31.120 1.00 29.74 C ATOM 2306 C ILE C 85 13.536 -18.199 30.043 1.00 30.97 C ATOM 2307 O ILE C 85 12.486 -18.573 29.525 1.00 30.20 O ATOM 2308 CB ILE C 85 12.634 -17.571 32.285 1.00 31.63 C ATOM 2309 CG1 ILE C 85 12.709 -16.543 33.410 1.00 32.67 C ATOM 2310 CG2 ILE C 85 13.064 -18.945 32.777 1.00 32.21 C ATOM 2311 CD1 ILE C 85 11.669 -16.751 34.473 1.00 37.95 C ATOM 0 H ILE C 85 12.207 -15.955 30.246 1.00 27.73 H new ATOM 0 HA ILE C 85 14.422 -16.965 31.464 1.00 29.74 H new ATOM 0 HB ILE C 85 11.715 -17.636 31.981 1.00 31.63 H new ATOM 0 HG12 ILE C 85 13.589 -16.580 33.816 1.00 32.67 H new ATOM 0 HG13 ILE C 85 12.607 -15.654 33.035 1.00 32.67 H new ATOM 0 HG21 ILE C 85 12.493 -19.219 33.512 1.00 32.21 H new ATOM 0 HG22 ILE C 85 12.989 -19.586 32.053 1.00 32.21 H new ATOM 0 HG23 ILE C 85 13.984 -18.907 33.081 1.00 32.21 H new ATOM 0 HD11 ILE C 85 11.766 -16.071 35.158 1.00 37.95 H new ATOM 0 HD12 ILE C 85 10.785 -16.688 34.078 1.00 37.95 H new ATOM 0 HD13 ILE C 85 11.783 -17.628 34.871 1.00 37.95 H new ATOM 2312 N LYS C 86 14.727 -18.697 29.718 1.00 31.03 N ATOM 2313 CA LYS C 86 14.898 -19.713 28.687 1.00 31.56 C ATOM 2314 C LYS C 86 14.354 -21.091 29.045 1.00 34.24 C ATOM 2315 O LYS C 86 13.601 -21.687 28.269 1.00 32.34 O ATOM 2316 CB LYS C 86 16.381 -19.838 28.331 0.50 31.66 C ATOM 2317 CG LYS C 86 16.698 -20.962 27.362 0.50 32.95 C ATOM 2318 CD LYS C 86 18.200 -21.093 27.148 0.50 32.91 C ATOM 2319 CE LYS C 86 18.521 -22.255 26.222 0.50 34.61 C ATOM 2320 NZ LYS C 86 17.902 -22.078 24.880 0.50 34.52 N ATOM 0 H LYS C 86 15.461 -18.452 30.093 1.00 31.03 H new ATOM 0 HA LYS C 86 14.372 -19.406 27.932 1.00 31.56 H new ATOM 0 HB2 LYS C 86 16.682 -19.000 27.947 0.50 31.66 H new ATOM 0 HB3 LYS C 86 16.888 -19.975 29.146 0.50 31.66 H new ATOM 0 HG2 LYS C 86 16.343 -21.797 27.704 0.50 32.95 H new ATOM 0 HG3 LYS C 86 16.261 -20.794 26.513 0.50 32.95 H new ATOM 0 HD2 LYS C 86 18.549 -20.270 26.772 0.50 32.91 H new ATOM 0 HD3 LYS C 86 18.641 -21.224 28.002 0.50 32.91 H new ATOM 0 HE2 LYS C 86 19.483 -22.337 26.127 0.50 34.61 H new ATOM 0 HE3 LYS C 86 18.204 -23.082 26.618 0.50 34.61 H new ATOM 0 HZ1 LYS C 86 18.255 -22.664 24.311 0.50 34.52 H new ATOM 0 HZ2 LYS C 86 17.024 -22.212 24.938 0.50 34.52 H new ATOM 0 HZ3 LYS C 86 18.057 -21.252 24.588 0.50 34.52 H new ATOM 2321 N LYS C 87 14.746 -21.593 30.214 1.00 34.52 N ATOM 2322 CA LYS C 87 14.323 -22.913 30.671 1.00 36.32 C ATOM 2323 C LYS C 87 12.820 -23.055 30.901 1.00 36.85 C ATOM 2324 O LYS C 87 12.207 -22.270 31.636 1.00 36.11 O ATOM 2325 CB LYS C 87 15.068 -23.286 31.958 0.50 35.91 C ATOM 2326 CG LYS C 87 16.573 -23.442 31.787 0.50 38.33 C ATOM 2327 CD LYS C 87 16.910 -24.596 30.855 0.50 38.00 C ATOM 2328 CE LYS C 87 18.412 -24.702 30.628 0.50 38.70 C ATOM 2329 NZ LYS C 87 18.763 -25.841 29.733 0.50 38.09 N ATOM 0 H LYS C 87 15.263 -21.179 30.762 1.00 34.52 H new ATOM 0 HA LYS C 87 14.546 -23.520 29.948 1.00 36.32 H new ATOM 0 HB2 LYS C 87 14.898 -22.605 32.627 0.50 35.91 H new ATOM 0 HB3 LYS C 87 14.704 -24.117 32.301 0.50 35.91 H new ATOM 0 HG2 LYS C 87 16.947 -22.619 31.434 0.50 38.33 H new ATOM 0 HG3 LYS C 87 16.985 -23.592 32.652 0.50 38.33 H new ATOM 0 HD2 LYS C 87 16.578 -25.426 31.231 0.50 38.00 H new ATOM 0 HD3 LYS C 87 16.460 -24.470 30.005 0.50 38.00 H new ATOM 0 HE2 LYS C 87 18.739 -23.875 30.241 0.50 38.70 H new ATOM 0 HE3 LYS C 87 18.860 -24.812 31.481 0.50 38.70 H new ATOM 0 HZ1 LYS C 87 19.646 -25.872 29.623 0.50 38.09 H new ATOM 0 HZ2 LYS C 87 18.483 -26.603 30.098 0.50 38.09 H new ATOM 0 HZ3 LYS C 87 18.370 -25.729 28.942 0.50 38.09 H new ATOM 2330 N LYS C 88 12.240 -24.073 30.272 1.00 36.43 N ATOM 2331 CA LYS C 88 10.818 -24.356 30.406 1.00 37.68 C ATOM 2332 C LYS C 88 10.494 -24.778 31.837 1.00 36.69 C ATOM 2333 O LYS C 88 9.537 -24.293 32.441 1.00 35.34 O ATOM 2334 CB LYS C 88 10.407 -25.469 29.445 1.00 38.03 C ATOM 2335 CG LYS C 88 8.959 -25.904 29.605 1.00 41.25 C ATOM 2336 CD LYS C 88 8.564 -26.909 28.540 1.00 45.59 C ATOM 2337 CE LYS C 88 7.084 -27.262 28.624 1.00 46.21 C ATOM 2338 NZ LYS C 88 6.681 -28.174 27.516 1.00 48.68 N ATOM 0 H LYS C 88 12.661 -24.618 29.756 1.00 36.43 H new ATOM 0 HA LYS C 88 10.325 -23.549 30.191 1.00 37.68 H new ATOM 0 HB2 LYS C 88 10.548 -25.168 28.534 1.00 38.03 H new ATOM 0 HB3 LYS C 88 10.985 -26.236 29.583 1.00 38.03 H new ATOM 0 HG2 LYS C 88 8.832 -26.294 30.484 1.00 41.25 H new ATOM 0 HG3 LYS C 88 8.379 -25.129 29.552 1.00 41.25 H new ATOM 0 HD2 LYS C 88 8.762 -26.546 27.662 1.00 45.59 H new ATOM 0 HD3 LYS C 88 9.096 -27.714 28.640 1.00 45.59 H new ATOM 0 HE2 LYS C 88 6.898 -27.684 29.477 1.00 46.21 H new ATOM 0 HE3 LYS C 88 6.553 -26.451 28.587 1.00 46.21 H new ATOM 0 HZ1 LYS C 88 5.815 -28.364 27.588 1.00 48.68 H new ATOM 0 HZ2 LYS C 88 6.833 -27.777 26.734 1.00 48.68 H new ATOM 0 HZ3 LYS C 88 7.154 -28.926 27.563 1.00 48.68 H new ATOM 2339 N THR C 89 11.290 -25.693 32.376 1.00 36.22 N ATOM 2340 CA THR C 89 11.061 -26.153 33.737 1.00 36.41 C ATOM 2341 C THR C 89 11.226 -24.984 34.701 1.00 34.26 C ATOM 2342 O THR C 89 10.560 -24.928 35.733 1.00 33.63 O ATOM 2343 CB THR C 89 12.027 -27.303 34.124 1.00 37.68 C ATOM 2344 OG1 THR C 89 13.385 -26.887 33.932 1.00 39.46 O ATOM 2345 CG2 THR C 89 11.751 -28.538 33.263 1.00 39.62 C ATOM 0 H THR C 89 11.960 -26.056 31.976 1.00 36.22 H new ATOM 0 HA THR C 89 10.157 -26.501 33.791 1.00 36.41 H new ATOM 0 HB THR C 89 11.885 -27.525 35.057 1.00 37.68 H new ATOM 0 HG1 THR C 89 13.903 -27.513 34.145 1.00 39.46 H new ATOM 0 HG21 THR C 89 12.360 -29.250 33.513 1.00 39.62 H new ATOM 0 HG22 THR C 89 10.837 -28.832 33.401 1.00 39.62 H new ATOM 0 HG23 THR C 89 11.881 -28.316 32.328 1.00 39.62 H new ATOM 2346 N GLU C 90 12.105 -24.046 34.358 1.00 34.00 N ATOM 2347 CA GLU C 90 12.308 -22.877 35.207 1.00 34.58 C ATOM 2348 C GLU C 90 11.021 -22.057 35.222 1.00 34.66 C ATOM 2349 O GLU C 90 10.549 -21.647 36.284 1.00 33.53 O ATOM 2350 CB GLU C 90 13.457 -22.013 34.694 1.00 35.58 C ATOM 2351 CG GLU C 90 13.796 -20.881 35.642 1.00 39.13 C ATOM 2352 CD GLU C 90 15.151 -20.258 35.371 1.00 41.52 C ATOM 2353 OE1 GLU C 90 16.040 -20.966 34.850 1.00 42.76 O ATOM 2354 OE2 GLU C 90 15.328 -19.065 35.699 1.00 40.82 O ATOM 0 H GLU C 90 12.588 -24.067 33.647 1.00 34.00 H new ATOM 0 HA GLU C 90 12.534 -23.175 36.102 1.00 34.58 H new ATOM 0 HB2 GLU C 90 14.242 -22.568 34.563 1.00 35.58 H new ATOM 0 HB3 GLU C 90 13.221 -21.646 33.828 1.00 35.58 H new ATOM 0 HG2 GLU C 90 13.113 -20.196 35.575 1.00 39.13 H new ATOM 0 HG3 GLU C 90 13.776 -21.213 36.553 1.00 39.13 H new ATOM 2355 N ARG C 91 10.459 -21.819 34.038 1.00 32.82 N ATOM 2356 CA ARG C 91 9.215 -21.068 33.930 1.00 34.46 C ATOM 2357 C ARG C 91 8.090 -21.840 34.611 1.00 34.29 C ATOM 2358 O ARG C 91 7.159 -21.250 35.163 1.00 34.16 O ATOM 2359 CB ARG C 91 8.855 -20.827 32.461 1.00 33.43 C ATOM 2360 CG ARG C 91 9.570 -19.641 31.829 1.00 33.51 C ATOM 2361 CD ARG C 91 9.227 -19.534 30.350 1.00 35.52 C ATOM 2362 NE ARG C 91 9.972 -20.507 29.560 1.00 36.19 N ATOM 2363 CZ ARG C 91 9.451 -21.231 28.580 1.00 37.16 C ATOM 2364 NH1 ARG C 91 8.172 -21.098 28.262 1.00 40.24 N ATOM 2365 NH2 ARG C 91 10.209 -22.094 27.922 1.00 37.44 N ATOM 0 H ARG C 91 10.784 -22.084 33.287 1.00 32.82 H new ATOM 0 HA ARG C 91 9.333 -20.209 34.366 1.00 34.46 H new ATOM 0 HB2 ARG C 91 9.064 -21.626 31.952 1.00 33.43 H new ATOM 0 HB3 ARG C 91 7.897 -20.689 32.392 1.00 33.43 H new ATOM 0 HG2 ARG C 91 9.316 -18.823 32.285 1.00 33.51 H new ATOM 0 HG3 ARG C 91 10.529 -19.740 31.937 1.00 33.51 H new ATOM 0 HD2 ARG C 91 8.275 -19.675 30.226 1.00 35.52 H new ATOM 0 HD3 ARG C 91 9.425 -18.639 30.034 1.00 35.52 H new ATOM 0 HE ARG C 91 10.805 -20.618 29.742 1.00 36.19 H new ATOM 0 HH11 ARG C 91 7.678 -20.541 28.692 1.00 40.24 H new ATOM 0 HH12 ARG C 91 7.836 -21.569 27.626 1.00 40.24 H new ATOM 0 HH21 ARG C 91 11.038 -22.184 28.131 1.00 37.44 H new ATOM 0 HH22 ARG C 91 9.872 -22.564 27.286 1.00 37.44 H new ATOM 2366 N GLU C 92 8.182 -23.166 34.571 1.00 34.86 N ATOM 2367 CA GLU C 92 7.166 -24.006 35.188 1.00 33.97 C ATOM 2368 C GLU C 92 7.145 -23.860 36.707 1.00 31.95 C ATOM 2369 O GLU C 92 6.079 -23.710 37.296 1.00 32.00 O ATOM 2370 CB GLU C 92 7.381 -25.470 34.796 1.00 35.49 C ATOM 2371 CG GLU C 92 7.047 -25.757 33.331 1.00 38.94 C ATOM 2372 CD GLU C 92 7.182 -27.226 32.970 1.00 39.23 C ATOM 2373 OE1 GLU C 92 6.835 -27.590 31.825 1.00 40.72 O ATOM 2374 OE2 GLU C 92 7.632 -28.014 33.830 1.00 38.95 O ATOM 0 H GLU C 92 8.823 -23.596 34.192 1.00 34.86 H new ATOM 0 HA GLU C 92 6.303 -23.709 34.858 1.00 33.97 H new ATOM 0 HB2 GLU C 92 8.305 -25.711 34.964 1.00 35.49 H new ATOM 0 HB3 GLU C 92 6.833 -26.034 35.363 1.00 35.49 H new ATOM 0 HG2 GLU C 92 6.140 -25.466 33.148 1.00 38.94 H new ATOM 0 HG3 GLU C 92 7.633 -25.234 32.762 1.00 38.94 H new ATOM 2375 N ASP C 93 8.317 -23.897 37.335 1.00 30.48 N ATOM 2376 CA ASP C 93 8.410 -23.753 38.785 1.00 30.56 C ATOM 2377 C ASP C 93 8.028 -22.335 39.199 1.00 30.96 C ATOM 2378 O ASP C 93 7.344 -22.130 40.203 1.00 29.52 O ATOM 2379 CB ASP C 93 9.831 -24.052 39.253 1.00 31.45 C ATOM 2380 CG ASP C 93 10.254 -25.472 38.951 1.00 31.91 C ATOM 2381 OD1 ASP C 93 11.472 -25.721 38.915 1.00 33.40 O ATOM 2382 OD2 ASP C 93 9.372 -26.337 38.755 1.00 31.36 O ATOM 0 H ASP C 93 9.072 -24.005 36.938 1.00 30.48 H new ATOM 0 HA ASP C 93 7.798 -24.383 39.197 1.00 30.56 H new ATOM 0 HB2 ASP C 93 10.446 -23.436 38.824 1.00 31.45 H new ATOM 0 HB3 ASP C 93 9.893 -23.895 40.208 1.00 31.45 H new ATOM 2383 N LEU C 94 8.481 -21.355 38.426 1.00 29.41 N ATOM 2384 CA LEU C 94 8.169 -19.964 38.725 1.00 29.90 C ATOM 2385 C LEU C 94 6.656 -19.741 38.717 1.00 27.45 C ATOM 2386 O LEU C 94 6.108 -19.107 39.616 1.00 29.56 O ATOM 2387 CB LEU C 94 8.838 -19.040 37.703 1.00 28.32 C ATOM 2388 CG LEU C 94 8.544 -17.553 37.879 1.00 29.84 C ATOM 2389 CD1 LEU C 94 8.885 -17.092 39.295 1.00 27.07 C ATOM 2390 CD2 LEU C 94 9.341 -16.777 36.850 1.00 32.27 C ATOM 0 H LEU C 94 8.968 -21.473 37.727 1.00 29.41 H new ATOM 0 HA LEU C 94 8.510 -19.757 39.609 1.00 29.90 H new ATOM 0 HB2 LEU C 94 9.798 -19.173 37.749 1.00 28.32 H new ATOM 0 HB3 LEU C 94 8.557 -19.307 36.814 1.00 28.32 H new ATOM 0 HG LEU C 94 7.597 -17.391 37.746 1.00 29.84 H new ATOM 0 HD11 LEU C 94 8.690 -16.146 39.383 1.00 27.07 H new ATOM 0 HD12 LEU C 94 8.354 -17.592 39.935 1.00 27.07 H new ATOM 0 HD13 LEU C 94 9.827 -17.245 39.467 1.00 27.07 H new ATOM 0 HD21 LEU C 94 9.163 -15.829 36.951 1.00 32.27 H new ATOM 0 HD22 LEU C 94 10.288 -16.944 36.981 1.00 32.27 H new ATOM 0 HD23 LEU C 94 9.083 -17.061 35.959 1.00 32.27 H new ATOM 2391 N ILE C 95 5.979 -20.274 37.707 1.00 28.04 N ATOM 2392 CA ILE C 95 4.531 -20.115 37.611 1.00 27.94 C ATOM 2393 C ILE C 95 3.768 -20.869 38.703 1.00 28.13 C ATOM 2394 O ILE C 95 2.716 -20.414 39.159 1.00 27.61 O ATOM 2395 CB ILE C 95 4.017 -20.545 36.216 1.00 28.98 C ATOM 2396 CG1 ILE C 95 4.507 -19.538 35.166 1.00 29.54 C ATOM 2397 CG2 ILE C 95 2.486 -20.605 36.209 1.00 29.42 C ATOM 2398 CD1 ILE C 95 4.204 -19.918 33.734 1.00 29.29 C ATOM 0 H ILE C 95 6.335 -20.729 37.070 1.00 28.04 H new ATOM 0 HA ILE C 95 4.358 -19.170 37.742 1.00 27.94 H new ATOM 0 HB ILE C 95 4.360 -21.428 36.006 1.00 28.98 H new ATOM 0 HG12 ILE C 95 4.104 -18.675 35.351 1.00 29.54 H new ATOM 0 HG13 ILE C 95 5.466 -19.430 35.263 1.00 29.54 H new ATOM 0 HG21 ILE C 95 2.177 -20.875 35.330 1.00 29.42 H new ATOM 0 HG22 ILE C 95 2.184 -21.248 36.870 1.00 29.42 H new ATOM 0 HG23 ILE C 95 2.127 -19.730 36.423 1.00 29.42 H new ATOM 0 HD11 ILE C 95 4.545 -19.233 33.138 1.00 29.29 H new ATOM 0 HD12 ILE C 95 4.628 -20.766 33.527 1.00 29.29 H new ATOM 0 HD13 ILE C 95 3.245 -20.000 33.617 1.00 29.29 H new ATOM 2399 N ALA C 96 4.287 -22.019 39.122 1.00 29.15 N ATOM 2400 CA ALA C 96 3.626 -22.782 40.174 1.00 29.28 C ATOM 2401 C ALA C 96 3.708 -21.947 41.445 1.00 30.17 C ATOM 2402 O ALA C 96 2.770 -21.907 42.243 1.00 31.01 O ATOM 2403 CB ALA C 96 4.316 -24.119 40.370 1.00 28.66 C ATOM 0 H ALA C 96 5.010 -22.370 38.816 1.00 29.15 H new ATOM 0 HA ALA C 96 2.702 -22.965 39.941 1.00 29.28 H new ATOM 0 HB1 ALA C 96 3.867 -24.615 41.072 1.00 28.66 H new ATOM 0 HB2 ALA C 96 4.282 -24.625 39.543 1.00 28.66 H new ATOM 0 HB3 ALA C 96 5.242 -23.972 40.620 1.00 28.66 H new ATOM 2404 N TYR C 97 4.840 -21.273 41.622 1.00 29.24 N ATOM 2405 CA TYR C 97 5.036 -20.417 42.783 1.00 29.23 C ATOM 2406 C TYR C 97 4.085 -19.228 42.717 1.00 29.31 C ATOM 2407 O TYR C 97 3.400 -18.917 43.694 1.00 27.31 O ATOM 2408 CB TYR C 97 6.477 -19.898 42.844 1.00 30.92 C ATOM 2409 CG TYR C 97 6.644 -18.771 43.839 1.00 29.42 C ATOM 2410 CD1 TYR C 97 6.558 -19.006 45.210 1.00 31.55 C ATOM 2411 CD2 TYR C 97 6.821 -17.460 43.406 1.00 29.08 C ATOM 2412 CE1 TYR C 97 6.637 -17.957 46.128 1.00 32.28 C ATOM 2413 CE2 TYR C 97 6.901 -16.406 44.311 1.00 31.78 C ATOM 2414 CZ TYR C 97 6.805 -16.659 45.669 1.00 32.07 C ATOM 2415 OH TYR C 97 6.854 -15.610 46.560 1.00 30.66 O ATOM 0 H TYR C 97 5.507 -21.299 41.080 1.00 29.24 H new ATOM 0 HA TYR C 97 4.856 -20.943 43.578 1.00 29.23 H new ATOM 0 HB2 TYR C 97 7.071 -20.627 43.083 1.00 30.92 H new ATOM 0 HB3 TYR C 97 6.745 -19.591 41.964 1.00 30.92 H new ATOM 0 HD1 TYR C 97 6.446 -19.876 45.519 1.00 31.55 H new ATOM 0 HD2 TYR C 97 6.887 -17.285 42.495 1.00 29.08 H new ATOM 0 HE1 TYR C 97 6.577 -18.127 47.040 1.00 32.28 H new ATOM 0 HE2 TYR C 97 7.018 -15.536 44.005 1.00 31.78 H new ATOM 0 HH TYR C 97 6.959 -14.890 46.140 1.00 30.66 H new ATOM 2416 N LEU C 98 4.049 -18.558 41.565 1.00 28.84 N ATOM 2417 CA LEU C 98 3.173 -17.405 41.397 1.00 29.85 C ATOM 2418 C LEU C 98 1.709 -17.800 41.576 1.00 31.50 C ATOM 2419 O LEU C 98 0.916 -17.036 42.132 1.00 32.02 O ATOM 2420 CB LEU C 98 3.361 -16.765 40.014 1.00 28.52 C ATOM 2421 CG LEU C 98 4.700 -16.094 39.689 1.00 27.46 C ATOM 2422 CD1 LEU C 98 4.706 -15.637 38.228 1.00 26.83 C ATOM 2423 CD2 LEU C 98 4.928 -14.914 40.627 1.00 29.21 C ATOM 0 H LEU C 98 4.522 -18.755 40.874 1.00 28.84 H new ATOM 0 HA LEU C 98 3.413 -16.759 42.079 1.00 29.85 H new ATOM 0 HB2 LEU C 98 3.208 -17.454 39.348 1.00 28.52 H new ATOM 0 HB3 LEU C 98 2.664 -16.100 39.900 1.00 28.52 H new ATOM 0 HG LEU C 98 5.421 -16.730 39.816 1.00 27.46 H new ATOM 0 HD11 LEU C 98 5.554 -15.213 38.025 1.00 26.83 H new ATOM 0 HD12 LEU C 98 4.582 -16.405 37.648 1.00 26.83 H new ATOM 0 HD13 LEU C 98 3.986 -15.004 38.084 1.00 26.83 H new ATOM 0 HD21 LEU C 98 5.776 -14.493 40.417 1.00 29.21 H new ATOM 0 HD22 LEU C 98 4.212 -14.269 40.517 1.00 29.21 H new ATOM 0 HD23 LEU C 98 4.941 -15.228 41.545 1.00 29.21 H new ATOM 2424 N LYS C 99 1.346 -18.988 41.108 1.00 30.60 N ATOM 2425 CA LYS C 99 -0.034 -19.419 41.244 1.00 34.15 C ATOM 2426 C LYS C 99 -0.441 -19.402 42.719 1.00 34.54 C ATOM 2427 O LYS C 99 -1.567 -19.040 43.059 1.00 33.67 O ATOM 2428 CB LYS C 99 -0.220 -20.821 40.663 1.00 35.92 C ATOM 2429 CG LYS C 99 -1.684 -21.235 40.523 1.00 39.01 C ATOM 2430 CD LYS C 99 -1.823 -22.697 40.120 1.00 41.28 C ATOM 2431 CE LYS C 99 -1.338 -22.954 38.702 1.00 45.55 C ATOM 2432 NZ LYS C 99 -2.310 -22.478 37.676 1.00 45.77 N ATOM 0 H LYS C 99 1.871 -19.547 40.718 1.00 30.60 H new ATOM 0 HA LYS C 99 -0.601 -18.806 40.750 1.00 34.15 H new ATOM 0 HB2 LYS C 99 0.204 -20.861 39.792 1.00 35.92 H new ATOM 0 HB3 LYS C 99 0.237 -21.461 41.231 1.00 35.92 H new ATOM 0 HG2 LYS C 99 -2.144 -21.086 41.364 1.00 39.01 H new ATOM 0 HG3 LYS C 99 -2.117 -20.674 39.860 1.00 39.01 H new ATOM 0 HD2 LYS C 99 -1.319 -23.250 40.737 1.00 41.28 H new ATOM 0 HD3 LYS C 99 -2.753 -22.964 40.195 1.00 41.28 H new ATOM 0 HE2 LYS C 99 -0.486 -22.510 38.568 1.00 45.55 H new ATOM 0 HE3 LYS C 99 -1.184 -23.904 38.582 1.00 45.55 H new ATOM 0 HZ1 LYS C 99 -2.187 -22.929 36.919 1.00 45.77 H new ATOM 0 HZ2 LYS C 99 -3.140 -22.611 37.969 1.00 45.77 H new ATOM 0 HZ3 LYS C 99 -2.184 -21.610 37.528 1.00 45.77 H new ATOM 2433 N LYS C 100 0.490 -19.770 43.593 1.00 34.54 N ATOM 2434 CA LYS C 100 0.219 -19.803 45.026 1.00 36.16 C ATOM 2435 C LYS C 100 0.382 -18.449 45.725 1.00 34.87 C ATOM 2436 O LYS C 100 -0.542 -17.964 46.381 1.00 34.88 O ATOM 2437 CB LYS C 100 1.128 -20.841 45.690 1.00 38.61 C ATOM 2438 CG LYS C 100 1.026 -20.909 47.209 1.00 43.68 C ATOM 2439 CD LYS C 100 1.881 -22.052 47.754 1.00 45.04 C ATOM 2440 CE LYS C 100 1.784 -22.168 49.270 1.00 47.31 C ATOM 2441 NZ LYS C 100 2.361 -20.992 49.986 1.00 47.18 N ATOM 0 H LYS C 100 1.288 -20.005 43.376 1.00 34.54 H new ATOM 0 HA LYS C 100 -0.716 -20.044 45.124 1.00 36.16 H new ATOM 0 HB2 LYS C 100 0.918 -21.715 45.326 1.00 38.61 H new ATOM 0 HB3 LYS C 100 2.047 -20.647 45.449 1.00 38.61 H new ATOM 0 HG2 LYS C 100 1.316 -20.068 47.596 1.00 43.68 H new ATOM 0 HG3 LYS C 100 0.101 -21.037 47.471 1.00 43.68 H new ATOM 0 HD2 LYS C 100 1.599 -22.887 47.348 1.00 45.04 H new ATOM 0 HD3 LYS C 100 2.807 -21.911 47.500 1.00 45.04 H new ATOM 0 HE2 LYS C 100 0.853 -22.268 49.522 1.00 47.31 H new ATOM 0 HE3 LYS C 100 2.244 -22.972 49.557 1.00 47.31 H new ATOM 0 HZ1 LYS C 100 2.332 -21.135 50.864 1.00 47.18 H new ATOM 0 HZ2 LYS C 100 3.206 -20.875 49.733 1.00 47.18 H new ATOM 0 HZ3 LYS C 100 1.889 -20.263 49.789 1.00 47.18 H new ATOM 2442 N ALA C 101 1.551 -17.835 45.562 1.00 33.40 N ATOM 2443 CA ALA C 101 1.861 -16.563 46.207 1.00 32.53 C ATOM 2444 C ALA C 101 1.005 -15.359 45.811 1.00 33.24 C ATOM 2445 O ALA C 101 0.813 -14.451 46.618 1.00 33.41 O ATOM 2446 CB ALA C 101 3.342 -16.235 46.006 1.00 33.51 C ATOM 0 H ALA C 101 2.187 -18.145 45.074 1.00 33.40 H new ATOM 0 HA ALA C 101 1.641 -16.709 47.140 1.00 32.53 H new ATOM 0 HB1 ALA C 101 3.547 -15.390 46.435 1.00 33.51 H new ATOM 0 HB2 ALA C 101 3.885 -16.936 46.398 1.00 33.51 H new ATOM 0 HB3 ALA C 101 3.534 -16.171 45.057 1.00 33.51 H new ATOM 2447 N THR C 102 0.499 -15.334 44.583 1.00 32.05 N ATOM 2448 CA THR C 102 -0.325 -14.209 44.146 1.00 34.41 C ATOM 2449 C THR C 102 -1.795 -14.473 44.458 1.00 36.49 C ATOM 2450 O THR C 102 -2.664 -13.652 44.169 1.00 36.25 O ATOM 2451 CB THR C 102 -0.201 -13.969 42.623 1.00 33.69 C ATOM 2452 OG1 THR C 102 -0.836 -15.042 41.918 1.00 30.40 O ATOM 2453 CG2 THR C 102 1.264 -13.893 42.209 1.00 31.64 C ATOM 0 H THR C 102 0.618 -15.949 43.993 1.00 32.05 H new ATOM 0 HA THR C 102 -0.008 -13.427 44.624 1.00 34.41 H new ATOM 0 HB THR C 102 -0.632 -13.128 42.406 1.00 33.69 H new ATOM 0 HG1 THR C 102 -0.304 -15.689 41.854 1.00 30.40 H new ATOM 0 HG21 THR C 102 1.323 -13.742 41.253 1.00 31.64 H new ATOM 0 HG22 THR C 102 1.696 -13.162 42.678 1.00 31.64 H new ATOM 0 HG23 THR C 102 1.707 -14.726 42.433 1.00 31.64 H new ATOM 2454 N ASN C 103 -2.071 -15.623 45.054 1.00 41.53 N ATOM 2455 CA ASN C 103 -3.443 -15.994 45.369 1.00 46.56 C ATOM 2456 C ASN C 103 -3.675 -16.141 46.867 1.00 49.32 C ATOM 2457 O ASN C 103 -4.643 -16.772 47.286 1.00 50.68 O ATOM 2458 CB ASN C 103 -3.781 -17.311 44.661 1.00 48.12 C ATOM 2459 CG ASN C 103 -5.253 -17.658 44.738 1.00 50.58 C ATOM 2460 OD1 ASN C 103 -6.096 -16.968 44.168 1.00 52.68 O ATOM 2461 ND2 ASN C 103 -5.570 -18.735 45.449 1.00 52.33 N ATOM 0 H ASN C 103 -1.480 -16.203 45.285 1.00 41.53 H new ATOM 0 HA ASN C 103 -4.023 -15.281 45.058 1.00 46.56 H new ATOM 0 HB2 ASN C 103 -3.516 -17.250 43.730 1.00 48.12 H new ATOM 0 HB3 ASN C 103 -3.263 -18.029 45.057 1.00 48.12 H new ATOM 0 HD21 ASN C 103 -6.393 -18.974 45.524 1.00 52.33 H new ATOM 0 HD22 ASN C 103 -4.952 -19.193 45.834 1.00 52.33 H new ATOM 2462 N GLU C 104 -2.791 -15.562 47.675 1.00 52.15 N ATOM 2463 CA GLU C 104 -2.920 -15.651 49.127 1.00 54.27 C ATOM 2464 C GLU C 104 -4.302 -15.195 49.586 1.00 55.52 C ATOM 2465 O GLU C 104 -5.043 -14.626 48.755 1.00 56.36 O ATOM 2466 CB GLU C 104 -1.866 -14.784 49.807 1.00 55.60 C ATOM 2467 CG GLU C 104 -1.985 -13.308 49.459 1.00 58.61 C ATOM 2468 CD GLU C 104 -1.088 -12.430 50.307 1.00 59.66 C ATOM 2469 OE1 GLU C 104 0.143 -12.650 50.301 1.00 60.81 O ATOM 2470 OE2 GLU C 104 -1.614 -11.517 50.979 1.00 60.79 O ATOM 2471 OXT GLU C 104 -4.621 -15.401 50.777 1.00 56.84 O ATOM 0 H GLU C 104 -2.110 -15.113 47.403 1.00 52.15 H new ATOM 0 HA GLU C 104 -2.794 -16.580 49.375 1.00 54.27 H new ATOM 0 HB2 GLU C 104 -1.940 -14.890 50.768 1.00 55.60 H new ATOM 0 HB3 GLU C 104 -0.984 -15.099 49.554 1.00 55.60 H new ATOM 0 HG2 GLU C 104 -1.763 -13.182 48.523 1.00 58.61 H new ATOM 0 HG3 GLU C 104 -2.906 -13.027 49.572 1.00 58.61 H new TER 2472 GLU C 104 ATOM 2473 N GLY D 1 1.867 21.638 41.134 1.00 34.90 N ATOM 2474 CA GLY D 1 1.868 20.156 41.313 1.00 34.94 C ATOM 2475 C GLY D 1 1.848 19.737 42.772 1.00 35.79 C ATOM 2476 O GLY D 1 2.305 20.477 43.643 1.00 34.86 O ATOM 0 H1 GLY D 1 1.083 21.897 40.802 1.00 34.90 H new ATOM 0 H2 GLY D 1 2.001 22.032 41.921 1.00 34.90 H new ATOM 0 H3 GLY D 1 2.517 21.870 40.572 1.00 34.90 H new ATOM 0 HA2 GLY D 1 1.096 19.780 40.863 1.00 34.94 H new ATOM 0 HA3 GLY D 1 2.655 19.784 40.885 1.00 34.94 H new ATOM 2477 N ASP D 2 1.316 18.547 43.035 1.00 36.88 N ATOM 2478 CA ASP D 2 1.227 18.005 44.392 1.00 39.19 C ATOM 2479 C ASP D 2 2.585 17.424 44.784 1.00 39.67 C ATOM 2480 O ASP D 2 2.974 16.363 44.299 1.00 39.15 O ATOM 2481 CB ASP D 2 0.166 16.901 44.437 1.00 40.83 C ATOM 2482 CG ASP D 2 -0.189 16.479 45.855 1.00 44.98 C ATOM 2483 OD1 ASP D 2 0.726 16.349 46.699 1.00 46.59 O ATOM 2484 OD2 ASP D 2 -1.392 16.261 46.119 1.00 45.11 O ATOM 0 H ASP D 2 0.994 18.027 42.430 1.00 36.88 H new ATOM 0 HA ASP D 2 0.979 18.710 45.011 1.00 39.19 H new ATOM 0 HB2 ASP D 2 -0.635 17.210 43.986 1.00 40.83 H new ATOM 0 HB3 ASP D 2 0.488 16.129 43.946 1.00 40.83 H new ATOM 2485 N VAL D 3 3.303 18.119 45.661 1.00 41.28 N ATOM 2486 CA VAL D 3 4.621 17.663 46.094 1.00 43.80 C ATOM 2487 C VAL D 3 4.590 16.288 46.756 1.00 44.31 C ATOM 2488 O VAL D 3 5.389 15.416 46.423 1.00 43.94 O ATOM 2489 CB VAL D 3 5.260 18.667 47.065 1.00 44.08 C ATOM 2490 CG1 VAL D 3 6.571 18.117 47.600 1.00 45.48 C ATOM 2491 CG2 VAL D 3 5.496 19.985 46.351 1.00 45.57 C ATOM 0 H VAL D 3 3.045 18.858 46.018 1.00 41.28 H new ATOM 0 HA VAL D 3 5.153 17.595 45.286 1.00 43.80 H new ATOM 0 HB VAL D 3 4.660 18.814 47.813 1.00 44.08 H new ATOM 0 HG11 VAL D 3 6.966 18.758 48.211 1.00 45.48 H new ATOM 0 HG12 VAL D 3 6.406 17.284 48.068 1.00 45.48 H new ATOM 0 HG13 VAL D 3 7.180 17.957 46.862 1.00 45.48 H new ATOM 0 HG21 VAL D 3 5.900 20.618 46.965 1.00 45.57 H new ATOM 0 HG22 VAL D 3 6.090 19.843 45.597 1.00 45.57 H new ATOM 0 HG23 VAL D 3 4.650 20.337 46.034 1.00 45.57 H new ATOM 2492 N GLU D 4 3.672 16.095 47.695 1.00 45.18 N ATOM 2493 CA GLU D 4 3.564 14.815 48.380 1.00 45.61 C ATOM 2494 C GLU D 4 3.454 13.673 47.378 1.00 43.43 C ATOM 2495 O GLU D 4 4.175 12.687 47.484 1.00 43.21 O ATOM 2496 CB GLU D 4 2.348 14.808 49.312 1.00 49.29 C ATOM 2497 CG GLU D 4 2.680 15.053 50.780 1.00 54.65 C ATOM 2498 CD GLU D 4 3.326 16.405 51.030 1.00 57.75 C ATOM 2499 OE1 GLU D 4 3.669 16.691 52.200 1.00 60.42 O ATOM 2500 OE2 GLU D 4 3.486 17.181 50.063 1.00 59.87 O ATOM 0 H GLU D 4 3.105 16.689 47.949 1.00 45.18 H new ATOM 0 HA GLU D 4 4.368 14.688 48.908 1.00 45.61 H new ATOM 0 HB2 GLU D 4 1.722 15.487 49.015 1.00 49.29 H new ATOM 0 HB3 GLU D 4 1.897 13.953 49.232 1.00 49.29 H new ATOM 0 HG2 GLU D 4 1.867 14.988 51.305 1.00 54.65 H new ATOM 0 HG3 GLU D 4 3.276 14.354 51.092 1.00 54.65 H new ATOM 2501 N LYS D 5 2.548 13.810 46.412 1.00 42.46 N ATOM 2502 CA LYS D 5 2.361 12.782 45.391 1.00 41.24 C ATOM 2503 C LYS D 5 3.648 12.620 44.608 1.00 40.53 C ATOM 2504 O LYS D 5 4.076 11.502 44.319 1.00 39.96 O ATOM 2505 CB LYS D 5 1.247 13.165 44.415 1.00 42.24 C ATOM 2506 CG LYS D 5 -0.132 13.291 45.029 1.00 45.85 C ATOM 2507 CD LYS D 5 -1.185 13.440 43.944 1.00 48.19 C ATOM 2508 CE LYS D 5 -2.587 13.519 44.528 1.00 49.41 C ATOM 2509 NZ LYS D 5 -3.624 13.482 43.462 1.00 50.93 N ATOM 0 H LYS D 5 2.031 14.492 46.330 1.00 42.46 H new ATOM 0 HA LYS D 5 2.118 11.955 45.836 1.00 41.24 H new ATOM 0 HB2 LYS D 5 1.478 14.010 43.998 1.00 42.24 H new ATOM 0 HB3 LYS D 5 1.212 12.500 43.709 1.00 42.24 H new ATOM 0 HG2 LYS D 5 -0.324 12.509 45.569 1.00 45.85 H new ATOM 0 HG3 LYS D 5 -0.159 14.058 45.622 1.00 45.85 H new ATOM 0 HD2 LYS D 5 -1.005 14.240 43.425 1.00 48.19 H new ATOM 0 HD3 LYS D 5 -1.130 12.688 43.334 1.00 48.19 H new ATOM 0 HE2 LYS D 5 -2.725 12.781 45.141 1.00 49.41 H new ATOM 0 HE3 LYS D 5 -2.679 14.336 45.042 1.00 49.41 H new ATOM 0 HZ1 LYS D 5 -4.432 13.530 43.832 1.00 50.93 H new ATOM 0 HZ2 LYS D 5 -3.509 14.172 42.912 1.00 50.93 H new ATOM 0 HZ3 LYS D 5 -3.552 12.722 43.004 1.00 50.93 H new ATOM 2510 N GLY D 6 4.252 13.754 44.261 1.00 39.63 N ATOM 2511 CA GLY D 6 5.490 13.743 43.508 1.00 38.73 C ATOM 2512 C GLY D 6 6.568 12.924 44.191 1.00 37.30 C ATOM 2513 O GLY D 6 7.344 12.241 43.527 1.00 35.48 O ATOM 0 H GLY D 6 3.957 14.538 44.455 1.00 39.63 H new ATOM 0 HA2 GLY D 6 5.325 13.383 42.622 1.00 38.73 H new ATOM 0 HA3 GLY D 6 5.803 14.653 43.390 1.00 38.73 H new ATOM 2514 N LYS D 7 6.610 12.985 45.520 1.00 36.25 N ATOM 2515 CA LYS D 7 7.611 12.242 46.276 1.00 36.60 C ATOM 2516 C LYS D 7 7.393 10.737 46.168 1.00 36.68 C ATOM 2517 O LYS D 7 8.352 9.972 46.018 1.00 35.12 O ATOM 2518 CB LYS D 7 7.589 12.661 47.745 1.00 37.08 C ATOM 2519 CG LYS D 7 8.629 11.949 48.590 1.00 37.14 C ATOM 2520 CD LYS D 7 8.566 12.415 50.030 1.00 41.71 C ATOM 2521 CE LYS D 7 9.595 11.705 50.890 1.00 41.32 C ATOM 2522 NZ LYS D 7 9.426 12.068 52.324 1.00 45.96 N ATOM 0 H LYS D 7 6.069 13.450 46.000 1.00 36.25 H new ATOM 0 HA LYS D 7 8.478 12.451 45.894 1.00 36.60 H new ATOM 0 HB2 LYS D 7 7.734 13.618 47.804 1.00 37.08 H new ATOM 0 HB3 LYS D 7 6.708 12.485 48.112 1.00 37.08 H new ATOM 0 HG2 LYS D 7 8.483 10.991 48.549 1.00 37.14 H new ATOM 0 HG3 LYS D 7 9.514 12.117 48.230 1.00 37.14 H new ATOM 0 HD2 LYS D 7 8.716 13.373 50.068 1.00 41.71 H new ATOM 0 HD3 LYS D 7 7.678 12.253 50.385 1.00 41.71 H new ATOM 0 HE2 LYS D 7 9.506 10.745 50.782 1.00 41.32 H new ATOM 0 HE3 LYS D 7 10.488 11.942 50.595 1.00 41.32 H new ATOM 0 HZ1 LYS D 7 10.037 11.643 52.812 1.00 45.96 H new ATOM 0 HZ2 LYS D 7 9.527 12.947 52.422 1.00 45.96 H new ATOM 0 HZ3 LYS D 7 8.612 11.832 52.596 1.00 45.96 H new ATOM 2523 N LYS D 8 6.132 10.316 46.246 1.00 36.31 N ATOM 2524 CA LYS D 8 5.799 8.899 46.150 1.00 37.80 C ATOM 2525 C LYS D 8 6.136 8.388 44.757 1.00 36.94 C ATOM 2526 O LYS D 8 6.545 7.240 44.587 1.00 36.48 O ATOM 2527 CB LYS D 8 4.313 8.668 46.456 1.00 38.54 C ATOM 2528 CG LYS D 8 3.960 8.863 47.921 1.00 42.34 C ATOM 2529 CD LYS D 8 2.467 8.718 48.177 1.00 43.69 C ATOM 2530 CE LYS D 8 2.151 8.975 49.645 1.00 45.56 C ATOM 2531 NZ LYS D 8 0.686 8.972 49.919 1.00 46.74 N ATOM 0 H LYS D 8 5.456 10.836 46.354 1.00 36.31 H new ATOM 0 HA LYS D 8 6.321 8.410 46.805 1.00 37.80 H new ATOM 0 HB2 LYS D 8 3.781 9.276 45.919 1.00 38.54 H new ATOM 0 HB3 LYS D 8 4.071 7.767 46.189 1.00 38.54 H new ATOM 0 HG2 LYS D 8 4.443 8.215 48.457 1.00 42.34 H new ATOM 0 HG3 LYS D 8 4.252 9.742 48.208 1.00 42.34 H new ATOM 0 HD2 LYS D 8 1.976 9.342 47.620 1.00 43.69 H new ATOM 0 HD3 LYS D 8 2.176 7.827 47.929 1.00 43.69 H new ATOM 0 HE2 LYS D 8 2.581 8.297 50.189 1.00 45.56 H new ATOM 0 HE3 LYS D 8 2.525 9.830 49.909 1.00 45.56 H new ATOM 0 HZ1 LYS D 8 0.545 9.125 50.784 1.00 46.74 H new ATOM 0 HZ2 LYS D 8 0.292 9.609 49.438 1.00 46.74 H new ATOM 0 HZ3 LYS D 8 0.344 8.180 49.699 1.00 46.74 H new ATOM 2532 N ILE D 9 5.962 9.240 43.753 1.00 36.03 N ATOM 2533 CA ILE D 9 6.293 8.838 42.396 1.00 33.84 C ATOM 2534 C ILE D 9 7.810 8.687 42.320 1.00 32.46 C ATOM 2535 O ILE D 9 8.320 7.736 41.731 1.00 33.22 O ATOM 2536 CB ILE D 9 5.845 9.881 41.361 1.00 34.46 C ATOM 2537 CG1 ILE D 9 4.319 9.996 41.367 1.00 36.46 C ATOM 2538 CG2 ILE D 9 6.362 9.491 39.988 1.00 33.24 C ATOM 2539 CD1 ILE D 9 3.756 10.949 40.310 1.00 36.86 C ATOM 0 H ILE D 9 5.659 10.041 43.835 1.00 36.03 H new ATOM 0 HA ILE D 9 5.833 8.008 42.193 1.00 33.84 H new ATOM 0 HB ILE D 9 6.213 10.749 41.590 1.00 34.46 H new ATOM 0 HG12 ILE D 9 3.938 9.115 41.229 1.00 36.46 H new ATOM 0 HG13 ILE D 9 4.031 10.295 42.244 1.00 36.46 H new ATOM 0 HG21 ILE D 9 6.078 10.151 39.336 1.00 33.24 H new ATOM 0 HG22 ILE D 9 7.331 9.451 40.006 1.00 33.24 H new ATOM 0 HG23 ILE D 9 6.008 8.622 39.743 1.00 33.24 H new ATOM 0 HD11 ILE D 9 2.788 10.969 40.375 1.00 36.86 H new ATOM 0 HD12 ILE D 9 4.108 11.841 40.457 1.00 36.86 H new ATOM 0 HD13 ILE D 9 4.014 10.642 39.427 1.00 36.86 H new ATOM 2540 N PHE D 10 8.533 9.621 42.929 1.00 31.49 N ATOM 2541 CA PHE D 10 9.992 9.560 42.909 1.00 30.16 C ATOM 2542 C PHE D 10 10.513 8.276 43.555 1.00 29.53 C ATOM 2543 O PHE D 10 11.305 7.545 42.960 1.00 28.37 O ATOM 2544 CB PHE D 10 10.602 10.753 43.641 1.00 27.12 C ATOM 2545 CG PHE D 10 12.087 10.834 43.492 1.00 28.07 C ATOM 2546 CD1 PHE D 10 12.652 11.410 42.357 1.00 26.04 C ATOM 2547 CD2 PHE D 10 12.928 10.259 44.446 1.00 28.64 C ATOM 2548 CE1 PHE D 10 14.026 11.410 42.167 1.00 25.13 C ATOM 2549 CE2 PHE D 10 14.307 10.251 44.265 1.00 25.64 C ATOM 2550 CZ PHE D 10 14.859 10.828 43.122 1.00 27.13 C ATOM 0 H PHE D 10 8.204 10.292 43.355 1.00 31.49 H new ATOM 0 HA PHE D 10 10.256 9.577 41.976 1.00 30.16 H new ATOM 0 HB2 PHE D 10 10.203 11.571 43.304 1.00 27.12 H new ATOM 0 HB3 PHE D 10 10.379 10.696 44.583 1.00 27.12 H new ATOM 0 HD1 PHE D 10 12.101 11.800 41.718 1.00 26.04 H new ATOM 0 HD2 PHE D 10 12.562 9.877 45.211 1.00 28.64 H new ATOM 0 HE1 PHE D 10 14.391 11.797 41.404 1.00 25.13 H new ATOM 0 HE2 PHE D 10 14.859 9.862 44.904 1.00 25.64 H new ATOM 0 HZ PHE D 10 15.781 10.825 42.997 1.00 27.13 H new ATOM 2551 N VAL D 11 10.064 8.013 44.777 1.00 29.81 N ATOM 2552 CA VAL D 11 10.484 6.831 45.518 1.00 31.55 C ATOM 2553 C VAL D 11 10.195 5.531 44.766 1.00 32.28 C ATOM 2554 O VAL D 11 10.945 4.558 44.869 1.00 33.05 O ATOM 2555 CB VAL D 11 9.780 6.765 46.888 1.00 31.38 C ATOM 2556 CG1 VAL D 11 10.106 5.442 47.580 1.00 31.15 C ATOM 2557 CG2 VAL D 11 10.218 7.933 47.749 1.00 31.60 C ATOM 0 H VAL D 11 9.508 8.515 45.199 1.00 29.81 H new ATOM 0 HA VAL D 11 11.444 6.915 45.633 1.00 31.55 H new ATOM 0 HB VAL D 11 8.820 6.817 46.756 1.00 31.38 H new ATOM 0 HG11 VAL D 11 9.660 5.408 48.441 1.00 31.15 H new ATOM 0 HG12 VAL D 11 9.801 4.704 47.029 1.00 31.15 H new ATOM 0 HG13 VAL D 11 11.065 5.372 47.710 1.00 31.15 H new ATOM 0 HG21 VAL D 11 9.772 7.886 48.609 1.00 31.60 H new ATOM 0 HG22 VAL D 11 11.178 7.896 47.881 1.00 31.60 H new ATOM 0 HG23 VAL D 11 9.984 8.765 47.309 1.00 31.60 H new ATOM 2558 N GLN D 12 9.107 5.516 44.009 1.00 31.07 N ATOM 2559 CA GLN D 12 8.737 4.325 43.269 1.00 31.44 C ATOM 2560 C GLN D 12 9.413 4.149 41.908 1.00 32.04 C ATOM 2561 O GLN D 12 9.759 3.030 41.527 1.00 33.89 O ATOM 2562 CB GLN D 12 7.219 4.290 43.074 1.00 32.13 C ATOM 2563 CG GLN D 12 6.737 3.038 42.379 1.00 33.90 C ATOM 2564 CD GLN D 12 5.255 3.072 42.060 1.00 37.30 C ATOM 2565 OE1 GLN D 12 4.437 3.421 42.912 1.00 35.74 O ATOM 2566 NE2 GLN D 12 4.900 2.694 40.828 1.00 32.98 N ATOM 0 H GLN D 12 8.573 6.183 43.912 1.00 31.07 H new ATOM 0 HA GLN D 12 9.054 3.589 43.815 1.00 31.44 H new ATOM 0 HB2 GLN D 12 6.786 4.360 43.939 1.00 32.13 H new ATOM 0 HB3 GLN D 12 6.947 5.065 42.557 1.00 32.13 H new ATOM 0 HG2 GLN D 12 7.237 2.917 41.557 1.00 33.90 H new ATOM 0 HG3 GLN D 12 6.925 2.270 42.940 1.00 33.90 H new ATOM 0 HE21 GLN D 12 5.501 2.457 40.261 1.00 32.98 H new ATOM 0 HE22 GLN D 12 4.070 2.688 40.602 1.00 32.98 H new ATOM 2567 N LYS D 13 9.610 5.241 41.176 1.00 31.28 N ATOM 2568 CA LYS D 13 10.193 5.149 39.837 1.00 30.36 C ATOM 2569 C LYS D 13 11.563 5.785 39.606 1.00 30.18 C ATOM 2570 O LYS D 13 12.157 5.585 38.549 1.00 30.13 O ATOM 2571 CB LYS D 13 9.216 5.749 38.823 1.00 31.02 C ATOM 2572 CG LYS D 13 7.782 5.225 38.939 1.00 31.47 C ATOM 2573 CD LYS D 13 6.840 5.965 37.999 1.00 29.65 C ATOM 2574 CE LYS D 13 5.405 5.467 38.152 1.00 31.07 C ATOM 2575 NZ LYS D 13 4.460 6.115 37.188 1.00 27.38 N ATOM 0 H LYS D 13 9.416 6.039 41.431 1.00 31.28 H new ATOM 0 HA LYS D 13 10.346 4.198 39.726 1.00 30.36 H new ATOM 0 HB2 LYS D 13 9.206 6.713 38.931 1.00 31.02 H new ATOM 0 HB3 LYS D 13 9.544 5.567 37.928 1.00 31.02 H new ATOM 0 HG2 LYS D 13 7.765 4.277 38.735 1.00 31.47 H new ATOM 0 HG3 LYS D 13 7.473 5.324 39.853 1.00 31.47 H new ATOM 0 HD2 LYS D 13 6.876 6.917 38.184 1.00 29.65 H new ATOM 0 HD3 LYS D 13 7.132 5.843 37.082 1.00 29.65 H new ATOM 0 HE2 LYS D 13 5.385 4.506 38.022 1.00 31.07 H new ATOM 0 HE3 LYS D 13 5.103 5.637 39.058 1.00 31.07 H new ATOM 0 HZ1 LYS D 13 3.642 5.784 37.305 1.00 27.38 H new ATOM 0 HZ2 LYS D 13 4.447 6.993 37.330 1.00 27.38 H new ATOM 0 HZ3 LYS D 13 4.728 5.954 36.355 1.00 27.38 H new ATOM 2576 N CYS D 14 12.074 6.535 40.577 1.00 27.75 N ATOM 2577 CA CYS D 14 13.353 7.217 40.393 1.00 28.40 C ATOM 2578 C CYS D 14 14.455 6.895 41.403 1.00 28.29 C ATOM 2579 O CYS D 14 15.617 6.743 41.027 1.00 27.12 O ATOM 2580 CB CYS D 14 13.125 8.731 40.409 1.00 29.90 C ATOM 2581 SG CYS D 14 11.655 9.305 39.497 1.00 30.32 S ATOM 0 H CYS D 14 11.702 6.662 41.342 1.00 27.75 H new ATOM 0 HA CYS D 14 13.677 6.884 39.542 1.00 28.40 H new ATOM 0 HB2 CYS D 14 13.050 9.022 41.331 1.00 29.90 H new ATOM 0 HB3 CYS D 14 13.909 9.165 40.037 1.00 29.90 H new ATOM 2582 N ALA D 15 14.085 6.819 42.681 1.00 28.83 N ATOM 2583 CA ALA D 15 15.032 6.563 43.768 1.00 30.72 C ATOM 2584 C ALA D 15 16.057 5.470 43.501 1.00 30.95 C ATOM 2585 O ALA D 15 17.220 5.605 43.884 1.00 31.04 O ATOM 2586 CB ALA D 15 14.273 6.256 45.058 1.00 29.69 C ATOM 0 H ALA D 15 13.272 6.915 42.944 1.00 28.83 H new ATOM 0 HA ALA D 15 15.548 7.380 43.849 1.00 30.72 H new ATOM 0 HB1 ALA D 15 14.906 6.087 45.774 1.00 29.69 H new ATOM 0 HB2 ALA D 15 13.714 7.013 45.293 1.00 29.69 H new ATOM 0 HB3 ALA D 15 13.717 5.472 44.928 1.00 29.69 H new ATOM 2587 N GLN D 16 15.635 4.395 42.843 1.00 32.02 N ATOM 2588 CA GLN D 16 16.544 3.292 42.553 1.00 33.82 C ATOM 2589 C GLN D 16 17.798 3.708 41.791 1.00 32.67 C ATOM 2590 O GLN D 16 18.838 3.064 41.918 1.00 33.79 O ATOM 2591 CB GLN D 16 15.826 2.180 41.780 1.00 35.77 C ATOM 2592 CG GLN D 16 14.895 2.651 40.674 1.00 41.22 C ATOM 2593 CD GLN D 16 13.463 2.812 41.156 1.00 42.88 C ATOM 2594 OE1 GLN D 16 13.193 3.552 42.104 1.00 45.28 O ATOM 2595 NE2 GLN D 16 12.538 2.114 40.505 1.00 45.10 N ATOM 0 H GLN D 16 14.831 4.285 42.557 1.00 32.02 H new ATOM 0 HA GLN D 16 16.834 2.965 43.419 1.00 33.82 H new ATOM 0 HB2 GLN D 16 16.494 1.594 41.392 1.00 35.77 H new ATOM 0 HB3 GLN D 16 15.313 1.649 42.409 1.00 35.77 H new ATOM 0 HG2 GLN D 16 15.214 3.498 40.325 1.00 41.22 H new ATOM 0 HG3 GLN D 16 14.918 2.015 39.942 1.00 41.22 H new ATOM 0 HE21 GLN D 16 12.765 1.608 39.848 1.00 45.10 H new ATOM 0 HE22 GLN D 16 11.713 2.169 40.741 1.00 45.10 H new ATOM 2596 N CYS D 17 17.712 4.784 41.014 1.00 29.36 N ATOM 2597 CA CYS D 17 18.868 5.238 40.244 1.00 27.49 C ATOM 2598 C CYS D 17 19.359 6.637 40.599 1.00 26.40 C ATOM 2599 O CYS D 17 20.466 7.016 40.206 1.00 27.00 O ATOM 2600 CB CYS D 17 18.548 5.220 38.744 1.00 26.51 C ATOM 2601 SG CYS D 17 18.061 3.597 38.075 1.00 27.49 S ATOM 0 H CYS D 17 17.003 5.261 40.919 1.00 29.36 H new ATOM 0 HA CYS D 17 19.576 4.616 40.472 1.00 27.49 H new ATOM 0 HB2 CYS D 17 17.833 5.852 38.573 1.00 26.51 H new ATOM 0 HB3 CYS D 17 19.326 5.534 38.258 1.00 26.51 H new ATOM 2602 N HIS D 18 18.549 7.390 41.346 1.00 25.14 N ATOM 2603 CA HIS D 18 18.871 8.779 41.699 1.00 25.32 C ATOM 2604 C HIS D 18 18.725 9.193 43.166 1.00 25.92 C ATOM 2605 O HIS D 18 17.750 8.832 43.823 1.00 25.05 O ATOM 2606 CB HIS D 18 17.958 9.734 40.909 1.00 24.30 C ATOM 2607 CG HIS D 18 18.151 9.704 39.424 1.00 23.46 C ATOM 2608 ND1 HIS D 18 19.237 10.284 38.802 1.00 23.69 N ATOM 2609 CD2 HIS D 18 17.352 9.238 38.431 1.00 20.58 C ATOM 2610 CE1 HIS D 18 19.096 10.182 37.490 1.00 25.17 C ATOM 2611 NE2 HIS D 18 17.960 9.552 37.240 1.00 23.16 N ATOM 0 H HIS D 18 17.799 7.112 41.662 1.00 25.14 H new ATOM 0 HA HIS D 18 19.816 8.836 41.486 1.00 25.32 H new ATOM 0 HB2 HIS D 18 17.034 9.515 41.107 1.00 24.30 H new ATOM 0 HB3 HIS D 18 18.109 10.639 41.224 1.00 24.30 H new ATOM 0 HD1 HIS D 18 19.901 10.654 39.204 1.00 23.69 H new ATOM 0 HD2 HIS D 18 16.544 8.790 38.537 1.00 20.58 H new ATOM 0 HE1 HIS D 18 19.694 10.499 36.852 1.00 25.17 H new ATOM 2612 N THR D 19 19.680 9.985 43.656 1.00 27.43 N ATOM 2613 CA THR D 19 19.609 10.543 45.008 1.00 29.19 C ATOM 2614 C THR D 19 19.317 12.027 44.767 1.00 29.86 C ATOM 2615 O THR D 19 19.696 12.570 43.724 1.00 30.40 O ATOM 2616 CB THR D 19 20.945 10.415 45.791 1.00 29.66 C ATOM 2617 OG1 THR D 19 21.995 11.083 45.083 1.00 28.27 O ATOM 2618 CG2 THR D 19 21.312 8.955 45.980 1.00 30.62 C ATOM 0 H THR D 19 20.383 10.213 43.217 1.00 27.43 H new ATOM 0 HA THR D 19 18.946 10.076 45.541 1.00 29.19 H new ATOM 0 HB THR D 19 20.830 10.827 46.662 1.00 29.66 H new ATOM 0 HG1 THR D 19 22.615 10.539 44.922 1.00 28.27 H new ATOM 0 HG21 THR D 19 22.147 8.892 46.470 1.00 30.62 H new ATOM 0 HG22 THR D 19 20.611 8.507 46.478 1.00 30.62 H new ATOM 0 HG23 THR D 19 21.413 8.532 45.113 1.00 30.62 H new ATOM 2619 N VAL D 20 18.637 12.685 45.701 1.00 30.60 N ATOM 2620 CA VAL D 20 18.314 14.100 45.524 1.00 31.83 C ATOM 2621 C VAL D 20 18.934 15.038 46.549 1.00 32.72 C ATOM 2622 O VAL D 20 19.003 16.238 46.316 1.00 33.44 O ATOM 2623 CB VAL D 20 16.790 14.341 45.539 1.00 30.74 C ATOM 2624 CG1 VAL D 20 16.149 13.637 44.365 1.00 31.82 C ATOM 2625 CG2 VAL D 20 16.190 13.852 46.858 1.00 28.99 C ATOM 0 H VAL D 20 18.356 12.337 46.436 1.00 30.60 H new ATOM 0 HA VAL D 20 18.700 14.310 44.659 1.00 31.83 H new ATOM 0 HB VAL D 20 16.617 15.292 45.462 1.00 30.74 H new ATOM 0 HG11 VAL D 20 15.191 13.791 44.378 1.00 31.82 H new ATOM 0 HG12 VAL D 20 16.520 13.983 43.538 1.00 31.82 H new ATOM 0 HG13 VAL D 20 16.324 12.685 44.424 1.00 31.82 H new ATOM 0 HG21 VAL D 20 15.233 14.008 46.856 1.00 28.99 H new ATOM 0 HG22 VAL D 20 16.362 12.903 46.960 1.00 28.99 H new ATOM 0 HG23 VAL D 20 16.594 14.334 47.596 1.00 28.99 H new ATOM 2626 N GLU D 21 19.384 14.488 47.673 1.00 35.73 N ATOM 2627 CA GLU D 21 19.981 15.281 48.747 1.00 37.40 C ATOM 2628 C GLU D 21 21.310 15.908 48.351 1.00 36.69 C ATOM 2629 O GLU D 21 22.034 15.373 47.512 1.00 34.16 O ATOM 2630 CB GLU D 21 20.193 14.414 49.998 1.00 40.92 C ATOM 2631 CG GLU D 21 21.163 13.246 49.796 1.00 44.61 C ATOM 2632 CD GLU D 21 20.478 11.984 49.292 1.00 47.31 C ATOM 2633 OE1 GLU D 21 19.561 12.097 48.447 1.00 47.54 O ATOM 2634 OE2 GLU D 21 20.865 10.876 49.734 1.00 46.43 O ATOM 0 H GLU D 21 19.352 13.644 47.836 1.00 35.73 H new ATOM 0 HA GLU D 21 19.357 16.000 48.934 1.00 37.40 H new ATOM 0 HB2 GLU D 21 20.524 14.976 50.716 1.00 40.92 H new ATOM 0 HB3 GLU D 21 19.335 14.063 50.285 1.00 40.92 H new ATOM 0 HG2 GLU D 21 21.851 13.509 49.164 1.00 44.61 H new ATOM 0 HG3 GLU D 21 21.608 13.053 50.636 1.00 44.61 H new ATOM 2635 N LYS D 22 21.619 17.049 48.961 1.00 36.45 N ATOM 2636 CA LYS D 22 22.867 17.753 48.694 1.00 37.28 C ATOM 2637 C LYS D 22 24.021 16.829 49.072 1.00 36.42 C ATOM 2638 O LYS D 22 24.026 16.235 50.152 1.00 36.99 O ATOM 2639 CB LYS D 22 22.923 19.043 49.518 1.00 40.77 C ATOM 2640 CG LYS D 22 24.166 19.902 49.283 1.00 41.74 C ATOM 2641 CD LYS D 22 23.979 21.283 49.913 1.00 43.15 C ATOM 2642 CE LYS D 22 25.204 22.169 49.739 1.00 43.02 C ATOM 2643 NZ LYS D 22 26.359 21.686 50.545 1.00 43.79 N ATOM 0 H LYS D 22 21.112 17.435 49.539 1.00 36.45 H new ATOM 0 HA LYS D 22 22.928 17.992 47.756 1.00 37.28 H new ATOM 0 HB2 LYS D 22 22.136 19.574 49.318 1.00 40.77 H new ATOM 0 HB3 LYS D 22 22.878 18.813 50.459 1.00 40.77 H new ATOM 0 HG2 LYS D 22 24.945 19.468 49.665 1.00 41.74 H new ATOM 0 HG3 LYS D 22 24.330 19.993 48.331 1.00 41.74 H new ATOM 0 HD2 LYS D 22 23.209 21.717 49.513 1.00 43.15 H new ATOM 0 HD3 LYS D 22 23.788 21.181 50.859 1.00 43.15 H new ATOM 0 HE2 LYS D 22 25.453 22.195 48.802 1.00 43.02 H new ATOM 0 HE3 LYS D 22 24.985 23.077 50.000 1.00 43.02 H new ATOM 0 HZ1 LYS D 22 27.042 22.250 50.454 1.00 43.79 H new ATOM 0 HZ2 LYS D 22 26.125 21.641 51.402 1.00 43.79 H new ATOM 0 HZ3 LYS D 22 26.602 20.878 50.261 1.00 43.79 H new ATOM 2644 N GLY D 23 24.997 16.705 48.183 1.00 34.58 N ATOM 2645 CA GLY D 23 26.109 15.819 48.460 1.00 35.54 C ATOM 2646 C GLY D 23 25.685 14.376 48.259 1.00 35.53 C ATOM 2647 O GLY D 23 26.441 13.449 48.546 1.00 38.38 O ATOM 0 H GLY D 23 25.033 17.117 47.429 1.00 34.58 H new ATOM 0 HA2 GLY D 23 26.854 16.030 47.875 1.00 35.54 H new ATOM 0 HA3 GLY D 23 26.417 15.950 49.370 1.00 35.54 H new ATOM 2648 N GLY D 24 24.462 14.181 47.779 1.00 33.73 N ATOM 2649 CA GLY D 24 23.980 12.835 47.534 1.00 34.46 C ATOM 2650 C GLY D 24 24.924 12.094 46.602 1.00 34.10 C ATOM 2651 O GLY D 24 25.587 12.704 45.753 1.00 33.24 O ATOM 0 H GLY D 24 23.904 14.808 47.592 1.00 33.73 H new ATOM 0 HA2 GLY D 24 23.903 12.355 48.374 1.00 34.46 H new ATOM 0 HA3 GLY D 24 23.092 12.869 47.144 1.00 34.46 H new ATOM 2652 N LYS D 25 24.992 10.777 46.754 1.00 33.26 N ATOM 2653 CA LYS D 25 25.886 9.977 45.930 1.00 33.74 C ATOM 2654 C LYS D 25 25.286 9.611 44.581 1.00 32.92 C ATOM 2655 O LYS D 25 24.068 9.628 44.395 1.00 30.64 O ATOM 2656 CB LYS D 25 26.255 8.681 46.652 1.00 35.48 C ATOM 2657 CG LYS D 25 25.102 7.697 46.746 1.00 35.08 C ATOM 2658 CD LYS D 25 25.553 6.377 47.357 1.00 40.47 C ATOM 2659 CE LYS D 25 24.410 5.371 47.401 1.00 41.21 C ATOM 2660 NZ LYS D 25 24.833 4.054 47.955 1.00 43.53 N ATOM 0 H LYS D 25 24.531 10.330 47.326 1.00 33.26 H new ATOM 0 HA LYS D 25 26.670 10.527 45.775 1.00 33.74 H new ATOM 0 HB2 LYS D 25 26.995 8.259 46.188 1.00 35.48 H new ATOM 0 HB3 LYS D 25 26.565 8.893 47.546 1.00 35.48 H new ATOM 0 HG2 LYS D 25 24.391 8.079 47.284 1.00 35.08 H new ATOM 0 HG3 LYS D 25 24.736 7.539 45.862 1.00 35.08 H new ATOM 0 HD2 LYS D 25 26.288 6.013 46.840 1.00 40.47 H new ATOM 0 HD3 LYS D 25 25.887 6.531 48.255 1.00 40.47 H new ATOM 0 HE2 LYS D 25 23.688 5.729 47.941 1.00 41.21 H new ATOM 0 HE3 LYS D 25 24.059 5.245 46.506 1.00 41.21 H new ATOM 0 HZ1 LYS D 25 24.138 3.498 47.963 1.00 43.53 H new ATOM 0 HZ2 LYS D 25 25.480 3.712 47.448 1.00 43.53 H new ATOM 0 HZ3 LYS D 25 25.134 4.164 48.785 1.00 43.53 H new ATOM 2661 N HIS D 26 26.162 9.279 43.644 1.00 32.23 N ATOM 2662 CA HIS D 26 25.733 8.849 42.327 1.00 32.60 C ATOM 2663 C HIS D 26 25.480 7.360 42.472 1.00 33.07 C ATOM 2664 O HIS D 26 26.141 6.686 43.266 1.00 34.90 O ATOM 2665 CB HIS D 26 26.839 9.070 41.296 1.00 31.10 C ATOM 2666 CG HIS D 26 27.187 10.508 41.078 1.00 30.89 C ATOM 2667 ND1 HIS D 26 26.241 11.467 40.788 1.00 32.35 N ATOM 2668 CD2 HIS D 26 28.383 11.144 41.064 1.00 32.51 C ATOM 2669 CE1 HIS D 26 26.838 12.630 40.601 1.00 31.68 C ATOM 2670 NE2 HIS D 26 28.139 12.462 40.762 1.00 31.78 N ATOM 0 H HIS D 26 27.015 9.297 43.754 1.00 32.23 H new ATOM 0 HA HIS D 26 24.954 9.343 42.026 1.00 32.60 H new ATOM 0 HB2 HIS D 26 27.634 8.594 41.581 1.00 31.10 H new ATOM 0 HB3 HIS D 26 26.563 8.682 40.451 1.00 31.10 H new ATOM 0 HD2 HIS D 26 29.214 10.760 41.228 1.00 32.51 H new ATOM 0 HE1 HIS D 26 26.415 13.431 40.392 1.00 31.68 H new ATOM 0 HE2 HIS D 26 28.736 13.077 40.690 1.00 31.78 H new ATOM 2671 N LYS D 27 24.506 6.856 41.729 1.00 32.04 N ATOM 2672 CA LYS D 27 24.175 5.438 41.742 1.00 31.29 C ATOM 2673 C LYS D 27 24.197 5.063 40.261 1.00 31.15 C ATOM 2674 O LYS D 27 25.170 5.376 39.571 1.00 29.11 O ATOM 2675 CB LYS D 27 22.789 5.224 42.366 1.00 32.50 C ATOM 2676 CG LYS D 27 22.685 5.803 43.783 1.00 33.79 C ATOM 2677 CD LYS D 27 21.284 5.691 44.365 1.00 35.30 C ATOM 2678 CE LYS D 27 20.886 4.247 44.586 1.00 35.32 C ATOM 2679 NZ LYS D 27 19.519 4.145 45.168 1.00 37.41 N ATOM 0 H LYS D 27 24.016 7.327 41.201 1.00 32.04 H new ATOM 0 HA LYS D 27 24.784 4.896 42.268 1.00 31.29 H new ATOM 0 HB2 LYS D 27 22.117 5.636 41.801 1.00 32.50 H new ATOM 0 HB3 LYS D 27 22.593 4.274 42.393 1.00 32.50 H new ATOM 0 HG2 LYS D 27 23.310 5.340 44.363 1.00 33.79 H new ATOM 0 HG3 LYS D 27 22.950 6.736 43.767 1.00 33.79 H new ATOM 0 HD2 LYS D 27 21.243 6.171 45.207 1.00 35.30 H new ATOM 0 HD3 LYS D 27 20.649 6.114 43.766 1.00 35.30 H new ATOM 0 HE2 LYS D 27 20.917 3.768 43.743 1.00 35.32 H new ATOM 0 HE3 LYS D 27 21.525 3.820 45.179 1.00 35.32 H new ATOM 0 HZ1 LYS D 27 19.264 3.292 45.180 1.00 37.41 H new ATOM 0 HZ2 LYS D 27 19.525 4.464 45.999 1.00 37.41 H new ATOM 0 HZ3 LYS D 27 18.950 4.617 44.673 1.00 37.41 H new ATOM 2680 N THR D 28 23.156 4.405 39.761 1.00 31.31 N ATOM 2681 CA THR D 28 23.140 4.077 38.341 1.00 31.83 C ATOM 2682 C THR D 28 23.049 5.416 37.610 1.00 32.01 C ATOM 2683 O THR D 28 23.646 5.599 36.553 1.00 32.61 O ATOM 2684 CB THR D 28 21.935 3.193 37.963 1.00 31.42 C ATOM 2685 OG1 THR D 28 22.086 1.896 38.558 1.00 35.01 O ATOM 2686 CG2 THR D 28 21.846 3.034 36.459 1.00 31.23 C ATOM 0 H THR D 28 22.470 4.146 40.210 1.00 31.31 H new ATOM 0 HA THR D 28 23.933 3.573 38.101 1.00 31.83 H new ATOM 0 HB THR D 28 21.126 3.618 38.288 1.00 31.42 H new ATOM 0 HG1 THR D 28 21.991 1.957 39.390 1.00 35.01 H new ATOM 0 HG21 THR D 28 21.084 2.476 36.237 1.00 31.23 H new ATOM 0 HG22 THR D 28 21.739 3.906 36.047 1.00 31.23 H new ATOM 0 HG23 THR D 28 22.658 2.618 36.129 1.00 31.23 H new ATOM 2687 N GLY D 29 22.309 6.352 38.202 1.00 30.35 N ATOM 2688 CA GLY D 29 22.160 7.676 37.621 1.00 28.81 C ATOM 2689 C GLY D 29 22.824 8.735 38.488 1.00 28.97 C ATOM 2690 O GLY D 29 23.189 8.458 39.634 1.00 27.90 O ATOM 0 H GLY D 29 21.886 6.236 38.942 1.00 30.35 H new ATOM 0 HA2 GLY D 29 22.552 7.689 36.734 1.00 28.81 H new ATOM 0 HA3 GLY D 29 21.218 7.883 37.518 1.00 28.81 H new ATOM 2691 N PRO D 30 22.982 9.968 37.980 1.00 28.49 N ATOM 2692 CA PRO D 30 23.616 11.057 38.732 1.00 28.65 C ATOM 2693 C PRO D 30 22.784 11.658 39.860 1.00 28.75 C ATOM 2694 O PRO D 30 21.551 11.608 39.834 1.00 27.37 O ATOM 2695 CB PRO D 30 23.919 12.077 37.645 1.00 29.83 C ATOM 2696 CG PRO D 30 22.735 11.919 36.735 1.00 28.26 C ATOM 2697 CD PRO D 30 22.605 10.418 36.627 1.00 28.09 C ATOM 0 HA PRO D 30 24.392 10.736 39.218 1.00 28.65 H new ATOM 0 HB2 PRO D 30 23.987 12.977 38.000 1.00 29.83 H new ATOM 0 HB3 PRO D 30 24.755 11.887 37.191 1.00 29.83 H new ATOM 0 HG2 PRO D 30 21.937 12.325 37.107 1.00 28.26 H new ATOM 0 HG3 PRO D 30 22.886 12.332 35.870 1.00 28.26 H new ATOM 0 HD2 PRO D 30 21.702 10.149 36.395 1.00 28.09 H new ATOM 0 HD3 PRO D 30 23.193 10.052 35.948 1.00 28.09 H new ATOM 2698 N ASN D 31 23.466 12.215 40.859 1.00 28.84 N ATOM 2699 CA ASN D 31 22.781 12.864 41.975 1.00 26.64 C ATOM 2700 C ASN D 31 22.054 14.048 41.350 1.00 27.08 C ATOM 2701 O ASN D 31 22.617 14.743 40.499 1.00 25.81 O ATOM 2702 CB ASN D 31 23.792 13.345 43.016 1.00 26.18 C ATOM 2703 CG ASN D 31 23.181 14.309 44.017 1.00 26.11 C ATOM 2704 OD1 ASN D 31 23.261 15.521 43.847 1.00 27.30 O ATOM 2705 ND2 ASN D 31 22.550 13.770 45.056 1.00 24.28 N ATOM 0 H ASN D 31 24.324 12.228 40.909 1.00 28.84 H new ATOM 0 HA ASN D 31 22.174 12.262 42.433 1.00 26.64 H new ATOM 0 HB2 ASN D 31 24.154 12.579 43.488 1.00 26.18 H new ATOM 0 HB3 ASN D 31 24.534 13.778 42.566 1.00 26.18 H new ATOM 0 HD21 ASN D 31 22.177 14.276 45.643 1.00 24.28 H new ATOM 0 HD22 ASN D 31 22.515 12.915 45.141 1.00 24.28 H new ATOM 2706 N LEU D 32 20.809 14.273 41.758 1.00 25.01 N ATOM 2707 CA LEU D 32 20.018 15.350 41.177 1.00 27.22 C ATOM 2708 C LEU D 32 19.977 16.672 41.937 1.00 28.79 C ATOM 2709 O LEU D 32 19.306 17.605 41.504 1.00 29.44 O ATOM 2710 CB LEU D 32 18.582 14.864 40.934 1.00 24.65 C ATOM 2711 CG LEU D 32 18.464 13.692 39.953 1.00 24.71 C ATOM 2712 CD1 LEU D 32 17.000 13.273 39.799 1.00 24.16 C ATOM 2713 CD2 LEU D 32 19.048 14.105 38.620 1.00 21.53 C ATOM 0 H LEU D 32 20.407 13.817 42.366 1.00 25.01 H new ATOM 0 HA LEU D 32 20.485 15.561 40.354 1.00 27.22 H new ATOM 0 HB2 LEU D 32 18.194 14.600 41.783 1.00 24.65 H new ATOM 0 HB3 LEU D 32 18.054 15.606 40.599 1.00 24.65 H new ATOM 0 HG LEU D 32 18.957 12.929 40.294 1.00 24.71 H new ATOM 0 HD11 LEU D 32 16.939 12.532 39.176 1.00 24.16 H new ATOM 0 HD12 LEU D 32 16.649 13.000 40.661 1.00 24.16 H new ATOM 0 HD13 LEU D 32 16.483 14.021 39.462 1.00 24.16 H new ATOM 0 HD21 LEU D 32 18.977 13.368 37.993 1.00 21.53 H new ATOM 0 HD22 LEU D 32 18.560 14.870 38.276 1.00 21.53 H new ATOM 0 HD23 LEU D 32 19.981 14.342 38.735 1.00 21.53 H new ATOM 2714 N HIS D 33 20.689 16.777 43.051 1.00 29.33 N ATOM 2715 CA HIS D 33 20.655 18.032 43.790 1.00 32.43 C ATOM 2716 C HIS D 33 21.188 19.203 42.962 1.00 31.60 C ATOM 2717 O HIS D 33 22.269 19.127 42.376 1.00 31.92 O ATOM 2718 CB HIS D 33 21.453 17.935 45.087 1.00 35.18 C ATOM 2719 CG HIS D 33 21.164 19.056 46.034 1.00 36.48 C ATOM 2720 ND1 HIS D 33 19.980 19.147 46.733 1.00 38.95 N ATOM 2721 CD2 HIS D 33 21.867 20.170 46.336 1.00 36.37 C ATOM 2722 CE1 HIS D 33 19.964 20.272 47.423 1.00 37.41 C ATOM 2723 NE2 HIS D 33 21.098 20.911 47.199 1.00 38.41 N ATOM 0 H HIS D 33 21.182 16.158 43.388 1.00 29.33 H new ATOM 0 HA HIS D 33 19.722 18.199 43.997 1.00 32.43 H new ATOM 0 HB2 HIS D 33 21.253 17.091 45.522 1.00 35.18 H new ATOM 0 HB3 HIS D 33 22.400 17.930 44.879 1.00 35.18 H new ATOM 0 HD1 HIS D 33 19.350 18.562 46.721 1.00 38.95 H new ATOM 0 HD2 HIS D 33 22.712 20.393 46.019 1.00 36.37 H new ATOM 0 HE1 HIS D 33 19.273 20.564 47.972 1.00 37.41 H new ATOM 2724 N GLY D 34 20.418 20.286 42.920 1.00 32.68 N ATOM 2725 CA GLY D 34 20.818 21.460 42.160 1.00 31.41 C ATOM 2726 C GLY D 34 20.401 21.387 40.701 1.00 30.09 C ATOM 2727 O GLY D 34 20.791 22.224 39.893 1.00 27.30 O ATOM 0 H GLY D 34 19.662 20.359 43.324 1.00 32.68 H new ATOM 0 HA2 GLY D 34 20.428 22.250 42.564 1.00 31.41 H new ATOM 0 HA3 GLY D 34 21.781 21.561 42.212 1.00 31.41 H new ATOM 2728 N LEU D 35 19.596 20.385 40.371 1.00 31.14 N ATOM 2729 CA LEU D 35 19.124 20.171 39.004 1.00 31.03 C ATOM 2730 C LEU D 35 18.609 21.431 38.294 1.00 30.21 C ATOM 2731 O LEU D 35 19.117 21.808 37.242 1.00 27.45 O ATOM 2732 CB LEU D 35 18.023 19.096 39.000 1.00 31.46 C ATOM 2733 CG LEU D 35 17.507 18.595 37.638 1.00 31.70 C ATOM 2734 CD1 LEU D 35 18.637 17.920 36.858 1.00 29.74 C ATOM 2735 CD2 LEU D 35 16.366 17.614 37.858 1.00 28.84 C ATOM 0 H LEU D 35 19.305 19.805 40.936 1.00 31.14 H new ATOM 0 HA LEU D 35 19.902 19.884 38.502 1.00 31.03 H new ATOM 0 HB2 LEU D 35 18.355 18.329 39.493 1.00 31.46 H new ATOM 0 HB3 LEU D 35 17.265 19.445 39.495 1.00 31.46 H new ATOM 0 HG LEU D 35 17.186 19.351 37.122 1.00 31.70 H new ATOM 0 HD11 LEU D 35 18.300 17.609 36.003 1.00 29.74 H new ATOM 0 HD12 LEU D 35 19.354 18.557 36.710 1.00 29.74 H new ATOM 0 HD13 LEU D 35 18.975 17.166 37.365 1.00 29.74 H new ATOM 0 HD21 LEU D 35 16.041 17.298 37.001 1.00 28.84 H new ATOM 0 HD22 LEU D 35 16.683 16.861 38.381 1.00 28.84 H new ATOM 0 HD23 LEU D 35 15.646 18.057 38.334 1.00 28.84 H new ATOM 2736 N PHE D 36 17.601 22.074 38.873 1.00 30.66 N ATOM 2737 CA PHE D 36 17.009 23.265 38.270 1.00 30.55 C ATOM 2738 C PHE D 36 17.965 24.423 38.047 1.00 30.68 C ATOM 2739 O PHE D 36 18.613 24.892 38.982 1.00 30.69 O ATOM 2740 CB PHE D 36 15.819 23.741 39.107 1.00 29.77 C ATOM 2741 CG PHE D 36 14.658 22.793 39.091 1.00 32.31 C ATOM 2742 CD1 PHE D 36 14.724 21.583 39.773 1.00 30.86 C ATOM 2743 CD2 PHE D 36 13.512 23.089 38.359 1.00 30.38 C ATOM 2744 CE1 PHE D 36 13.666 20.681 39.724 1.00 30.19 C ATOM 2745 CE2 PHE D 36 12.451 22.193 38.305 1.00 30.23 C ATOM 2746 CZ PHE D 36 12.527 20.989 38.987 1.00 30.85 C ATOM 0 H PHE D 36 17.243 21.837 39.618 1.00 30.66 H new ATOM 0 HA PHE D 36 16.728 22.984 37.385 1.00 30.55 H new ATOM 0 HB2 PHE D 36 16.109 23.870 40.024 1.00 29.77 H new ATOM 0 HB3 PHE D 36 15.526 24.605 38.777 1.00 29.77 H new ATOM 0 HD1 PHE D 36 15.484 21.374 40.267 1.00 30.86 H new ATOM 0 HD2 PHE D 36 13.455 23.896 37.900 1.00 30.38 H new ATOM 0 HE1 PHE D 36 13.720 19.874 40.183 1.00 30.19 H new ATOM 0 HE2 PHE D 36 11.691 22.401 37.812 1.00 30.23 H new ATOM 0 HZ PHE D 36 11.818 20.388 38.952 1.00 30.85 H new ATOM 2747 N GLY D 37 18.045 24.874 36.796 1.00 28.49 N ATOM 2748 CA GLY D 37 18.909 25.983 36.448 1.00 27.78 C ATOM 2749 C GLY D 37 20.259 25.547 35.912 1.00 29.27 C ATOM 2750 O GLY D 37 21.019 26.362 35.389 1.00 27.69 O ATOM 0 H GLY D 37 17.602 24.545 36.136 1.00 28.49 H new ATOM 0 HA2 GLY D 37 18.466 26.533 35.783 1.00 27.78 H new ATOM 0 HA3 GLY D 37 19.043 26.538 37.232 1.00 27.78 H new ATOM 2751 N ARG D 38 20.548 24.255 36.039 1.00 29.41 N ATOM 2752 CA ARG D 38 21.812 23.681 35.581 1.00 29.07 C ATOM 2753 C ARG D 38 21.667 23.057 34.188 1.00 27.52 C ATOM 2754 O ARG D 38 20.605 22.550 33.830 1.00 24.98 O ATOM 2755 CB ARG D 38 22.272 22.620 36.591 1.00 31.72 C ATOM 2756 CG ARG D 38 23.630 21.997 36.311 1.00 34.42 C ATOM 2757 CD ARG D 38 24.131 21.223 37.533 1.00 35.12 C ATOM 2758 NE ARG D 38 23.381 19.991 37.790 1.00 36.90 N ATOM 2759 CZ ARG D 38 23.315 19.395 38.979 1.00 39.88 C ATOM 2760 NH1 ARG D 38 22.618 18.273 39.136 1.00 39.86 N ATOM 2761 NH2 ARG D 38 23.936 19.933 40.024 1.00 39.63 N ATOM 0 H ARG D 38 20.014 23.683 36.395 1.00 29.41 H new ATOM 0 HA ARG D 38 22.473 24.388 35.518 1.00 29.07 H new ATOM 0 HB2 ARG D 38 22.294 23.023 37.473 1.00 31.72 H new ATOM 0 HB3 ARG D 38 21.609 21.913 36.619 1.00 31.72 H new ATOM 0 HG2 ARG D 38 23.567 21.401 35.548 1.00 34.42 H new ATOM 0 HG3 ARG D 38 24.267 22.690 36.077 1.00 34.42 H new ATOM 0 HD2 ARG D 38 25.067 21.003 37.407 1.00 35.12 H new ATOM 0 HD3 ARG D 38 24.077 21.795 38.314 1.00 35.12 H new ATOM 0 HE ARG D 38 22.958 19.631 37.133 1.00 36.90 H new ATOM 0 HH11 ARG D 38 22.205 17.926 38.466 1.00 39.86 H new ATOM 0 HH12 ARG D 38 22.581 17.894 39.907 1.00 39.86 H new ATOM 0 HH21 ARG D 38 24.379 20.664 39.931 1.00 39.63 H new ATOM 0 HH22 ARG D 38 23.895 19.550 40.793 1.00 39.63 H new ATOM 2762 N LYS D 39 22.730 23.100 33.396 1.00 26.23 N ATOM 2763 CA LYS D 39 22.654 22.512 32.071 1.00 26.72 C ATOM 2764 C LYS D 39 22.707 20.998 32.175 1.00 26.41 C ATOM 2765 O LYS D 39 23.167 20.450 33.179 1.00 23.31 O ATOM 2766 CB LYS D 39 23.797 22.998 31.184 1.00 26.93 C ATOM 2767 CG LYS D 39 23.662 24.439 30.749 1.00 32.02 C ATOM 2768 CD LYS D 39 24.693 24.784 29.697 1.00 33.32 C ATOM 2769 CE LYS D 39 24.217 24.429 28.289 1.00 35.71 C ATOM 2770 NZ LYS D 39 23.152 25.346 27.795 1.00 34.12 N ATOM 0 H LYS D 39 23.486 23.456 33.601 1.00 26.23 H new ATOM 0 HA LYS D 39 21.815 22.787 31.669 1.00 26.72 H new ATOM 0 HB2 LYS D 39 24.634 22.890 31.662 1.00 26.93 H new ATOM 0 HB3 LYS D 39 23.846 22.434 30.396 1.00 26.93 H new ATOM 0 HG2 LYS D 39 22.771 24.592 30.397 1.00 32.02 H new ATOM 0 HG3 LYS D 39 23.769 25.024 31.516 1.00 32.02 H new ATOM 0 HD2 LYS D 39 24.893 25.732 29.740 1.00 33.32 H new ATOM 0 HD3 LYS D 39 25.518 24.311 29.887 1.00 33.32 H new ATOM 0 HE2 LYS D 39 24.971 24.457 27.680 1.00 35.71 H new ATOM 0 HE3 LYS D 39 23.883 23.518 28.284 1.00 35.71 H new ATOM 0 HZ1 LYS D 39 22.917 25.111 26.969 1.00 34.12 H new ATOM 0 HZ2 LYS D 39 22.443 25.294 28.331 1.00 34.12 H new ATOM 0 HZ3 LYS D 39 23.459 26.182 27.789 1.00 34.12 H new ATOM 2771 N THR D 40 22.224 20.334 31.128 1.00 26.48 N ATOM 2772 CA THR D 40 22.216 18.876 31.053 1.00 25.55 C ATOM 2773 C THR D 40 23.621 18.297 31.148 1.00 24.51 C ATOM 2774 O THR D 40 24.573 18.870 30.619 1.00 22.61 O ATOM 2775 CB THR D 40 21.628 18.406 29.719 1.00 25.06 C ATOM 2776 OG1 THR D 40 22.156 19.225 28.667 1.00 26.98 O ATOM 2777 CG2 THR D 40 20.118 18.507 29.728 1.00 26.29 C ATOM 0 H THR D 40 21.889 20.720 30.436 1.00 26.48 H new ATOM 0 HA THR D 40 21.679 18.569 31.800 1.00 25.55 H new ATOM 0 HB THR D 40 21.870 17.477 29.578 1.00 25.06 H new ATOM 0 HG1 THR D 40 22.933 19.473 28.868 1.00 26.98 H new ATOM 0 HG21 THR D 40 19.768 18.205 28.875 1.00 26.29 H new ATOM 0 HG22 THR D 40 19.761 17.952 30.439 1.00 26.29 H new ATOM 0 HG23 THR D 40 19.856 19.429 29.876 1.00 26.29 H new ATOM 2778 N GLY D 41 23.731 17.153 31.820 1.00 27.84 N ATOM 2779 CA GLY D 41 25.006 16.470 31.963 1.00 29.45 C ATOM 2780 C GLY D 41 26.100 17.229 32.691 1.00 32.44 C ATOM 2781 O GLY D 41 27.243 17.241 32.234 1.00 33.61 O ATOM 0 H GLY D 41 23.071 16.756 32.202 1.00 27.84 H new ATOM 0 HA2 GLY D 41 24.852 15.634 32.431 1.00 29.45 H new ATOM 0 HA3 GLY D 41 25.331 16.244 31.077 1.00 29.45 H new ATOM 2782 N GLN D 42 25.777 17.855 33.819 1.00 33.50 N ATOM 2783 CA GLN D 42 26.787 18.605 34.556 1.00 36.54 C ATOM 2784 C GLN D 42 26.977 18.201 36.017 1.00 37.60 C ATOM 2785 O GLN D 42 27.801 18.791 36.710 1.00 40.54 O ATOM 2786 CB GLN D 42 26.488 20.102 34.482 1.00 38.57 C ATOM 2787 CG GLN D 42 27.583 20.915 33.809 1.00 41.93 C ATOM 2788 CD GLN D 42 27.875 20.442 32.398 1.00 43.36 C ATOM 2789 OE1 GLN D 42 26.967 20.302 31.578 1.00 47.20 O ATOM 2790 NE2 GLN D 42 29.145 20.198 32.106 1.00 42.32 N ATOM 0 H GLN D 42 24.992 17.858 34.170 1.00 33.50 H new ATOM 0 HA GLN D 42 27.623 18.385 34.116 1.00 36.54 H new ATOM 0 HB2 GLN D 42 25.657 20.234 34.000 1.00 38.57 H new ATOM 0 HB3 GLN D 42 26.351 20.441 35.381 1.00 38.57 H new ATOM 0 HG2 GLN D 42 27.321 21.849 33.786 1.00 41.93 H new ATOM 0 HG3 GLN D 42 28.394 20.861 34.339 1.00 41.93 H new ATOM 0 HE21 GLN D 42 29.753 20.307 32.705 1.00 42.32 H new ATOM 0 HE22 GLN D 42 29.361 19.931 31.318 1.00 42.32 H new ATOM 2791 N ALA D 43 26.227 17.211 36.497 1.00 36.81 N ATOM 2792 CA ALA D 43 26.389 16.766 37.880 1.00 36.46 C ATOM 2793 C ALA D 43 27.852 16.374 38.068 1.00 37.44 C ATOM 2794 O ALA D 43 28.386 15.547 37.330 1.00 37.55 O ATOM 2795 CB ALA D 43 25.483 15.571 38.173 1.00 35.13 C ATOM 0 H ALA D 43 25.628 16.789 36.047 1.00 36.81 H new ATOM 0 HA ALA D 43 26.142 17.477 38.491 1.00 36.46 H new ATOM 0 HB1 ALA D 43 25.604 15.291 39.094 1.00 35.13 H new ATOM 0 HB2 ALA D 43 24.557 15.824 38.032 1.00 35.13 H new ATOM 0 HB3 ALA D 43 25.711 14.838 37.580 1.00 35.13 H new ATOM 2796 N PRO D 44 28.525 16.970 39.058 1.00 38.41 N ATOM 2797 CA PRO D 44 29.936 16.651 39.301 1.00 37.78 C ATOM 2798 C PRO D 44 30.228 15.207 39.716 1.00 36.21 C ATOM 2799 O PRO D 44 29.635 14.684 40.662 1.00 34.84 O ATOM 2800 CB PRO D 44 30.331 17.652 40.388 1.00 39.20 C ATOM 2801 CG PRO D 44 29.041 17.852 41.145 1.00 41.39 C ATOM 2802 CD PRO D 44 28.036 17.975 40.020 1.00 38.45 C ATOM 0 HA PRO D 44 30.451 16.723 38.482 1.00 37.78 H new ATOM 0 HB2 PRO D 44 31.033 17.304 40.960 1.00 39.20 H new ATOM 0 HB3 PRO D 44 30.659 18.483 40.010 1.00 39.20 H new ATOM 0 HG2 PRO D 44 28.843 17.104 41.730 1.00 41.39 H new ATOM 0 HG3 PRO D 44 29.065 18.647 41.700 1.00 41.39 H new ATOM 0 HD2 PRO D 44 27.133 17.783 40.318 1.00 38.45 H new ATOM 0 HD3 PRO D 44 28.025 18.867 39.639 1.00 38.45 H new ATOM 2803 N GLY D 45 31.151 14.570 39.002 1.00 34.73 N ATOM 2804 CA GLY D 45 31.527 13.205 39.338 1.00 35.10 C ATOM 2805 C GLY D 45 30.790 12.093 38.613 1.00 33.15 C ATOM 2806 O GLY D 45 30.947 10.921 38.947 1.00 32.60 O ATOM 0 H GLY D 45 31.566 14.906 38.328 1.00 34.73 H new ATOM 0 HA2 GLY D 45 32.476 13.102 39.165 1.00 35.10 H new ATOM 0 HA3 GLY D 45 31.398 13.082 40.291 1.00 35.10 H new ATOM 2807 N PHE D 46 29.990 12.449 37.617 1.00 32.17 N ATOM 2808 CA PHE D 46 29.251 11.446 36.868 1.00 29.46 C ATOM 2809 C PHE D 46 29.623 11.491 35.391 1.00 30.26 C ATOM 2810 O PHE D 46 29.758 12.569 34.801 1.00 28.67 O ATOM 2811 CB PHE D 46 27.746 11.674 37.022 1.00 28.18 C ATOM 2812 CG PHE D 46 26.907 10.552 36.483 1.00 25.70 C ATOM 2813 CD1 PHE D 46 26.608 9.446 37.277 1.00 26.58 C ATOM 2814 CD2 PHE D 46 26.436 10.586 35.175 1.00 25.55 C ATOM 2815 CE1 PHE D 46 25.853 8.390 36.779 1.00 22.50 C ATOM 2816 CE2 PHE D 46 25.679 9.532 34.665 1.00 25.12 C ATOM 2817 CZ PHE D 46 25.388 8.431 35.471 1.00 24.02 C ATOM 0 H PHE D 46 29.862 13.260 37.361 1.00 32.17 H new ATOM 0 HA PHE D 46 29.483 10.574 37.223 1.00 29.46 H new ATOM 0 HB2 PHE D 46 27.540 11.798 37.962 1.00 28.18 H new ATOM 0 HB3 PHE D 46 27.503 12.496 36.567 1.00 28.18 H new ATOM 0 HD1 PHE D 46 26.918 9.414 38.153 1.00 26.58 H new ATOM 0 HD2 PHE D 46 26.628 11.319 34.635 1.00 25.55 H new ATOM 0 HE1 PHE D 46 25.660 7.659 37.320 1.00 22.50 H new ATOM 0 HE2 PHE D 46 25.369 9.563 33.789 1.00 25.12 H new ATOM 0 HZ PHE D 46 24.884 7.726 35.133 1.00 24.02 H new ATOM 2818 N THR D 47 29.787 10.314 34.798 1.00 28.93 N ATOM 2819 CA THR D 47 30.125 10.215 33.388 1.00 30.47 C ATOM 2820 C THR D 47 28.848 9.962 32.604 1.00 29.17 C ATOM 2821 O THR D 47 28.236 8.898 32.714 1.00 29.83 O ATOM 2822 CB THR D 47 31.105 9.068 33.127 1.00 30.72 C ATOM 2823 OG1 THR D 47 32.311 9.303 33.865 1.00 35.17 O ATOM 2824 CG2 THR D 47 31.434 8.987 31.638 1.00 32.90 C ATOM 0 H THR D 47 29.706 9.558 35.199 1.00 28.93 H new ATOM 0 HA THR D 47 30.548 11.043 33.111 1.00 30.47 H new ATOM 0 HB THR D 47 30.700 8.233 33.408 1.00 30.72 H new ATOM 0 HG1 THR D 47 32.852 8.675 33.726 1.00 35.17 H new ATOM 0 HG21 THR D 47 32.055 8.258 31.483 1.00 32.90 H new ATOM 0 HG22 THR D 47 30.620 8.830 31.135 1.00 32.90 H new ATOM 0 HG23 THR D 47 31.837 9.821 31.350 1.00 32.90 H new ATOM 2825 N TYR D 48 28.461 10.950 31.808 1.00 28.12 N ATOM 2826 CA TYR D 48 27.242 10.887 31.015 1.00 29.11 C ATOM 2827 C TYR D 48 27.489 10.323 29.619 1.00 30.47 C ATOM 2828 O TYR D 48 28.630 10.200 29.170 1.00 30.96 O ATOM 2829 CB TYR D 48 26.659 12.295 30.856 1.00 28.52 C ATOM 2830 CG TYR D 48 26.150 12.952 32.118 1.00 27.68 C ATOM 2831 CD1 TYR D 48 24.788 12.962 32.414 1.00 29.00 C ATOM 2832 CD2 TYR D 48 27.018 13.603 32.997 1.00 27.69 C ATOM 2833 CE1 TYR D 48 24.296 13.608 33.546 1.00 27.05 C ATOM 2834 CE2 TYR D 48 26.533 14.257 34.139 1.00 27.44 C ATOM 2835 CZ TYR D 48 25.167 14.255 34.401 1.00 27.67 C ATOM 2836 OH TYR D 48 24.657 14.926 35.491 1.00 27.65 O ATOM 0 H TYR D 48 28.902 11.682 31.712 1.00 28.12 H new ATOM 0 HA TYR D 48 26.629 10.300 31.485 1.00 29.11 H new ATOM 0 HB2 TYR D 48 27.341 12.866 30.469 1.00 28.52 H new ATOM 0 HB3 TYR D 48 25.929 12.253 30.218 1.00 28.52 H new ATOM 0 HD1 TYR D 48 24.195 12.528 31.844 1.00 29.00 H new ATOM 0 HD2 TYR D 48 27.931 13.603 32.823 1.00 27.69 H new ATOM 0 HE1 TYR D 48 23.384 13.604 33.726 1.00 27.05 H new ATOM 0 HE2 TYR D 48 27.120 14.689 34.717 1.00 27.44 H new ATOM 0 HH TYR D 48 24.005 15.398 35.250 1.00 27.65 H new ATOM 2837 N THR D 49 26.407 9.971 28.938 1.00 29.86 N ATOM 2838 CA THR D 49 26.525 9.495 27.572 1.00 29.88 C ATOM 2839 C THR D 49 26.861 10.798 26.865 1.00 30.11 C ATOM 2840 O THR D 49 26.607 11.875 27.413 1.00 28.51 O ATOM 2841 CB THR D 49 25.182 8.985 27.024 1.00 29.04 C ATOM 2842 OG1 THR D 49 24.188 10.008 27.175 1.00 26.75 O ATOM 2843 CG2 THR D 49 24.741 7.730 27.754 1.00 30.61 C ATOM 0 H THR D 49 25.604 10.000 29.246 1.00 29.86 H new ATOM 0 HA THR D 49 27.154 8.764 27.469 1.00 29.88 H new ATOM 0 HB THR D 49 25.292 8.768 26.085 1.00 29.04 H new ATOM 0 HG1 THR D 49 23.711 9.839 27.846 1.00 26.75 H new ATOM 0 HG21 THR D 49 23.893 7.426 27.393 1.00 30.61 H new ATOM 0 HG22 THR D 49 25.409 7.036 27.638 1.00 30.61 H new ATOM 0 HG23 THR D 49 24.638 7.924 28.699 1.00 30.61 H new ATOM 2844 N ASP D 50 27.439 10.725 25.675 1.00 30.15 N ATOM 2845 CA ASP D 50 27.757 11.950 24.954 1.00 30.25 C ATOM 2846 C ASP D 50 26.462 12.719 24.687 1.00 28.78 C ATOM 2847 O ASP D 50 26.448 13.948 24.680 1.00 28.83 O ATOM 2848 CB ASP D 50 28.462 11.632 23.633 1.00 32.13 C ATOM 2849 CG ASP D 50 29.930 11.281 23.824 1.00 36.47 C ATOM 2850 OD1 ASP D 50 30.597 10.947 22.822 1.00 38.45 O ATOM 2851 OD2 ASP D 50 30.418 11.341 24.973 1.00 35.83 O ATOM 0 H ASP D 50 27.652 9.995 25.274 1.00 30.15 H new ATOM 0 HA ASP D 50 28.356 12.491 25.492 1.00 30.25 H new ATOM 0 HB2 ASP D 50 28.010 10.892 23.199 1.00 32.13 H new ATOM 0 HB3 ASP D 50 28.390 12.396 23.040 1.00 32.13 H new ATOM 2852 N ALA D 51 25.376 11.981 24.480 1.00 26.66 N ATOM 2853 CA ALA D 51 24.070 12.577 24.217 1.00 25.64 C ATOM 2854 C ALA D 51 23.593 13.462 25.369 1.00 24.40 C ATOM 2855 O ALA D 51 23.283 14.629 25.171 1.00 25.63 O ATOM 2856 CB ALA D 51 23.041 11.478 23.942 1.00 23.53 C ATOM 0 H ALA D 51 25.375 11.121 24.488 1.00 26.66 H new ATOM 0 HA ALA D 51 24.163 13.144 23.436 1.00 25.64 H new ATOM 0 HB1 ALA D 51 22.176 11.881 23.768 1.00 23.53 H new ATOM 0 HB2 ALA D 51 23.318 10.961 23.169 1.00 23.53 H new ATOM 0 HB3 ALA D 51 22.976 10.895 24.714 1.00 23.53 H new ATOM 2857 N ASN D 52 23.528 12.900 26.568 1.00 26.09 N ATOM 2858 CA ASN D 52 23.077 13.643 27.741 1.00 25.83 C ATOM 2859 C ASN D 52 24.064 14.763 28.060 1.00 26.53 C ATOM 2860 O ASN D 52 23.667 15.867 28.432 1.00 23.85 O ATOM 2861 CB ASN D 52 22.947 12.680 28.930 1.00 26.45 C ATOM 2862 CG ASN D 52 22.146 13.261 30.095 1.00 29.13 C ATOM 2863 OD1 ASN D 52 21.603 12.512 30.916 1.00 29.24 O ATOM 2864 ND2 ASN D 52 22.076 14.588 30.181 1.00 28.20 N ATOM 0 H ASN D 52 23.742 12.082 26.727 1.00 26.09 H new ATOM 0 HA ASN D 52 22.212 14.043 27.562 1.00 25.83 H new ATOM 0 HB2 ASN D 52 22.522 11.861 28.630 1.00 26.45 H new ATOM 0 HB3 ASN D 52 23.834 12.441 29.243 1.00 26.45 H new ATOM 0 HD21 ASN D 52 21.641 14.955 30.826 1.00 28.20 H new ATOM 0 HD22 ASN D 52 22.466 15.078 29.592 1.00 28.20 H new ATOM 2865 N LYS D 53 25.352 14.478 27.887 1.00 27.29 N ATOM 2866 CA LYS D 53 26.400 15.452 28.168 1.00 27.88 C ATOM 2867 C LYS D 53 26.308 16.668 27.246 1.00 28.03 C ATOM 2868 O LYS D 53 26.510 17.802 27.676 1.00 28.60 O ATOM 2869 CB LYS D 53 27.782 14.788 28.035 0.50 27.38 C ATOM 2870 CG LYS D 53 28.913 15.518 28.765 0.50 26.77 C ATOM 2871 CD LYS D 53 30.249 14.775 28.651 0.50 26.89 C ATOM 2872 CE LYS D 53 30.239 13.410 29.360 0.50 26.04 C ATOM 2873 NZ LYS D 53 30.141 13.479 30.859 0.50 23.85 N ATOM 0 H LYS D 53 25.641 13.719 27.605 1.00 27.29 H new ATOM 0 HA LYS D 53 26.277 15.766 29.078 1.00 27.88 H new ATOM 0 HB2 LYS D 53 27.726 13.881 28.375 0.50 27.38 H new ATOM 0 HB3 LYS D 53 28.008 14.725 27.094 0.50 27.38 H new ATOM 0 HG2 LYS D 53 29.009 16.411 28.399 0.50 26.77 H new ATOM 0 HG3 LYS D 53 28.680 15.619 29.701 0.50 26.77 H new ATOM 0 HD2 LYS D 53 30.463 14.646 27.714 0.50 26.89 H new ATOM 0 HD3 LYS D 53 30.953 15.325 29.029 0.50 26.89 H new ATOM 0 HE2 LYS D 53 29.492 12.890 29.023 0.50 26.04 H new ATOM 0 HE3 LYS D 53 31.048 12.931 29.123 0.50 26.04 H new ATOM 0 HZ1 LYS D 53 30.480 12.736 31.213 0.50 23.85 H new ATOM 0 HZ2 LYS D 53 30.598 14.183 31.154 0.50 23.85 H new ATOM 0 HZ3 LYS D 53 29.287 13.558 31.098 0.50 23.85 H new ATOM 2874 N ASN D 54 25.979 16.438 25.981 1.00 29.36 N ATOM 2875 CA ASN D 54 25.893 17.532 25.020 1.00 27.30 C ATOM 2876 C ASN D 54 24.496 17.961 24.568 1.00 25.52 C ATOM 2877 O ASN D 54 24.371 18.659 23.569 1.00 24.56 O ATOM 2878 CB ASN D 54 26.729 17.188 23.790 1.00 29.88 C ATOM 2879 CG ASN D 54 28.201 17.057 24.117 1.00 32.19 C ATOM 2880 OD1 ASN D 54 28.758 17.896 24.817 1.00 34.94 O ATOM 2881 ND2 ASN D 54 28.839 16.009 23.610 1.00 32.15 N ATOM 0 H ASN D 54 25.802 15.660 25.659 1.00 29.36 H new ATOM 0 HA ASN D 54 26.231 18.299 25.508 1.00 27.30 H new ATOM 0 HB2 ASN D 54 26.409 16.356 23.406 1.00 29.88 H new ATOM 0 HB3 ASN D 54 26.609 17.876 23.117 1.00 29.88 H new ATOM 0 HD21 ASN D 54 29.677 15.898 23.768 1.00 32.15 H new ATOM 0 HD22 ASN D 54 28.414 15.441 23.123 1.00 32.15 H new ATOM 2882 N LYS D 55 23.449 17.561 25.283 1.00 25.25 N ATOM 2883 CA LYS D 55 22.094 17.954 24.873 1.00 25.68 C ATOM 2884 C LYS D 55 22.032 19.479 24.755 1.00 26.87 C ATOM 2885 O LYS D 55 21.357 20.027 23.881 1.00 25.78 O ATOM 2886 CB LYS D 55 21.054 17.448 25.879 1.00 25.61 C ATOM 2887 CG LYS D 55 19.642 17.958 25.625 1.00 24.85 C ATOM 2888 CD LYS D 55 19.125 17.540 24.250 1.00 26.88 C ATOM 2889 CE LYS D 55 17.742 18.119 23.986 1.00 24.24 C ATOM 2890 NZ LYS D 55 17.188 17.665 22.675 1.00 26.44 N ATOM 0 H LYS D 55 23.493 17.075 25.991 1.00 25.25 H new ATOM 0 HA LYS D 55 21.890 17.555 24.013 1.00 25.68 H new ATOM 0 HB2 LYS D 55 21.045 16.478 25.860 1.00 25.61 H new ATOM 0 HB3 LYS D 55 21.327 17.712 26.772 1.00 25.61 H new ATOM 0 HG2 LYS D 55 19.047 17.617 26.311 1.00 24.85 H new ATOM 0 HG3 LYS D 55 19.630 18.925 25.694 1.00 24.85 H new ATOM 0 HD2 LYS D 55 19.741 17.841 23.564 1.00 26.88 H new ATOM 0 HD3 LYS D 55 19.090 16.572 24.195 1.00 26.88 H new ATOM 0 HE2 LYS D 55 17.140 17.856 24.700 1.00 24.24 H new ATOM 0 HE3 LYS D 55 17.790 19.088 23.998 1.00 24.24 H new ATOM 0 HZ1 LYS D 55 16.505 18.187 22.444 1.00 26.44 H new ATOM 0 HZ2 LYS D 55 17.822 17.714 22.052 1.00 26.44 H new ATOM 0 HZ3 LYS D 55 16.907 16.824 22.747 1.00 26.44 H new ATOM 2891 N GLY D 56 22.737 20.152 25.656 1.00 26.07 N ATOM 2892 CA GLY D 56 22.811 21.599 25.622 1.00 28.16 C ATOM 2893 C GLY D 56 21.619 22.425 26.060 1.00 28.08 C ATOM 2894 O GLY D 56 21.441 23.527 25.561 1.00 28.39 O ATOM 0 H GLY D 56 23.180 19.785 26.296 1.00 26.07 H new ATOM 0 HA2 GLY D 56 23.564 21.863 26.173 1.00 28.16 H new ATOM 0 HA3 GLY D 56 23.022 21.856 24.711 1.00 28.16 H new ATOM 2895 N ILE D 57 20.805 21.916 26.977 1.00 28.15 N ATOM 2896 CA ILE D 57 19.662 22.685 27.451 1.00 28.19 C ATOM 2897 C ILE D 57 19.697 22.809 28.967 1.00 28.90 C ATOM 2898 O ILE D 57 20.380 22.045 29.650 1.00 29.94 O ATOM 2899 CB ILE D 57 18.319 22.050 27.005 1.00 27.93 C ATOM 2900 CG1 ILE D 57 18.197 20.618 27.532 1.00 25.88 C ATOM 2901 CG2 ILE D 57 18.212 22.077 25.491 1.00 26.74 C ATOM 2902 CD1 ILE D 57 17.600 20.528 28.914 1.00 25.60 C ATOM 0 H ILE D 57 20.894 21.138 27.333 1.00 28.15 H new ATOM 0 HA ILE D 57 19.722 23.568 27.055 1.00 28.19 H new ATOM 0 HB ILE D 57 17.589 22.569 27.378 1.00 27.93 H new ATOM 0 HG12 ILE D 57 17.651 20.102 26.919 1.00 25.88 H new ATOM 0 HG13 ILE D 57 19.077 20.209 27.541 1.00 25.88 H new ATOM 0 HG21 ILE D 57 17.370 21.679 25.219 1.00 26.74 H new ATOM 0 HG22 ILE D 57 18.250 22.995 25.180 1.00 26.74 H new ATOM 0 HG23 ILE D 57 18.947 21.575 25.105 1.00 26.74 H new ATOM 0 HD11 ILE D 57 17.552 19.598 29.186 1.00 25.60 H new ATOM 0 HD12 ILE D 57 18.156 21.019 29.539 1.00 25.60 H new ATOM 0 HD13 ILE D 57 16.708 20.909 28.907 1.00 25.60 H new ATOM 2903 N THR D 58 18.961 23.780 29.490 1.00 28.60 N ATOM 2904 CA THR D 58 18.908 24.014 30.925 1.00 26.89 C ATOM 2905 C THR D 58 17.704 23.309 31.535 1.00 26.28 C ATOM 2906 O THR D 58 16.595 23.404 31.010 1.00 24.33 O ATOM 2907 CB THR D 58 18.786 25.520 31.219 1.00 29.32 C ATOM 2908 OG1 THR D 58 19.913 26.206 30.659 1.00 32.31 O ATOM 2909 CG2 THR D 58 18.719 25.774 32.724 1.00 30.33 C ATOM 0 H THR D 58 18.480 24.320 29.025 1.00 28.60 H new ATOM 0 HA THR D 58 19.726 23.666 31.313 1.00 26.89 H new ATOM 0 HB THR D 58 17.968 25.852 30.817 1.00 29.32 H new ATOM 0 HG1 THR D 58 19.813 26.279 29.828 1.00 32.31 H new ATOM 0 HG21 THR D 58 18.643 26.727 32.888 1.00 30.33 H new ATOM 0 HG22 THR D 58 17.947 25.319 33.095 1.00 30.33 H new ATOM 0 HG23 THR D 58 19.525 25.437 33.145 1.00 30.33 H new ATOM 2910 N TRP D 59 17.918 22.592 32.635 1.00 24.52 N ATOM 2911 CA TRP D 59 16.810 21.917 33.287 1.00 25.59 C ATOM 2912 C TRP D 59 15.929 22.917 34.034 1.00 25.32 C ATOM 2913 O TRP D 59 16.413 23.751 34.796 1.00 25.57 O ATOM 2914 CB TRP D 59 17.300 20.843 34.270 1.00 24.16 C ATOM 2915 CG TRP D 59 17.836 19.607 33.599 1.00 25.59 C ATOM 2916 CD1 TRP D 59 19.072 19.058 33.765 1.00 24.53 C ATOM 2917 CD2 TRP D 59 17.154 18.783 32.643 1.00 25.86 C ATOM 2918 NE1 TRP D 59 19.209 17.942 32.971 1.00 27.75 N ATOM 2919 CE2 TRP D 59 18.046 17.750 32.270 1.00 27.18 C ATOM 2920 CE3 TRP D 59 15.878 18.817 32.062 1.00 26.55 C ATOM 2921 CZ2 TRP D 59 17.703 16.757 31.339 1.00 25.81 C ATOM 2922 CZ3 TRP D 59 15.536 17.832 31.135 1.00 26.66 C ATOM 2923 CH2 TRP D 59 16.449 16.815 30.783 1.00 25.77 C ATOM 0 H TRP D 59 18.684 22.487 33.012 1.00 24.52 H new ATOM 0 HA TRP D 59 16.292 21.486 32.590 1.00 25.59 H new ATOM 0 HB2 TRP D 59 17.994 21.223 34.832 1.00 24.16 H new ATOM 0 HB3 TRP D 59 16.567 20.592 34.854 1.00 24.16 H new ATOM 0 HD1 TRP D 59 19.729 19.390 34.333 1.00 24.53 H new ATOM 0 HE1 TRP D 59 19.910 17.446 32.922 1.00 27.75 H new ATOM 0 HE3 TRP D 59 15.271 19.484 32.290 1.00 26.55 H new ATOM 0 HZ2 TRP D 59 18.303 16.085 31.107 1.00 25.81 H new ATOM 0 HZ3 TRP D 59 14.693 17.846 30.743 1.00 26.66 H new ATOM 0 HH2 TRP D 59 16.196 16.171 30.162 1.00 25.77 H new ATOM 2924 N LYS D 60 14.631 22.822 33.785 1.00 26.31 N ATOM 2925 CA LYS D 60 13.632 23.666 34.424 1.00 25.56 C ATOM 2926 C LYS D 60 12.295 22.982 34.207 1.00 24.39 C ATOM 2927 O LYS D 60 12.221 21.970 33.512 1.00 21.49 O ATOM 2928 CB LYS D 60 13.640 25.081 33.828 1.00 28.22 C ATOM 2929 CG LYS D 60 13.632 25.158 32.313 1.00 31.47 C ATOM 2930 CD LYS D 60 14.056 26.558 31.870 1.00 37.01 C ATOM 2931 CE LYS D 60 14.051 26.713 30.362 1.00 38.17 C ATOM 2932 NZ LYS D 60 14.628 28.029 29.949 1.00 40.22 N ATOM 0 H LYS D 60 14.299 22.255 33.230 1.00 26.31 H new ATOM 0 HA LYS D 60 13.817 23.772 35.370 1.00 25.56 H new ATOM 0 HB2 LYS D 60 12.866 25.560 34.164 1.00 28.22 H new ATOM 0 HB3 LYS D 60 14.425 25.547 34.155 1.00 28.22 H new ATOM 0 HG2 LYS D 60 14.235 24.495 31.943 1.00 31.47 H new ATOM 0 HG3 LYS D 60 12.746 24.956 31.974 1.00 31.47 H new ATOM 0 HD2 LYS D 60 13.458 27.214 32.262 1.00 37.01 H new ATOM 0 HD3 LYS D 60 14.945 26.746 32.209 1.00 37.01 H new ATOM 0 HE2 LYS D 60 14.561 25.993 29.959 1.00 38.17 H new ATOM 0 HE3 LYS D 60 13.143 26.637 30.030 1.00 38.17 H new ATOM 0 HZ1 LYS D 60 14.613 28.094 29.062 1.00 40.22 H new ATOM 0 HZ2 LYS D 60 14.146 28.689 30.303 1.00 40.22 H new ATOM 0 HZ3 LYS D 60 15.468 28.088 30.237 1.00 40.22 H new ATOM 2933 N GLU D 61 11.240 23.522 34.799 1.00 24.13 N ATOM 2934 CA GLU D 61 9.933 22.907 34.672 1.00 25.17 C ATOM 2935 C GLU D 61 9.608 22.473 33.242 1.00 25.12 C ATOM 2936 O GLU D 61 9.295 21.313 33.003 1.00 23.21 O ATOM 2937 CB GLU D 61 8.856 23.857 35.188 1.00 26.13 C ATOM 2938 CG GLU D 61 9.088 24.301 36.621 1.00 32.53 C ATOM 2939 CD GLU D 61 7.946 25.136 37.163 1.00 36.05 C ATOM 2940 OE1 GLU D 61 7.549 26.108 36.481 1.00 38.66 O ATOM 2941 OE2 GLU D 61 7.454 24.824 38.271 1.00 36.44 O ATOM 0 H GLU D 61 11.260 24.238 35.275 1.00 24.13 H new ATOM 0 HA GLU D 61 9.951 22.100 35.211 1.00 25.17 H new ATOM 0 HB2 GLU D 61 8.821 24.639 34.615 1.00 26.13 H new ATOM 0 HB3 GLU D 61 7.992 23.421 35.126 1.00 26.13 H new ATOM 0 HG2 GLU D 61 9.208 23.520 37.183 1.00 32.53 H new ATOM 0 HG3 GLU D 61 9.910 24.814 36.668 1.00 32.53 H new ATOM 2942 N GLU D 62 9.708 23.404 32.302 1.00 23.44 N ATOM 2943 CA GLU D 62 9.396 23.139 30.905 1.00 24.75 C ATOM 2944 C GLU D 62 10.194 22.005 30.257 1.00 22.76 C ATOM 2945 O GLU D 62 9.616 21.115 29.626 1.00 22.13 O ATOM 2946 CB GLU D 62 9.571 24.422 30.088 1.00 26.91 C ATOM 2947 CG GLU D 62 8.649 25.572 30.502 1.00 36.30 C ATOM 2948 CD GLU D 62 8.884 26.079 31.935 1.00 41.11 C ATOM 2949 OE1 GLU D 62 10.059 26.272 32.332 1.00 39.91 O ATOM 2950 OE2 GLU D 62 7.882 26.300 32.659 1.00 44.81 O ATOM 0 H GLU D 62 9.960 24.211 32.458 1.00 23.44 H new ATOM 0 HA GLU D 62 8.474 22.836 30.902 1.00 24.75 H new ATOM 0 HB2 GLU D 62 10.492 24.717 30.165 1.00 26.91 H new ATOM 0 HB3 GLU D 62 9.416 24.219 29.152 1.00 26.91 H new ATOM 0 HG2 GLU D 62 8.770 26.310 29.884 1.00 36.30 H new ATOM 0 HG3 GLU D 62 7.727 25.281 30.419 1.00 36.30 H new ATOM 2951 N THR D 63 11.513 22.030 30.397 1.00 20.02 N ATOM 2952 CA THR D 63 12.315 20.983 29.797 1.00 20.60 C ATOM 2953 C THR D 63 12.126 19.649 30.506 1.00 21.50 C ATOM 2954 O THR D 63 12.085 18.607 29.852 1.00 19.32 O ATOM 2955 CB THR D 63 13.812 21.372 29.747 1.00 21.53 C ATOM 2956 OG1 THR D 63 14.201 21.981 30.987 1.00 22.02 O ATOM 2957 CG2 THR D 63 14.053 22.344 28.587 1.00 18.28 C ATOM 0 H THR D 63 11.953 22.632 30.826 1.00 20.02 H new ATOM 0 HA THR D 63 12.003 20.878 28.885 1.00 20.60 H new ATOM 0 HB THR D 63 14.345 20.574 29.609 1.00 21.53 H new ATOM 0 HG1 THR D 63 14.939 22.370 30.889 1.00 22.02 H new ATOM 0 HG21 THR D 63 14.992 22.587 28.557 1.00 18.28 H new ATOM 0 HG22 THR D 63 13.803 21.919 27.752 1.00 18.28 H new ATOM 0 HG23 THR D 63 13.517 23.142 28.717 1.00 18.28 H new ATOM 2958 N LEU D 64 11.986 19.672 31.830 1.00 20.15 N ATOM 2959 CA LEU D 64 11.769 18.429 32.565 1.00 22.43 C ATOM 2960 C LEU D 64 10.430 17.808 32.165 1.00 23.24 C ATOM 2961 O LEU D 64 10.301 16.581 32.104 1.00 23.25 O ATOM 2962 CB LEU D 64 11.778 18.666 34.079 1.00 19.90 C ATOM 2963 CG LEU D 64 13.124 18.819 34.785 1.00 23.75 C ATOM 2964 CD1 LEU D 64 12.875 19.241 36.232 1.00 22.34 C ATOM 2965 CD2 LEU D 64 13.912 17.510 34.724 1.00 20.24 C ATOM 0 H LEU D 64 12.013 20.383 32.314 1.00 20.15 H new ATOM 0 HA LEU D 64 12.495 17.826 32.341 1.00 22.43 H new ATOM 0 HB2 LEU D 64 11.260 19.467 34.255 1.00 19.90 H new ATOM 0 HB3 LEU D 64 11.308 17.927 34.496 1.00 19.90 H new ATOM 0 HG LEU D 64 13.653 19.499 34.340 1.00 23.75 H new ATOM 0 HD11 LEU D 64 13.724 19.341 36.691 1.00 22.34 H new ATOM 0 HD12 LEU D 64 12.399 20.086 36.245 1.00 22.34 H new ATOM 0 HD13 LEU D 64 12.344 18.564 36.680 1.00 22.34 H new ATOM 0 HD21 LEU D 64 14.763 17.623 35.176 1.00 20.24 H new ATOM 0 HD22 LEU D 64 13.406 16.807 35.160 1.00 20.24 H new ATOM 0 HD23 LEU D 64 14.068 17.269 33.797 1.00 20.24 H new ATOM 2966 N MET D 65 9.435 18.654 31.899 1.00 22.91 N ATOM 2967 CA MET D 65 8.120 18.159 31.504 1.00 24.00 C ATOM 2968 C MET D 65 8.211 17.351 30.222 1.00 23.80 C ATOM 2969 O MET D 65 7.576 16.311 30.100 1.00 21.66 O ATOM 2970 CB MET D 65 7.133 19.310 31.291 1.00 24.38 C ATOM 2971 CG MET D 65 6.484 19.846 32.562 1.00 31.06 C ATOM 2972 SD MET D 65 5.413 18.646 33.416 1.00 33.56 S ATOM 2973 CE MET D 65 4.022 18.542 32.267 1.00 32.78 C ATOM 0 H MET D 65 9.501 19.510 31.941 1.00 22.91 H new ATOM 0 HA MET D 65 7.800 17.594 32.225 1.00 24.00 H new ATOM 0 HB2 MET D 65 7.597 20.038 30.849 1.00 24.38 H new ATOM 0 HB3 MET D 65 6.434 19.011 30.688 1.00 24.38 H new ATOM 0 HG2 MET D 65 7.181 20.134 33.172 1.00 31.06 H new ATOM 0 HG3 MET D 65 5.960 20.631 32.339 1.00 31.06 H new ATOM 0 HE1 MET D 65 3.520 17.730 32.438 1.00 32.78 H new ATOM 0 HE2 MET D 65 3.443 19.311 32.389 1.00 32.78 H new ATOM 0 HE3 MET D 65 4.355 18.530 31.356 1.00 32.78 H new ATOM 2974 N GLU D 66 9.002 17.832 29.265 1.00 25.37 N ATOM 2975 CA GLU D 66 9.140 17.140 27.987 1.00 24.96 C ATOM 2976 C GLU D 66 10.006 15.894 28.118 1.00 23.17 C ATOM 2977 O GLU D 66 9.637 14.815 27.652 1.00 22.91 O ATOM 2978 CB GLU D 66 9.726 18.080 26.929 1.00 26.02 C ATOM 2979 CG GLU D 66 9.900 17.417 25.565 1.00 30.64 C ATOM 2980 CD GLU D 66 10.171 18.417 24.449 1.00 34.99 C ATOM 2981 OE1 GLU D 66 10.352 17.981 23.288 1.00 34.70 O ATOM 2982 OE2 GLU D 66 10.199 19.638 24.729 1.00 34.45 O ATOM 0 H GLU D 66 9.465 18.554 29.336 1.00 25.37 H new ATOM 0 HA GLU D 66 8.254 16.861 27.707 1.00 24.96 H new ATOM 0 HB2 GLU D 66 9.147 18.853 26.835 1.00 26.02 H new ATOM 0 HB3 GLU D 66 10.587 18.406 27.236 1.00 26.02 H new ATOM 0 HG2 GLU D 66 10.633 16.783 25.610 1.00 30.64 H new ATOM 0 HG3 GLU D 66 9.100 16.911 25.352 1.00 30.64 H new ATOM 2983 N TYR D 67 11.160 16.051 28.750 1.00 21.41 N ATOM 2984 CA TYR D 67 12.075 14.940 28.961 1.00 20.06 C ATOM 2985 C TYR D 67 11.404 13.770 29.686 1.00 20.83 C ATOM 2986 O TYR D 67 11.416 12.631 29.197 1.00 18.19 O ATOM 2987 CB TYR D 67 13.276 15.412 29.784 1.00 21.14 C ATOM 2988 CG TYR D 67 14.203 14.304 30.233 1.00 19.68 C ATOM 2989 CD1 TYR D 67 15.076 13.689 29.337 1.00 21.48 C ATOM 2990 CD2 TYR D 67 14.224 13.889 31.566 1.00 20.73 C ATOM 2991 CE1 TYR D 67 15.959 12.690 29.754 1.00 21.14 C ATOM 2992 CE2 TYR D 67 15.098 12.893 31.996 1.00 20.53 C ATOM 2993 CZ TYR D 67 15.964 12.302 31.084 1.00 21.44 C ATOM 2994 OH TYR D 67 16.852 11.350 31.515 1.00 22.14 O ATOM 0 H TYR D 67 11.434 16.802 29.068 1.00 21.41 H new ATOM 0 HA TYR D 67 12.360 14.629 28.087 1.00 20.06 H new ATOM 0 HB2 TYR D 67 13.784 16.050 29.258 1.00 21.14 H new ATOM 0 HB3 TYR D 67 12.952 15.884 30.567 1.00 21.14 H new ATOM 0 HD1 TYR D 67 15.070 13.949 28.444 1.00 21.48 H new ATOM 0 HD2 TYR D 67 13.645 14.284 32.177 1.00 20.73 H new ATOM 0 HE1 TYR D 67 16.537 12.290 29.145 1.00 21.14 H new ATOM 0 HE2 TYR D 67 15.102 12.626 32.887 1.00 20.53 H new ATOM 0 HH TYR D 67 17.214 11.607 32.228 1.00 22.14 H new ATOM 2995 N LEU D 68 10.821 14.052 30.851 1.00 19.82 N ATOM 2996 CA LEU D 68 10.188 12.998 31.648 1.00 21.87 C ATOM 2997 C LEU D 68 9.078 12.248 30.923 1.00 22.70 C ATOM 2998 O LEU D 68 8.737 11.122 31.295 1.00 22.95 O ATOM 2999 CB LEU D 68 9.663 13.571 32.968 1.00 22.94 C ATOM 3000 CG LEU D 68 10.764 14.144 33.870 1.00 23.25 C ATOM 3001 CD1 LEU D 68 10.155 14.766 35.106 1.00 24.20 C ATOM 3002 CD2 LEU D 68 11.738 13.048 34.247 1.00 24.45 C ATOM 0 H LEU D 68 10.780 14.839 31.196 1.00 19.82 H new ATOM 0 HA LEU D 68 10.884 12.344 31.820 1.00 21.87 H new ATOM 0 HB2 LEU D 68 9.018 14.269 32.775 1.00 22.94 H new ATOM 0 HB3 LEU D 68 9.191 12.874 33.450 1.00 22.94 H new ATOM 0 HG LEU D 68 11.245 14.835 33.388 1.00 23.25 H new ATOM 0 HD11 LEU D 68 10.859 15.125 35.668 1.00 24.20 H new ATOM 0 HD12 LEU D 68 9.554 15.481 34.846 1.00 24.20 H new ATOM 0 HD13 LEU D 68 9.661 14.092 35.598 1.00 24.20 H new ATOM 0 HD21 LEU D 68 12.432 13.414 34.817 1.00 24.45 H new ATOM 0 HD22 LEU D 68 11.267 12.346 34.722 1.00 24.45 H new ATOM 0 HD23 LEU D 68 12.140 12.681 33.444 1.00 24.45 H new ATOM 3003 N GLU D 69 8.519 12.855 29.885 1.00 22.44 N ATOM 3004 CA GLU D 69 7.465 12.188 29.139 1.00 25.26 C ATOM 3005 C GLU D 69 8.064 11.064 28.305 1.00 25.48 C ATOM 3006 O GLU D 69 7.435 10.028 28.096 1.00 23.90 O ATOM 3007 CB GLU D 69 6.742 13.167 28.212 1.00 28.15 C ATOM 3008 CG GLU D 69 5.523 12.550 27.541 1.00 33.43 C ATOM 3009 CD GLU D 69 4.743 13.542 26.700 1.00 38.10 C ATOM 3010 OE1 GLU D 69 3.565 13.256 26.402 1.00 40.20 O ATOM 3011 OE2 GLU D 69 5.303 14.598 26.330 1.00 40.81 O ATOM 0 H GLU D 69 8.731 13.639 29.601 1.00 22.44 H new ATOM 0 HA GLU D 69 6.825 11.831 29.774 1.00 25.26 H new ATOM 0 HB2 GLU D 69 6.467 13.945 28.721 1.00 28.15 H new ATOM 0 HB3 GLU D 69 7.359 13.477 27.531 1.00 28.15 H new ATOM 0 HG2 GLU D 69 5.808 11.812 26.980 1.00 33.43 H new ATOM 0 HG3 GLU D 69 4.938 12.180 28.221 1.00 33.43 H new ATOM 3012 N ASN D 70 9.290 11.274 27.838 1.00 23.69 N ATOM 3013 CA ASN D 70 9.965 10.291 27.007 1.00 23.47 C ATOM 3014 C ASN D 70 11.440 10.664 26.910 1.00 22.79 C ATOM 3015 O ASN D 70 11.849 11.384 25.999 1.00 21.46 O ATOM 3016 CB ASN D 70 9.342 10.289 25.607 1.00 25.68 C ATOM 3017 CG ASN D 70 9.846 9.150 24.751 1.00 25.04 C ATOM 3018 OD1 ASN D 70 10.928 8.621 24.979 1.00 26.10 O ATOM 3019 ND2 ASN D 70 9.063 8.775 23.746 1.00 29.36 N ATOM 0 H ASN D 70 9.749 11.985 27.993 1.00 23.69 H new ATOM 0 HA ASN D 70 9.872 9.408 27.397 1.00 23.47 H new ATOM 0 HB2 ASN D 70 8.377 10.228 25.686 1.00 25.68 H new ATOM 0 HB3 ASN D 70 9.538 11.131 25.168 1.00 25.68 H new ATOM 0 HD21 ASN D 70 9.309 8.137 23.224 1.00 29.36 H new ATOM 0 HD22 ASN D 70 8.310 9.170 23.617 1.00 29.36 H new ATOM 3020 N PRO D 71 12.258 10.184 27.859 1.00 21.54 N ATOM 3021 CA PRO D 71 13.699 10.463 27.897 1.00 19.76 C ATOM 3022 C PRO D 71 14.447 10.223 26.590 1.00 20.09 C ATOM 3023 O PRO D 71 15.174 11.088 26.114 1.00 17.08 O ATOM 3024 CB PRO D 71 14.196 9.545 29.009 1.00 19.63 C ATOM 3025 CG PRO D 71 13.039 9.551 29.966 1.00 24.14 C ATOM 3026 CD PRO D 71 11.848 9.380 29.026 1.00 21.33 C ATOM 0 HA PRO D 71 13.863 11.407 28.050 1.00 19.76 H new ATOM 0 HB2 PRO D 71 14.391 8.653 28.682 1.00 19.63 H new ATOM 0 HB3 PRO D 71 15.008 9.881 29.420 1.00 19.63 H new ATOM 0 HG2 PRO D 71 13.098 8.830 30.612 1.00 24.14 H new ATOM 0 HG3 PRO D 71 12.988 10.379 30.469 1.00 24.14 H new ATOM 0 HD2 PRO D 71 11.701 8.450 28.792 1.00 21.33 H new ATOM 0 HD3 PRO D 71 11.024 9.707 29.421 1.00 21.33 H new ATOM 3027 N LYS D 72 14.279 9.040 26.013 1.00 20.15 N ATOM 3028 CA LYS D 72 14.985 8.727 24.784 1.00 19.67 C ATOM 3029 C LYS D 72 14.541 9.557 23.579 1.00 20.51 C ATOM 3030 O LYS D 72 15.310 9.740 22.638 1.00 23.58 O ATOM 3031 CB LYS D 72 14.909 7.218 24.515 0.50 16.27 C ATOM 3032 CG LYS D 72 15.743 6.439 25.533 0.50 16.13 C ATOM 3033 CD LYS D 72 15.800 4.941 25.278 0.50 17.11 C ATOM 3034 CE LYS D 72 16.786 4.282 26.243 0.50 17.69 C ATOM 3035 NZ LYS D 72 16.786 2.790 26.142 0.50 19.19 N ATOM 0 H LYS D 72 13.769 8.415 26.312 1.00 20.15 H new ATOM 0 HA LYS D 72 15.912 8.979 24.915 1.00 19.67 H new ATOM 0 HB2 LYS D 72 13.985 6.925 24.556 0.50 16.27 H new ATOM 0 HB3 LYS D 72 15.227 7.029 23.618 0.50 16.27 H new ATOM 0 HG2 LYS D 72 16.647 6.791 25.533 0.50 16.13 H new ATOM 0 HG3 LYS D 72 15.379 6.592 26.419 0.50 16.13 H new ATOM 0 HD2 LYS D 72 14.918 4.553 25.390 0.50 17.11 H new ATOM 0 HD3 LYS D 72 16.070 4.772 24.362 0.50 17.11 H new ATOM 0 HE2 LYS D 72 17.679 4.614 26.063 0.50 17.69 H new ATOM 0 HE3 LYS D 72 16.565 4.541 27.151 0.50 17.69 H new ATOM 0 HZ1 LYS D 72 17.373 2.453 26.720 0.50 19.19 H new ATOM 0 HZ2 LYS D 72 15.973 2.480 26.330 0.50 19.19 H new ATOM 0 HZ3 LYS D 72 17.012 2.548 25.316 0.50 19.19 H new ATOM 3036 N LYS D 73 13.319 10.074 23.605 1.00 21.28 N ATOM 3037 CA LYS D 73 12.858 10.914 22.502 1.00 22.77 C ATOM 3038 C LYS D 73 13.493 12.298 22.657 1.00 22.93 C ATOM 3039 O LYS D 73 13.963 12.892 21.687 1.00 24.26 O ATOM 3040 CB LYS D 73 11.337 11.054 22.519 0.50 20.31 C ATOM 3041 CG LYS D 73 10.801 11.946 21.414 0.50 20.23 C ATOM 3042 CD LYS D 73 9.312 12.182 21.573 0.50 22.41 C ATOM 3043 CE LYS D 73 8.778 13.095 20.484 0.50 24.29 C ATOM 3044 NZ LYS D 73 7.334 13.394 20.693 0.50 24.95 N ATOM 0 H LYS D 73 12.749 9.955 24.238 1.00 21.28 H new ATOM 0 HA LYS D 73 13.115 10.506 21.661 1.00 22.77 H new ATOM 0 HB2 LYS D 73 10.937 10.174 22.438 0.50 20.31 H new ATOM 0 HB3 LYS D 73 11.062 11.413 23.377 0.50 20.31 H new ATOM 0 HG2 LYS D 73 11.269 12.796 21.425 0.50 20.23 H new ATOM 0 HG3 LYS D 73 10.976 11.538 20.552 0.50 20.23 H new ATOM 0 HD2 LYS D 73 8.843 11.333 21.545 0.50 22.41 H new ATOM 0 HD3 LYS D 73 9.136 12.575 22.442 0.50 22.41 H new ATOM 0 HE2 LYS D 73 9.284 13.922 20.475 0.50 24.29 H new ATOM 0 HE3 LYS D 73 8.902 12.677 19.618 0.50 24.29 H new ATOM 0 HZ1 LYS D 73 7.044 13.929 20.044 0.50 24.95 H new ATOM 0 HZ2 LYS D 73 6.869 12.635 20.681 0.50 24.95 H new ATOM 0 HZ3 LYS D 73 7.225 13.796 21.479 0.50 24.95 H new ATOM 3045 N TYR D 74 13.517 12.798 23.890 1.00 21.71 N ATOM 3046 CA TYR D 74 14.086 14.108 24.179 1.00 20.00 C ATOM 3047 C TYR D 74 15.612 14.102 24.070 1.00 20.23 C ATOM 3048 O TYR D 74 16.212 15.071 23.602 1.00 19.61 O ATOM 3049 CB TYR D 74 13.677 14.564 25.577 1.00 19.46 C ATOM 3050 CG TYR D 74 13.973 16.016 25.837 1.00 23.91 C ATOM 3051 CD1 TYR D 74 13.319 17.018 25.115 1.00 23.21 C ATOM 3052 CD2 TYR D 74 14.892 16.397 26.815 1.00 23.61 C ATOM 3053 CE1 TYR D 74 13.569 18.360 25.363 1.00 25.51 C ATOM 3054 CE2 TYR D 74 15.151 17.741 27.072 1.00 25.97 C ATOM 3055 CZ TYR D 74 14.484 18.718 26.345 1.00 26.02 C ATOM 3056 OH TYR D 74 14.721 20.047 26.609 1.00 27.99 O ATOM 0 H TYR D 74 13.205 12.388 24.579 1.00 21.71 H new ATOM 0 HA TYR D 74 13.739 14.727 23.517 1.00 20.00 H new ATOM 0 HB2 TYR D 74 12.727 14.407 25.697 1.00 19.46 H new ATOM 0 HB3 TYR D 74 14.140 14.023 26.236 1.00 19.46 H new ATOM 0 HD1 TYR D 74 12.706 16.781 24.457 1.00 23.21 H new ATOM 0 HD2 TYR D 74 15.339 15.743 27.303 1.00 23.61 H new ATOM 0 HE1 TYR D 74 13.127 19.016 24.875 1.00 25.51 H new ATOM 0 HE2 TYR D 74 15.766 17.982 27.726 1.00 25.97 H new ATOM 0 HH TYR D 74 15.292 20.114 27.222 1.00 27.99 H new ATOM 3057 N ILE D 75 16.240 13.020 24.515 1.00 19.41 N ATOM 3058 CA ILE D 75 17.692 12.913 24.423 1.00 20.87 C ATOM 3059 C ILE D 75 18.073 11.584 23.777 1.00 20.44 C ATOM 3060 O ILE D 75 18.457 10.636 24.455 1.00 22.01 O ATOM 3061 CB ILE D 75 18.385 13.011 25.806 1.00 20.04 C ATOM 3062 CG1 ILE D 75 17.941 14.280 26.546 1.00 20.28 C ATOM 3063 CG2 ILE D 75 19.901 13.061 25.606 1.00 22.24 C ATOM 3064 CD1 ILE D 75 18.629 14.477 27.910 1.00 20.65 C ATOM 0 H ILE D 75 15.849 12.342 24.871 1.00 19.41 H new ATOM 0 HA ILE D 75 17.995 13.659 23.882 1.00 20.87 H new ATOM 0 HB ILE D 75 18.137 12.235 26.333 1.00 20.04 H new ATOM 0 HG12 ILE D 75 18.124 15.051 25.987 1.00 20.28 H new ATOM 0 HG13 ILE D 75 16.981 14.247 26.679 1.00 20.28 H new ATOM 0 HG21 ILE D 75 20.340 13.122 26.469 1.00 22.24 H new ATOM 0 HG22 ILE D 75 20.194 12.256 25.151 1.00 22.24 H new ATOM 0 HG23 ILE D 75 20.132 13.836 25.071 1.00 22.24 H new ATOM 0 HD11 ILE D 75 18.304 15.293 28.321 1.00 20.65 H new ATOM 0 HD12 ILE D 75 18.428 13.723 28.486 1.00 20.65 H new ATOM 0 HD13 ILE D 75 19.589 14.539 27.783 1.00 20.65 H new ATOM 3065 N PRO D 76 17.960 11.501 22.443 1.00 22.35 N ATOM 3066 CA PRO D 76 18.291 10.288 21.691 1.00 21.18 C ATOM 3067 C PRO D 76 19.713 9.853 22.007 1.00 20.17 C ATOM 3068 O PRO D 76 20.641 10.656 21.948 1.00 19.66 O ATOM 3069 CB PRO D 76 18.132 10.732 20.238 1.00 20.51 C ATOM 3070 CG PRO D 76 17.039 11.738 20.326 1.00 24.35 C ATOM 3071 CD PRO D 76 17.434 12.542 21.546 1.00 21.39 C ATOM 0 HA PRO D 76 17.734 9.522 21.903 1.00 21.18 H new ATOM 0 HB2 PRO D 76 18.950 11.117 19.887 1.00 20.51 H new ATOM 0 HB3 PRO D 76 17.895 9.991 19.658 1.00 20.51 H new ATOM 0 HG2 PRO D 76 16.991 12.290 19.530 1.00 24.35 H new ATOM 0 HG3 PRO D 76 16.171 11.320 20.434 1.00 24.35 H new ATOM 0 HD2 PRO D 76 18.103 13.213 21.337 1.00 21.39 H new ATOM 0 HD3 PRO D 76 16.677 13.007 21.935 1.00 21.39 H new ATOM 3072 N GLY D 77 19.878 8.582 22.351 1.00 19.81 N ATOM 3073 CA GLY D 77 21.198 8.085 22.684 1.00 20.05 C ATOM 3074 C GLY D 77 21.413 7.951 24.181 1.00 21.96 C ATOM 3075 O GLY D 77 22.384 7.328 24.615 1.00 22.49 O ATOM 0 H GLY D 77 19.246 8.000 22.397 1.00 19.81 H new ATOM 0 HA2 GLY D 77 21.330 7.221 22.263 1.00 20.05 H new ATOM 0 HA3 GLY D 77 21.867 8.684 22.317 1.00 20.05 H new ATOM 3076 N THR D 78 20.526 8.526 24.987 1.00 21.47 N ATOM 3077 CA THR D 78 20.706 8.419 26.431 1.00 22.50 C ATOM 3078 C THR D 78 20.562 6.960 26.883 1.00 23.62 C ATOM 3079 O THR D 78 19.806 6.198 26.297 1.00 25.09 O ATOM 3080 CB THR D 78 19.701 9.323 27.214 1.00 21.95 C ATOM 3081 OG1 THR D 78 19.965 9.211 28.617 1.00 18.96 O ATOM 3082 CG2 THR D 78 18.250 8.909 26.951 1.00 21.65 C ATOM 0 H THR D 78 19.835 8.969 24.730 1.00 21.47 H new ATOM 0 HA THR D 78 21.602 8.730 26.633 1.00 22.50 H new ATOM 0 HB THR D 78 19.819 10.237 26.912 1.00 21.95 H new ATOM 0 HG1 THR D 78 20.774 9.016 28.736 1.00 18.96 H new ATOM 0 HG21 THR D 78 17.653 9.488 27.450 1.00 21.65 H new ATOM 0 HG22 THR D 78 18.058 8.987 26.003 1.00 21.65 H new ATOM 0 HG23 THR D 78 18.119 7.990 27.233 1.00 21.65 H new ATOM 3083 N LYS D 79 21.307 6.572 27.914 1.00 25.00 N ATOM 3084 CA LYS D 79 21.251 5.204 28.430 1.00 23.97 C ATOM 3085 C LYS D 79 20.900 5.235 29.917 1.00 25.49 C ATOM 3086 O LYS D 79 21.517 5.974 30.686 1.00 24.99 O ATOM 3087 CB LYS D 79 22.600 4.513 28.240 1.00 25.19 C ATOM 3088 CG LYS D 79 23.112 4.498 26.798 1.00 26.61 C ATOM 3089 CD LYS D 79 22.211 3.673 25.903 1.00 29.05 C ATOM 3090 CE LYS D 79 22.721 3.658 24.463 1.00 31.30 C ATOM 3091 NZ LYS D 79 21.880 2.781 23.609 1.00 31.57 N ATOM 0 H LYS D 79 21.854 7.087 28.332 1.00 25.00 H new ATOM 0 HA LYS D 79 20.572 4.711 27.943 1.00 23.97 H new ATOM 0 HB2 LYS D 79 23.258 4.955 28.799 1.00 25.19 H new ATOM 0 HB3 LYS D 79 22.528 3.598 28.555 1.00 25.19 H new ATOM 0 HG2 LYS D 79 23.162 5.406 26.461 1.00 26.61 H new ATOM 0 HG3 LYS D 79 24.012 4.137 26.776 1.00 26.61 H new ATOM 0 HD2 LYS D 79 22.161 2.765 26.240 1.00 29.05 H new ATOM 0 HD3 LYS D 79 21.311 4.034 25.926 1.00 29.05 H new ATOM 0 HE2 LYS D 79 22.719 4.560 24.106 1.00 31.30 H new ATOM 0 HE3 LYS D 79 23.640 3.348 24.445 1.00 31.30 H new ATOM 0 HZ1 LYS D 79 22.194 2.787 22.776 1.00 31.57 H new ATOM 0 HZ2 LYS D 79 21.899 1.950 23.927 1.00 31.57 H new ATOM 0 HZ3 LYS D 79 21.042 3.080 23.611 1.00 31.57 H new ATOM 3092 N MET D 80 19.914 4.431 30.311 1.00 25.48 N ATOM 3093 CA MET D 80 19.467 4.360 31.703 1.00 28.09 C ATOM 3094 C MET D 80 20.197 3.289 32.520 1.00 27.19 C ATOM 3095 O MET D 80 20.229 3.359 33.749 1.00 25.50 O ATOM 3096 CB MET D 80 17.967 4.069 31.758 1.00 31.53 C ATOM 3097 CG MET D 80 17.139 5.130 32.457 1.00 37.35 C ATOM 3098 SD MET D 80 16.863 6.566 31.425 1.00 40.30 S ATOM 3099 CE MET D 80 15.144 6.411 31.120 1.00 40.84 C ATOM 0 H MET D 80 19.484 3.910 29.778 1.00 25.48 H new ATOM 0 HA MET D 80 19.672 5.223 32.095 1.00 28.09 H new ATOM 0 HB2 MET D 80 17.637 3.964 30.852 1.00 31.53 H new ATOM 0 HB3 MET D 80 17.831 3.221 32.209 1.00 31.53 H new ATOM 0 HG2 MET D 80 16.284 4.752 32.716 1.00 37.35 H new ATOM 0 HG3 MET D 80 17.588 5.402 33.273 1.00 37.35 H new ATOM 0 HE1 MET D 80 14.740 7.292 31.091 1.00 40.84 H new ATOM 0 HE2 MET D 80 15.005 5.964 30.271 1.00 40.84 H new ATOM 0 HE3 MET D 80 14.735 5.891 31.829 1.00 40.84 H new ATOM 3100 N ILE D 81 20.754 2.291 31.834 1.00 27.84 N ATOM 3101 CA ILE D 81 21.477 1.199 32.490 1.00 28.16 C ATOM 3102 C ILE D 81 22.923 1.158 32.014 1.00 27.15 C ATOM 3103 O ILE D 81 23.248 1.697 30.964 1.00 27.70 O ATOM 3104 CB ILE D 81 20.824 -0.175 32.190 1.00 31.48 C ATOM 3105 CG1 ILE D 81 20.757 -0.403 30.677 1.00 32.33 C ATOM 3106 CG2 ILE D 81 19.427 -0.226 32.788 1.00 33.98 C ATOM 3107 CD1 ILE D 81 20.260 -1.781 30.276 1.00 34.79 C ATOM 0 H ILE D 81 20.724 2.227 30.977 1.00 27.84 H new ATOM 0 HA ILE D 81 21.442 1.367 33.445 1.00 28.16 H new ATOM 0 HB ILE D 81 21.363 -0.876 32.589 1.00 31.48 H new ATOM 0 HG12 ILE D 81 20.175 0.266 30.285 1.00 32.33 H new ATOM 0 HG13 ILE D 81 21.640 -0.267 30.300 1.00 32.33 H new ATOM 0 HG21 ILE D 81 19.024 -1.087 32.597 1.00 33.98 H new ATOM 0 HG22 ILE D 81 19.481 -0.101 33.748 1.00 33.98 H new ATOM 0 HG23 ILE D 81 18.883 0.478 32.401 1.00 33.98 H new ATOM 0 HD11 ILE D 81 20.245 -1.851 29.309 1.00 34.79 H new ATOM 0 HD12 ILE D 81 20.853 -2.457 30.639 1.00 34.79 H new ATOM 0 HD13 ILE D 81 19.365 -1.916 30.624 1.00 34.79 H new ATOM 3108 N PHE D 82 23.789 0.514 32.787 1.00 28.36 N ATOM 3109 CA PHE D 82 25.204 0.414 32.440 1.00 27.89 C ATOM 3110 C PHE D 82 25.434 0.173 30.944 1.00 26.03 C ATOM 3111 O PHE D 82 24.994 -0.835 30.395 1.00 23.51 O ATOM 3112 CB PHE D 82 25.867 -0.713 33.237 1.00 28.39 C ATOM 3113 CG PHE D 82 27.301 -0.937 32.869 1.00 28.68 C ATOM 3114 CD1 PHE D 82 28.252 0.041 33.121 1.00 28.00 C ATOM 3115 CD2 PHE D 82 27.697 -2.114 32.248 1.00 30.03 C ATOM 3116 CE1 PHE D 82 29.587 -0.146 32.758 1.00 29.93 C ATOM 3117 CE2 PHE D 82 29.033 -2.311 31.881 1.00 31.28 C ATOM 3118 CZ PHE D 82 29.977 -1.321 32.139 1.00 28.53 C ATOM 0 H PHE D 82 23.576 0.124 33.524 1.00 28.36 H new ATOM 0 HA PHE D 82 25.604 1.268 32.666 1.00 27.89 H new ATOM 0 HB2 PHE D 82 25.811 -0.507 34.183 1.00 28.39 H new ATOM 0 HB3 PHE D 82 25.372 -1.535 33.096 1.00 28.39 H new ATOM 0 HD1 PHE D 82 27.997 0.832 33.538 1.00 28.00 H new ATOM 0 HD2 PHE D 82 27.069 -2.777 32.074 1.00 30.03 H new ATOM 0 HE1 PHE D 82 30.214 0.519 32.932 1.00 29.93 H new ATOM 0 HE2 PHE D 82 29.290 -3.102 31.465 1.00 31.28 H new ATOM 0 HZ PHE D 82 30.866 -1.449 31.897 1.00 28.53 H new ATOM 3119 N ALA D 83 26.131 1.101 30.299 1.00 25.81 N ATOM 3120 CA ALA D 83 26.415 0.997 28.871 1.00 28.18 C ATOM 3121 C ALA D 83 27.911 1.052 28.591 1.00 27.99 C ATOM 3122 O ALA D 83 28.323 1.265 27.451 1.00 30.65 O ATOM 3123 CB ALA D 83 25.696 2.115 28.103 1.00 25.82 C ATOM 0 H ALA D 83 26.452 1.806 30.673 1.00 25.81 H new ATOM 0 HA ALA D 83 26.086 0.136 28.568 1.00 28.18 H new ATOM 0 HB1 ALA D 83 25.892 2.035 27.156 1.00 25.82 H new ATOM 0 HB2 ALA D 83 24.739 2.040 28.242 1.00 25.82 H new ATOM 0 HB3 ALA D 83 26.002 2.977 28.425 1.00 25.82 H new ATOM 3124 N GLY D 84 28.721 0.853 29.628 1.00 28.41 N ATOM 3125 CA GLY D 84 30.165 0.882 29.453 1.00 29.03 C ATOM 3126 C GLY D 84 30.886 1.975 30.227 1.00 30.18 C ATOM 3127 O GLY D 84 30.254 2.852 30.819 1.00 29.44 O ATOM 0 H GLY D 84 28.456 0.701 30.432 1.00 28.41 H new ATOM 0 HA2 GLY D 84 30.527 0.023 29.721 1.00 29.03 H new ATOM 0 HA3 GLY D 84 30.361 0.990 28.509 1.00 29.03 H new ATOM 3128 N ILE D 85 32.217 1.913 30.217 1.00 31.56 N ATOM 3129 CA ILE D 85 33.076 2.880 30.907 1.00 30.91 C ATOM 3130 C ILE D 85 33.947 3.565 29.858 1.00 30.76 C ATOM 3131 O ILE D 85 34.755 2.908 29.204 1.00 29.00 O ATOM 3132 CB ILE D 85 34.006 2.170 31.917 1.00 31.91 C ATOM 3133 CG1 ILE D 85 33.180 1.359 32.916 1.00 31.75 C ATOM 3134 CG2 ILE D 85 34.873 3.196 32.639 1.00 29.97 C ATOM 3135 CD1 ILE D 85 32.221 2.191 33.738 1.00 36.01 C ATOM 0 H ILE D 85 32.654 1.299 29.803 1.00 31.56 H new ATOM 0 HA ILE D 85 32.520 3.515 31.385 1.00 30.91 H new ATOM 0 HB ILE D 85 34.587 1.560 31.437 1.00 31.91 H new ATOM 0 HG12 ILE D 85 32.677 0.684 32.434 1.00 31.75 H new ATOM 0 HG13 ILE D 85 33.782 0.890 33.515 1.00 31.75 H new ATOM 0 HG21 ILE D 85 35.453 2.743 33.270 1.00 29.97 H new ATOM 0 HG22 ILE D 85 35.413 3.676 31.992 1.00 29.97 H new ATOM 0 HG23 ILE D 85 34.305 3.822 33.114 1.00 29.97 H new ATOM 0 HD11 ILE D 85 31.733 1.615 34.347 1.00 36.01 H new ATOM 0 HD12 ILE D 85 32.718 2.851 34.246 1.00 36.01 H new ATOM 0 HD13 ILE D 85 31.596 2.642 33.149 1.00 36.01 H new ATOM 3136 N LYS D 86 33.801 4.880 29.697 1.00 30.90 N ATOM 3137 CA LYS D 86 34.581 5.589 28.688 1.00 32.14 C ATOM 3138 C LYS D 86 36.074 5.746 28.995 1.00 32.10 C ATOM 3139 O LYS D 86 36.908 5.519 28.120 1.00 30.75 O ATOM 3140 CB LYS D 86 33.975 6.968 28.404 0.50 33.01 C ATOM 3141 CG LYS D 86 34.146 7.990 29.512 0.50 34.34 C ATOM 3142 CD LYS D 86 33.786 9.389 29.017 0.50 34.58 C ATOM 3143 CE LYS D 86 34.672 9.800 27.845 0.50 34.64 C ATOM 3144 NZ LYS D 86 34.341 11.149 27.306 0.50 37.00 N ATOM 0 H LYS D 86 33.264 5.372 30.155 1.00 30.90 H new ATOM 0 HA LYS D 86 34.532 5.018 27.906 1.00 32.14 H new ATOM 0 HB2 LYS D 86 34.375 7.321 27.594 0.50 33.01 H new ATOM 0 HB3 LYS D 86 33.027 6.859 28.228 0.50 33.01 H new ATOM 0 HG2 LYS D 86 33.583 7.754 30.266 0.50 34.34 H new ATOM 0 HG3 LYS D 86 35.063 7.980 29.829 0.50 34.34 H new ATOM 0 HD2 LYS D 86 32.855 9.410 28.746 0.50 34.58 H new ATOM 0 HD3 LYS D 86 33.885 10.027 29.741 0.50 34.58 H new ATOM 0 HE2 LYS D 86 35.599 9.790 28.129 0.50 34.64 H new ATOM 0 HE3 LYS D 86 34.585 9.144 27.136 0.50 34.64 H new ATOM 0 HZ1 LYS D 86 34.884 11.339 26.627 0.50 37.00 H new ATOM 0 HZ2 LYS D 86 33.498 11.157 27.021 0.50 37.00 H new ATOM 0 HZ3 LYS D 86 34.443 11.758 27.947 0.50 37.00 H new ATOM 3145 N LYS D 87 36.407 6.125 30.227 1.00 33.28 N ATOM 3146 CA LYS D 87 37.802 6.319 30.620 1.00 33.98 C ATOM 3147 C LYS D 87 38.628 5.035 30.607 1.00 33.14 C ATOM 3148 O LYS D 87 38.286 4.059 31.270 1.00 32.63 O ATOM 3149 CB LYS D 87 37.890 6.950 32.015 0.50 32.41 C ATOM 3150 CG LYS D 87 37.665 8.453 32.060 0.50 34.37 C ATOM 3151 CD LYS D 87 37.769 8.969 33.495 0.50 33.84 C ATOM 3152 CE LYS D 87 37.517 10.470 33.591 0.50 33.72 C ATOM 3153 NZ LYS D 87 38.568 11.277 32.908 0.50 36.35 N ATOM 0 H LYS D 87 35.837 6.276 30.853 1.00 33.28 H new ATOM 0 HA LYS D 87 38.178 6.913 29.952 1.00 33.98 H new ATOM 0 HB2 LYS D 87 37.236 6.522 32.590 0.50 32.41 H new ATOM 0 HB3 LYS D 87 38.765 6.757 32.387 0.50 32.41 H new ATOM 0 HG2 LYS D 87 38.320 8.900 31.502 0.50 34.37 H new ATOM 0 HG3 LYS D 87 36.791 8.665 31.697 0.50 34.37 H new ATOM 0 HD2 LYS D 87 37.129 8.500 34.052 0.50 33.84 H new ATOM 0 HD3 LYS D 87 38.651 8.768 33.845 0.50 33.84 H new ATOM 0 HE2 LYS D 87 36.653 10.674 33.200 0.50 33.72 H new ATOM 0 HE3 LYS D 87 37.474 10.727 34.525 0.50 33.72 H new ATOM 0 HZ1 LYS D 87 38.394 12.143 33.016 0.50 36.35 H new ATOM 0 HZ2 LYS D 87 39.363 11.088 33.260 0.50 36.35 H new ATOM 0 HZ3 LYS D 87 38.575 11.082 32.040 0.50 36.35 H new ATOM 3154 N LYS D 88 39.717 5.052 29.850 1.00 32.75 N ATOM 3155 CA LYS D 88 40.616 3.908 29.755 1.00 34.80 C ATOM 3156 C LYS D 88 41.244 3.644 31.125 1.00 34.94 C ATOM 3157 O LYS D 88 41.326 2.499 31.581 1.00 34.45 O ATOM 3158 CB LYS D 88 41.700 4.197 28.712 1.00 35.95 C ATOM 3159 CG LYS D 88 42.887 3.247 28.721 1.00 39.38 C ATOM 3160 CD LYS D 88 43.784 3.509 27.516 1.00 42.20 C ATOM 3161 CE LYS D 88 45.115 2.781 27.628 1.00 44.49 C ATOM 3162 NZ LYS D 88 45.992 3.392 28.675 1.00 45.56 N ATOM 0 H LYS D 88 39.957 5.728 29.376 1.00 32.75 H new ATOM 0 HA LYS D 88 40.122 3.120 29.480 1.00 34.80 H new ATOM 0 HB2 LYS D 88 41.294 4.174 27.831 1.00 35.95 H new ATOM 0 HB3 LYS D 88 42.027 5.100 28.850 1.00 35.95 H new ATOM 0 HG2 LYS D 88 43.394 3.361 29.540 1.00 39.38 H new ATOM 0 HG3 LYS D 88 42.574 2.329 28.706 1.00 39.38 H new ATOM 0 HD2 LYS D 88 43.329 3.227 26.707 1.00 42.20 H new ATOM 0 HD3 LYS D 88 43.943 4.462 27.434 1.00 42.20 H new ATOM 0 HE2 LYS D 88 44.957 1.848 27.842 1.00 44.49 H new ATOM 0 HE3 LYS D 88 45.569 2.803 26.771 1.00 44.49 H new ATOM 0 HZ1 LYS D 88 46.823 3.462 28.363 1.00 45.56 H new ATOM 0 HZ2 LYS D 88 45.685 4.201 28.884 1.00 45.56 H new ATOM 0 HZ3 LYS D 88 45.990 2.877 29.401 1.00 45.56 H new ATOM 3163 N THR D 89 41.679 4.715 31.778 1.00 35.19 N ATOM 3164 CA THR D 89 42.284 4.626 33.102 1.00 36.88 C ATOM 3165 C THR D 89 41.327 3.920 34.054 1.00 36.45 C ATOM 3166 O THR D 89 41.690 2.951 34.721 1.00 37.34 O ATOM 3167 CB THR D 89 42.564 6.024 33.673 1.00 38.04 C ATOM 3168 OG1 THR D 89 43.345 6.770 32.735 1.00 40.28 O ATOM 3169 CG2 THR D 89 43.315 5.918 34.997 1.00 40.21 C ATOM 0 H THR D 89 41.632 5.515 31.466 1.00 35.19 H new ATOM 0 HA THR D 89 43.116 4.135 33.016 1.00 36.88 H new ATOM 0 HB THR D 89 41.720 6.476 33.831 1.00 38.04 H new ATOM 0 HG1 THR D 89 43.498 7.536 33.044 1.00 40.28 H new ATOM 0 HG21 THR D 89 43.485 6.807 35.345 1.00 40.21 H new ATOM 0 HG22 THR D 89 42.780 5.419 35.634 1.00 40.21 H new ATOM 0 HG23 THR D 89 44.159 5.461 34.855 1.00 40.21 H new ATOM 3170 N GLU D 90 40.099 4.424 34.111 1.00 35.45 N ATOM 3171 CA GLU D 90 39.069 3.860 34.973 1.00 34.12 C ATOM 3172 C GLU D 90 38.875 2.372 34.666 1.00 32.98 C ATOM 3173 O GLU D 90 38.735 1.555 35.583 1.00 30.54 O ATOM 3174 CB GLU D 90 37.768 4.638 34.771 1.00 36.04 C ATOM 3175 CG GLU D 90 36.585 4.156 35.583 1.00 38.28 C ATOM 3176 CD GLU D 90 35.398 5.103 35.478 1.00 38.72 C ATOM 3177 OE1 GLU D 90 34.304 4.755 35.983 1.00 36.53 O ATOM 3178 OE2 GLU D 90 35.568 6.197 34.891 1.00 36.87 O ATOM 0 H GLU D 90 39.840 5.103 33.651 1.00 35.45 H new ATOM 0 HA GLU D 90 39.340 3.936 35.901 1.00 34.12 H new ATOM 0 HB2 GLU D 90 37.930 5.570 34.987 1.00 36.04 H new ATOM 0 HB3 GLU D 90 37.531 4.602 33.831 1.00 36.04 H new ATOM 0 HG2 GLU D 90 36.322 3.274 35.278 1.00 38.28 H new ATOM 0 HG3 GLU D 90 36.846 4.068 36.513 1.00 38.28 H new ATOM 3179 N ARG D 91 38.871 2.017 33.382 1.00 29.06 N ATOM 3180 CA ARG D 91 38.717 0.617 33.011 1.00 28.64 C ATOM 3181 C ARG D 91 39.920 -0.197 33.476 1.00 29.20 C ATOM 3182 O ARG D 91 39.769 -1.297 34.011 1.00 28.28 O ATOM 3183 CB ARG D 91 38.521 0.468 31.497 1.00 28.76 C ATOM 3184 CG ARG D 91 37.045 0.430 31.089 1.00 26.86 C ATOM 3185 CD ARG D 91 36.847 0.194 29.596 1.00 27.45 C ATOM 3186 NE ARG D 91 37.217 1.362 28.806 1.00 30.80 N ATOM 3187 CZ ARG D 91 38.277 1.426 28.012 1.00 30.17 C ATOM 3188 NH1 ARG D 91 39.078 0.380 27.895 1.00 32.11 N ATOM 3189 NH2 ARG D 91 38.537 2.539 27.337 1.00 32.31 N ATOM 0 H ARG D 91 38.955 2.563 32.723 1.00 29.06 H new ATOM 0 HA ARG D 91 37.924 0.275 33.453 1.00 28.64 H new ATOM 0 HB2 ARG D 91 38.958 1.206 31.045 1.00 28.76 H new ATOM 0 HB3 ARG D 91 38.956 -0.346 31.198 1.00 28.76 H new ATOM 0 HG2 ARG D 91 36.595 -0.272 31.585 1.00 26.86 H new ATOM 0 HG3 ARG D 91 36.624 1.268 31.338 1.00 26.86 H new ATOM 0 HD2 ARG D 91 37.379 -0.567 29.316 1.00 27.45 H new ATOM 0 HD3 ARG D 91 35.919 -0.031 29.425 1.00 27.45 H new ATOM 0 HE ARG D 91 36.713 2.057 28.859 1.00 30.80 H new ATOM 0 HH11 ARG D 91 38.911 -0.341 28.334 1.00 32.11 H new ATOM 0 HH12 ARG D 91 39.766 0.421 27.380 1.00 32.11 H new ATOM 0 HH21 ARG D 91 38.018 3.220 27.414 1.00 32.31 H new ATOM 0 HH22 ARG D 91 39.225 2.579 26.822 1.00 32.31 H new ATOM 3190 N GLU D 92 41.119 0.347 33.298 1.00 30.18 N ATOM 3191 CA GLU D 92 42.310 -0.368 33.735 1.00 32.48 C ATOM 3192 C GLU D 92 42.277 -0.616 35.242 1.00 31.94 C ATOM 3193 O GLU D 92 42.647 -1.694 35.703 1.00 32.26 O ATOM 3194 CB GLU D 92 43.574 0.413 33.372 1.00 32.86 C ATOM 3195 CG GLU D 92 43.711 0.697 31.887 1.00 35.38 C ATOM 3196 CD GLU D 92 44.943 1.513 31.563 1.00 37.77 C ATOM 3197 OE1 GLU D 92 45.328 2.358 32.398 1.00 39.16 O ATOM 3198 OE2 GLU D 92 45.518 1.323 30.469 1.00 39.23 O ATOM 0 H GLU D 92 41.263 1.113 32.934 1.00 30.18 H new ATOM 0 HA GLU D 92 42.323 -1.223 33.277 1.00 32.48 H new ATOM 0 HB2 GLU D 92 43.575 1.254 33.855 1.00 32.86 H new ATOM 0 HB3 GLU D 92 44.350 -0.087 33.671 1.00 32.86 H new ATOM 0 HG2 GLU D 92 43.746 -0.143 31.402 1.00 35.38 H new ATOM 0 HG3 GLU D 92 42.923 1.170 31.577 1.00 35.38 H new ATOM 3199 N ASP D 93 41.835 0.379 36.008 1.00 31.65 N ATOM 3200 CA ASP D 93 41.769 0.238 37.460 1.00 32.23 C ATOM 3201 C ASP D 93 40.717 -0.785 37.850 1.00 32.32 C ATOM 3202 O ASP D 93 40.935 -1.613 38.732 1.00 34.00 O ATOM 3203 CB ASP D 93 41.446 1.583 38.123 1.00 32.42 C ATOM 3204 CG ASP D 93 42.620 2.555 38.089 1.00 34.43 C ATOM 3205 OD1 ASP D 93 42.434 3.713 38.511 1.00 34.41 O ATOM 3206 OD2 ASP D 93 43.726 2.170 37.649 1.00 34.35 O ATOM 0 H ASP D 93 41.570 1.140 35.708 1.00 31.65 H new ATOM 0 HA ASP D 93 42.637 -0.065 37.769 1.00 32.23 H new ATOM 0 HB2 ASP D 93 40.685 1.985 37.675 1.00 32.42 H new ATOM 0 HB3 ASP D 93 41.185 1.430 39.045 1.00 32.42 H new ATOM 3207 N LEU D 94 39.568 -0.725 37.188 1.00 32.73 N ATOM 3208 CA LEU D 94 38.490 -1.656 37.470 1.00 31.57 C ATOM 3209 C LEU D 94 38.969 -3.073 37.204 1.00 31.14 C ATOM 3210 O LEU D 94 38.761 -3.979 38.016 1.00 30.44 O ATOM 3211 CB LEU D 94 37.276 -1.349 36.588 1.00 33.81 C ATOM 3212 CG LEU D 94 36.103 -2.335 36.650 1.00 34.94 C ATOM 3213 CD1 LEU D 94 35.649 -2.519 38.096 1.00 35.28 C ATOM 3214 CD2 LEU D 94 34.957 -1.815 35.788 1.00 35.31 C ATOM 0 H LEU D 94 39.394 -0.151 36.571 1.00 32.73 H new ATOM 0 HA LEU D 94 38.229 -1.566 38.400 1.00 31.57 H new ATOM 0 HB2 LEU D 94 36.944 -0.470 36.828 1.00 33.81 H new ATOM 0 HB3 LEU D 94 37.578 -1.297 35.668 1.00 33.81 H new ATOM 0 HG LEU D 94 36.387 -3.198 36.309 1.00 34.94 H new ATOM 0 HD11 LEU D 94 34.907 -3.144 38.126 1.00 35.28 H new ATOM 0 HD12 LEU D 94 36.385 -2.866 38.625 1.00 35.28 H new ATOM 0 HD13 LEU D 94 35.366 -1.665 38.458 1.00 35.28 H new ATOM 0 HD21 LEU D 94 34.214 -2.438 35.826 1.00 35.31 H new ATOM 0 HD22 LEU D 94 34.670 -0.950 36.119 1.00 35.31 H new ATOM 0 HD23 LEU D 94 35.257 -1.726 34.870 1.00 35.31 H new ATOM 3215 N ILE D 95 39.624 -3.263 36.065 1.00 28.12 N ATOM 3216 CA ILE D 95 40.110 -4.587 35.704 1.00 27.38 C ATOM 3217 C ILE D 95 41.154 -5.100 36.699 1.00 27.42 C ATOM 3218 O ILE D 95 41.187 -6.287 37.018 1.00 26.80 O ATOM 3219 CB ILE D 95 40.677 -4.580 34.271 1.00 26.38 C ATOM 3220 CG1 ILE D 95 39.535 -4.314 33.278 1.00 27.42 C ATOM 3221 CG2 ILE D 95 41.354 -5.900 33.969 1.00 25.98 C ATOM 3222 CD1 ILE D 95 39.962 -4.235 31.838 1.00 29.24 C ATOM 0 H ILE D 95 39.796 -2.645 35.492 1.00 28.12 H new ATOM 0 HA ILE D 95 39.356 -5.196 35.738 1.00 27.38 H new ATOM 0 HB ILE D 95 41.340 -3.877 34.187 1.00 26.38 H new ATOM 0 HG12 ILE D 95 38.873 -5.017 33.369 1.00 27.42 H new ATOM 0 HG13 ILE D 95 39.099 -3.482 33.520 1.00 27.42 H new ATOM 0 HG21 ILE D 95 41.707 -5.884 33.065 1.00 25.98 H new ATOM 0 HG22 ILE D 95 42.080 -6.043 34.596 1.00 25.98 H new ATOM 0 HG23 ILE D 95 40.710 -6.621 34.051 1.00 25.98 H new ATOM 0 HD11 ILE D 95 39.187 -4.066 31.279 1.00 29.24 H new ATOM 0 HD12 ILE D 95 40.602 -3.514 31.729 1.00 29.24 H new ATOM 0 HD13 ILE D 95 40.372 -5.074 31.575 1.00 29.24 H new ATOM 3223 N ALA D 96 41.997 -4.206 37.199 1.00 28.28 N ATOM 3224 CA ALA D 96 43.008 -4.619 38.168 1.00 29.82 C ATOM 3225 C ALA D 96 42.282 -5.150 39.405 1.00 30.95 C ATOM 3226 O ALA D 96 42.654 -6.182 39.968 1.00 31.62 O ATOM 3227 CB ALA D 96 43.902 -3.437 38.534 1.00 27.25 C ATOM 0 H ALA D 96 42.003 -3.370 36.997 1.00 28.28 H new ATOM 0 HA ALA D 96 43.575 -5.311 37.793 1.00 29.82 H new ATOM 0 HB1 ALA D 96 44.569 -3.723 39.178 1.00 27.25 H new ATOM 0 HB2 ALA D 96 44.344 -3.106 37.736 1.00 27.25 H new ATOM 0 HB3 ALA D 96 43.362 -2.730 38.921 1.00 27.25 H new ATOM 3228 N TYR D 97 41.234 -4.448 39.828 1.00 31.95 N ATOM 3229 CA TYR D 97 40.479 -4.893 40.990 1.00 32.72 C ATOM 3230 C TYR D 97 39.904 -6.279 40.725 1.00 33.58 C ATOM 3231 O TYR D 97 40.010 -7.181 41.559 1.00 33.78 O ATOM 3232 CB TYR D 97 39.330 -3.931 41.306 1.00 33.34 C ATOM 3233 CG TYR D 97 38.346 -4.508 42.301 1.00 35.80 C ATOM 3234 CD1 TYR D 97 38.714 -4.727 43.630 1.00 34.28 C ATOM 3235 CD2 TYR D 97 37.062 -4.884 41.903 1.00 36.26 C ATOM 3236 CE1 TYR D 97 37.830 -5.309 44.538 1.00 34.46 C ATOM 3237 CE2 TYR D 97 36.170 -5.469 42.806 1.00 36.87 C ATOM 3238 CZ TYR D 97 36.562 -5.678 44.122 1.00 36.01 C ATOM 3239 OH TYR D 97 35.688 -6.260 45.016 1.00 37.25 O ATOM 0 H TYR D 97 40.949 -3.724 39.462 1.00 31.95 H new ATOM 0 HA TYR D 97 41.082 -4.917 41.749 1.00 32.72 H new ATOM 0 HB2 TYR D 97 39.693 -3.103 41.658 1.00 33.34 H new ATOM 0 HB3 TYR D 97 38.863 -3.710 40.485 1.00 33.34 H new ATOM 0 HD1 TYR D 97 39.564 -4.480 43.915 1.00 34.28 H new ATOM 0 HD2 TYR D 97 36.796 -4.743 41.023 1.00 36.26 H new ATOM 0 HE1 TYR D 97 38.091 -5.449 45.420 1.00 34.46 H new ATOM 0 HE2 TYR D 97 35.318 -5.717 42.527 1.00 36.87 H new ATOM 0 HH TYR D 97 34.962 -6.429 44.629 1.00 37.25 H new ATOM 3240 N LEU D 98 39.287 -6.441 39.558 1.00 33.43 N ATOM 3241 CA LEU D 98 38.681 -7.712 39.190 1.00 32.35 C ATOM 3242 C LEU D 98 39.688 -8.850 39.142 1.00 31.64 C ATOM 3243 O LEU D 98 39.390 -9.968 39.563 1.00 32.13 O ATOM 3244 CB LEU D 98 37.972 -7.598 37.832 1.00 32.76 C ATOM 3245 CG LEU D 98 36.653 -6.823 37.740 1.00 31.47 C ATOM 3246 CD1 LEU D 98 36.194 -6.806 36.297 1.00 34.12 C ATOM 3247 CD2 LEU D 98 35.594 -7.463 38.617 1.00 32.60 C ATOM 0 H LEU D 98 39.209 -5.824 38.964 1.00 33.43 H new ATOM 0 HA LEU D 98 38.035 -7.920 39.883 1.00 32.35 H new ATOM 0 HB2 LEU D 98 38.595 -7.189 37.211 1.00 32.76 H new ATOM 0 HB3 LEU D 98 37.804 -8.499 37.514 1.00 32.76 H new ATOM 0 HG LEU D 98 36.792 -5.915 38.052 1.00 31.47 H new ATOM 0 HD11 LEU D 98 35.359 -6.317 36.229 1.00 34.12 H new ATOM 0 HD12 LEU D 98 36.867 -6.374 35.748 1.00 34.12 H new ATOM 0 HD13 LEU D 98 36.062 -7.716 35.989 1.00 34.12 H new ATOM 0 HD21 LEU D 98 34.768 -6.960 38.546 1.00 32.60 H new ATOM 0 HD22 LEU D 98 35.442 -8.376 38.327 1.00 32.60 H new ATOM 0 HD23 LEU D 98 35.894 -7.463 39.539 1.00 32.60 H new ATOM 3248 N LYS D 99 40.877 -8.577 38.620 1.00 31.54 N ATOM 3249 CA LYS D 99 41.892 -9.616 38.526 1.00 33.21 C ATOM 3250 C LYS D 99 42.204 -10.173 39.911 1.00 33.49 C ATOM 3251 O LYS D 99 42.456 -11.367 40.073 1.00 34.19 O ATOM 3252 CB LYS D 99 43.163 -9.060 37.892 1.00 33.06 C ATOM 3253 CG LYS D 99 44.164 -10.128 37.508 1.00 34.52 C ATOM 3254 CD LYS D 99 45.325 -9.524 36.736 1.00 36.78 C ATOM 3255 CE LYS D 99 46.289 -10.591 36.243 1.00 37.74 C ATOM 3256 NZ LYS D 99 47.423 -9.966 35.520 1.00 41.22 N ATOM 0 H LYS D 99 41.114 -7.807 38.318 1.00 31.54 H new ATOM 0 HA LYS D 99 41.550 -10.331 37.967 1.00 33.21 H new ATOM 0 HB2 LYS D 99 42.925 -8.551 37.101 1.00 33.06 H new ATOM 0 HB3 LYS D 99 43.582 -8.443 38.512 1.00 33.06 H new ATOM 0 HG2 LYS D 99 44.495 -10.569 38.306 1.00 34.52 H new ATOM 0 HG3 LYS D 99 43.729 -10.806 36.968 1.00 34.52 H new ATOM 0 HD2 LYS D 99 44.984 -9.021 35.980 1.00 36.78 H new ATOM 0 HD3 LYS D 99 45.799 -8.896 37.303 1.00 36.78 H new ATOM 0 HE2 LYS D 99 46.621 -11.107 36.994 1.00 37.74 H new ATOM 0 HE3 LYS D 99 45.825 -11.209 35.657 1.00 37.74 H new ATOM 0 HZ1 LYS D 99 47.980 -10.600 35.236 1.00 41.22 H new ATOM 0 HZ2 LYS D 99 47.114 -9.509 34.822 1.00 41.22 H new ATOM 0 HZ3 LYS D 99 47.856 -9.414 36.067 1.00 41.22 H new ATOM 3257 N LYS D 100 42.169 -9.298 40.906 1.00 33.25 N ATOM 3258 CA LYS D 100 42.449 -9.673 42.285 1.00 35.31 C ATOM 3259 C LYS D 100 41.249 -10.323 42.961 1.00 35.31 C ATOM 3260 O LYS D 100 41.322 -11.468 43.403 1.00 36.05 O ATOM 3261 CB LYS D 100 42.874 -8.429 43.072 1.00 37.50 C ATOM 3262 CG LYS D 100 43.006 -8.620 44.575 1.00 40.93 C ATOM 3263 CD LYS D 100 43.504 -7.332 45.213 1.00 42.52 C ATOM 3264 CE LYS D 100 43.662 -7.456 46.719 1.00 44.89 C ATOM 3265 NZ LYS D 100 44.277 -6.218 47.284 1.00 44.64 N ATOM 0 H LYS D 100 41.981 -8.465 40.800 1.00 33.25 H new ATOM 0 HA LYS D 100 43.165 -10.328 42.274 1.00 35.31 H new ATOM 0 HB2 LYS D 100 43.726 -8.121 42.725 1.00 37.50 H new ATOM 0 HB3 LYS D 100 42.228 -7.724 42.907 1.00 37.50 H new ATOM 0 HG2 LYS D 100 42.149 -8.869 44.955 1.00 40.93 H new ATOM 0 HG3 LYS D 100 43.622 -9.345 44.765 1.00 40.93 H new ATOM 0 HD2 LYS D 100 44.356 -7.088 44.820 1.00 42.52 H new ATOM 0 HD3 LYS D 100 42.883 -6.614 45.013 1.00 42.52 H new ATOM 0 HE2 LYS D 100 42.796 -7.610 47.129 1.00 44.89 H new ATOM 0 HE3 LYS D 100 44.216 -8.224 46.929 1.00 44.89 H new ATOM 0 HZ1 LYS D 100 44.363 -6.305 48.166 1.00 44.64 H new ATOM 0 HZ2 LYS D 100 45.079 -6.091 46.919 1.00 44.64 H new ATOM 0 HZ3 LYS D 100 43.756 -5.519 47.105 1.00 44.64 H new ATOM 3266 N ALA D 101 40.141 -9.591 43.022 1.00 36.04 N ATOM 3267 CA ALA D 101 38.921 -10.069 43.667 1.00 35.13 C ATOM 3268 C ALA D 101 38.329 -11.359 43.103 1.00 36.41 C ATOM 3269 O ALA D 101 37.790 -12.169 43.857 1.00 37.18 O ATOM 3270 CB ALA D 101 37.864 -8.971 43.648 1.00 35.76 C ATOM 0 H ALA D 101 40.075 -8.801 42.690 1.00 36.04 H new ATOM 0 HA ALA D 101 39.191 -10.292 44.572 1.00 35.13 H new ATOM 0 HB1 ALA D 101 37.056 -9.292 44.077 1.00 35.76 H new ATOM 0 HB2 ALA D 101 38.196 -8.194 44.125 1.00 35.76 H new ATOM 0 HB3 ALA D 101 37.667 -8.727 42.730 1.00 35.76 H new ATOM 3271 N THR D 102 38.410 -11.558 41.791 1.00 35.62 N ATOM 3272 CA THR D 102 37.845 -12.771 41.208 1.00 37.33 C ATOM 3273 C THR D 102 38.787 -13.962 41.314 1.00 38.49 C ATOM 3274 O THR D 102 38.458 -15.060 40.868 1.00 35.91 O ATOM 3275 CB THR D 102 37.451 -12.570 39.721 1.00 37.36 C ATOM 3276 OG1 THR D 102 38.614 -12.267 38.944 1.00 36.42 O ATOM 3277 CG2 THR D 102 36.442 -11.438 39.589 1.00 36.76 C ATOM 0 H THR D 102 38.778 -11.018 41.232 1.00 35.62 H new ATOM 0 HA THR D 102 37.048 -12.960 41.727 1.00 37.33 H new ATOM 0 HB THR D 102 37.050 -13.391 39.394 1.00 37.36 H new ATOM 0 HG1 THR D 102 38.784 -11.446 39.002 1.00 36.42 H new ATOM 0 HG21 THR D 102 36.205 -11.323 38.656 1.00 36.76 H new ATOM 0 HG22 THR D 102 35.646 -11.652 40.101 1.00 36.76 H new ATOM 0 HG23 THR D 102 36.831 -10.616 39.927 1.00 36.76 H new ATOM 3278 N ASN D 103 39.959 -13.747 41.902 1.00 41.82 N ATOM 3279 CA ASN D 103 40.917 -14.832 42.069 1.00 46.22 C ATOM 3280 C ASN D 103 41.162 -15.091 43.554 1.00 49.97 C ATOM 3281 O ASN D 103 41.799 -16.078 43.920 1.00 51.33 O ATOM 3282 CB ASN D 103 42.238 -14.507 41.363 1.00 45.90 C ATOM 3283 CG ASN D 103 43.184 -15.699 41.318 1.00 47.24 C ATOM 3284 OD1 ASN D 103 42.834 -16.769 40.814 1.00 46.84 O ATOM 3285 ND2 ASN D 103 44.387 -15.518 41.843 1.00 45.46 N ATOM 0 H ASN D 103 40.217 -12.986 42.209 1.00 41.82 H new ATOM 0 HA ASN D 103 40.546 -15.632 41.665 1.00 46.22 H new ATOM 0 HB2 ASN D 103 42.053 -14.210 40.458 1.00 45.90 H new ATOM 0 HB3 ASN D 103 42.673 -13.770 41.820 1.00 45.90 H new ATOM 0 HD21 ASN D 103 44.958 -16.161 41.841 1.00 45.46 H new ATOM 0 HD22 ASN D 103 44.597 -14.758 42.186 1.00 45.46 H new ATOM 3286 N GLU D 104 40.655 -14.201 44.406 1.00 52.77 N ATOM 3287 CA GLU D 104 40.803 -14.351 45.851 1.00 55.38 C ATOM 3288 C GLU D 104 39.804 -15.380 46.358 1.00 56.34 C ATOM 3289 O GLU D 104 38.597 -15.052 46.385 1.00 56.65 O ATOM 3290 CB GLU D 104 40.553 -13.027 46.574 1.00 56.47 C ATOM 3291 CG GLU D 104 41.589 -11.959 46.307 1.00 59.38 C ATOM 3292 CD GLU D 104 41.346 -10.706 47.121 1.00 60.37 C ATOM 3293 OE1 GLU D 104 40.211 -10.181 47.081 1.00 61.52 O ATOM 3294 OE2 GLU D 104 42.291 -10.245 47.797 1.00 61.29 O ATOM 3295 OXT GLU D 104 40.239 -16.498 46.710 1.00 58.12 O ATOM 0 H GLU D 104 40.220 -13.500 44.165 1.00 52.77 H new ATOM 0 HA GLU D 104 41.711 -14.639 46.032 1.00 55.38 H new ATOM 0 HB2 GLU D 104 39.682 -12.689 46.313 1.00 56.47 H new ATOM 0 HB3 GLU D 104 40.517 -13.195 47.529 1.00 56.47 H new ATOM 0 HG2 GLU D 104 42.471 -12.309 46.511 1.00 59.38 H new ATOM 0 HG3 GLU D 104 41.584 -11.735 45.363 1.00 59.38 H new TER 3296 GLU D 104 ATOM 3297 N GLY E 1 -8.764 17.146 2.492 1.00 41.06 N ATOM 3298 CA GLY E 1 -7.304 17.117 2.194 1.00 38.69 C ATOM 3299 C GLY E 1 -7.038 17.235 0.707 1.00 37.82 C ATOM 3300 O GLY E 1 -7.886 16.875 -0.104 1.00 39.28 O ATOM 0 H1 GLY E 1 -8.977 17.928 2.859 1.00 41.06 H new ATOM 0 H2 GLY E 1 -9.223 17.038 1.737 1.00 41.06 H new ATOM 0 H3 GLY E 1 -8.965 16.489 3.057 1.00 41.06 H new ATOM 0 HA2 GLY E 1 -6.863 17.843 2.661 1.00 38.69 H new ATOM 0 HA3 GLY E 1 -6.921 16.291 2.528 1.00 38.69 H new ATOM 3301 N ASP E 2 -5.858 17.727 0.346 1.00 36.55 N ATOM 3302 CA ASP E 2 -5.500 17.903 -1.059 1.00 36.17 C ATOM 3303 C ASP E 2 -4.940 16.618 -1.673 1.00 35.23 C ATOM 3304 O ASP E 2 -3.770 16.283 -1.485 1.00 33.60 O ATOM 3305 CB ASP E 2 -4.483 19.039 -1.186 1.00 37.00 C ATOM 3306 CG ASP E 2 -4.287 19.490 -2.616 1.00 38.53 C ATOM 3307 OD1 ASP E 2 -3.877 18.664 -3.460 1.00 36.98 O ATOM 3308 OD2 ASP E 2 -4.544 20.681 -2.892 1.00 43.17 O ATOM 0 H ASP E 2 -5.247 17.967 0.902 1.00 36.55 H new ATOM 0 HA ASP E 2 -6.306 18.127 -1.549 1.00 36.17 H new ATOM 0 HB2 ASP E 2 -4.777 19.793 -0.651 1.00 37.00 H new ATOM 0 HB3 ASP E 2 -3.632 18.748 -0.823 1.00 37.00 H new ATOM 3309 N VAL E 3 -5.791 15.907 -2.409 1.00 35.88 N ATOM 3310 CA VAL E 3 -5.434 14.646 -3.057 1.00 35.81 C ATOM 3311 C VAL E 3 -4.245 14.767 -4.003 1.00 36.50 C ATOM 3312 O VAL E 3 -3.384 13.887 -4.047 1.00 34.07 O ATOM 3313 CB VAL E 3 -6.632 14.084 -3.865 1.00 37.68 C ATOM 3314 CG1 VAL E 3 -6.193 12.874 -4.693 1.00 37.35 C ATOM 3315 CG2 VAL E 3 -7.761 13.697 -2.922 1.00 36.25 C ATOM 0 H VAL E 3 -6.605 16.147 -2.548 1.00 35.88 H new ATOM 0 HA VAL E 3 -5.189 14.047 -2.335 1.00 35.81 H new ATOM 0 HB VAL E 3 -6.952 14.772 -4.470 1.00 37.68 H new ATOM 0 HG11 VAL E 3 -6.950 12.532 -5.193 1.00 37.35 H new ATOM 0 HG12 VAL E 3 -5.493 13.140 -5.309 1.00 37.35 H new ATOM 0 HG13 VAL E 3 -5.857 12.182 -4.102 1.00 37.35 H new ATOM 0 HG21 VAL E 3 -8.506 13.347 -3.435 1.00 36.25 H new ATOM 0 HG22 VAL E 3 -7.448 13.019 -2.303 1.00 36.25 H new ATOM 0 HG23 VAL E 3 -8.050 14.478 -2.425 1.00 36.25 H new ATOM 3316 N GLU E 4 -4.210 15.853 -4.766 1.00 36.74 N ATOM 3317 CA GLU E 4 -3.136 16.070 -5.720 1.00 38.77 C ATOM 3318 C GLU E 4 -1.791 16.153 -5.001 1.00 38.73 C ATOM 3319 O GLU E 4 -0.799 15.576 -5.446 1.00 37.61 O ATOM 3320 CB GLU E 4 -3.384 17.353 -6.499 1.00 40.85 C ATOM 3321 CG GLU E 4 -2.709 17.359 -7.847 1.00 47.61 C ATOM 3322 CD GLU E 4 -3.418 16.468 -8.851 1.00 50.64 C ATOM 3323 OE1 GLU E 4 -3.613 15.267 -8.559 1.00 51.21 O ATOM 3324 OE2 GLU E 4 -3.780 16.975 -9.937 1.00 53.17 O ATOM 0 H GLU E 4 -4.801 16.477 -4.745 1.00 36.74 H new ATOM 0 HA GLU E 4 -3.114 15.321 -6.336 1.00 38.77 H new ATOM 0 HB2 GLU E 4 -4.339 17.473 -6.620 1.00 40.85 H new ATOM 0 HB3 GLU E 4 -3.066 18.108 -5.980 1.00 40.85 H new ATOM 0 HG2 GLU E 4 -2.680 18.267 -8.188 1.00 47.61 H new ATOM 0 HG3 GLU E 4 -1.790 17.064 -7.748 1.00 47.61 H new ATOM 3325 N LYS E 5 -1.762 16.888 -3.893 1.00 38.70 N ATOM 3326 CA LYS E 5 -0.547 17.012 -3.102 1.00 37.25 C ATOM 3327 C LYS E 5 -0.293 15.645 -2.464 1.00 36.83 C ATOM 3328 O LYS E 5 0.852 15.186 -2.369 1.00 35.58 O ATOM 3329 CB LYS E 5 -0.732 18.058 -2.007 1.00 37.56 C ATOM 3330 CG LYS E 5 -0.908 19.477 -2.504 1.00 38.45 C ATOM 3331 CD LYS E 5 -1.054 20.415 -1.323 1.00 38.81 C ATOM 3332 CE LYS E 5 -0.990 21.863 -1.745 1.00 38.48 C ATOM 3333 NZ LYS E 5 -1.139 22.748 -0.560 1.00 38.10 N ATOM 0 H LYS E 5 -2.437 17.322 -3.584 1.00 38.70 H new ATOM 0 HA LYS E 5 0.198 17.288 -3.659 1.00 37.25 H new ATOM 0 HB2 LYS E 5 -1.507 17.817 -1.475 1.00 37.56 H new ATOM 0 HB3 LYS E 5 0.037 18.029 -1.417 1.00 37.56 H new ATOM 0 HG2 LYS E 5 -0.145 19.738 -3.043 1.00 38.45 H new ATOM 0 HG3 LYS E 5 -1.691 19.535 -3.074 1.00 38.45 H new ATOM 0 HD2 LYS E 5 -1.899 20.245 -0.878 1.00 38.81 H new ATOM 0 HD3 LYS E 5 -0.352 20.235 -0.678 1.00 38.81 H new ATOM 0 HE2 LYS E 5 -0.145 22.041 -2.187 1.00 38.48 H new ATOM 0 HE3 LYS E 5 -1.691 22.051 -2.388 1.00 38.48 H new ATOM 0 HZ1 LYS E 5 -1.564 23.493 -0.797 1.00 38.10 H new ATOM 0 HZ2 LYS E 5 -1.608 22.327 0.068 1.00 38.10 H new ATOM 0 HZ3 LYS E 5 -0.334 22.955 -0.241 1.00 38.10 H new ATOM 3334 N GLY E 6 -1.379 15.008 -2.033 1.00 35.33 N ATOM 3335 CA GLY E 6 -1.295 13.699 -1.415 1.00 35.30 C ATOM 3336 C GLY E 6 -0.618 12.696 -2.328 1.00 36.09 C ATOM 3337 O GLY E 6 0.185 11.879 -1.871 1.00 35.20 O ATOM 0 H GLY E 6 -2.177 15.323 -2.092 1.00 35.33 H new ATOM 0 HA2 GLY E 6 -0.802 13.764 -0.582 1.00 35.30 H new ATOM 0 HA3 GLY E 6 -2.186 13.387 -1.194 1.00 35.30 H new ATOM 3338 N LYS E 7 -0.922 12.762 -3.623 1.00 36.90 N ATOM 3339 CA LYS E 7 -0.316 11.838 -4.574 1.00 36.54 C ATOM 3340 C LYS E 7 1.187 12.056 -4.640 1.00 35.48 C ATOM 3341 O LYS E 7 1.960 11.099 -4.755 1.00 34.25 O ATOM 3342 CB LYS E 7 -0.918 12.016 -5.971 1.00 38.33 C ATOM 3343 CG LYS E 7 -0.375 11.016 -6.994 1.00 40.48 C ATOM 3344 CD LYS E 7 -1.096 11.115 -8.341 1.00 43.64 C ATOM 3345 CE LYS E 7 -0.927 12.493 -8.972 1.00 46.59 C ATOM 3346 NZ LYS E 7 -1.640 12.606 -10.284 1.00 49.82 N ATOM 0 H LYS E 7 -1.471 13.328 -3.967 1.00 36.90 H new ATOM 0 HA LYS E 7 -0.498 10.936 -4.268 1.00 36.54 H new ATOM 0 HB2 LYS E 7 -1.882 11.922 -5.916 1.00 38.33 H new ATOM 0 HB3 LYS E 7 -0.738 12.917 -6.282 1.00 38.33 H new ATOM 0 HG2 LYS E 7 0.573 11.173 -7.125 1.00 40.48 H new ATOM 0 HG3 LYS E 7 -0.468 10.116 -6.645 1.00 40.48 H new ATOM 0 HD2 LYS E 7 -0.750 10.438 -8.944 1.00 43.64 H new ATOM 0 HD3 LYS E 7 -2.040 10.929 -8.217 1.00 43.64 H new ATOM 0 HE2 LYS E 7 -1.264 13.169 -8.363 1.00 46.59 H new ATOM 0 HE3 LYS E 7 0.017 12.674 -9.102 1.00 46.59 H new ATOM 0 HZ1 LYS E 7 -1.518 13.421 -10.619 1.00 49.82 H new ATOM 0 HZ2 LYS E 7 -1.316 12.001 -10.851 1.00 49.82 H new ATOM 0 HZ3 LYS E 7 -2.510 12.463 -10.163 1.00 49.82 H new ATOM 3347 N LYS E 8 1.598 13.317 -4.561 1.00 34.35 N ATOM 3348 CA LYS E 8 3.014 13.648 -4.611 1.00 35.15 C ATOM 3349 C LYS E 8 3.730 13.119 -3.375 1.00 32.75 C ATOM 3350 O LYS E 8 4.839 12.603 -3.467 1.00 31.50 O ATOM 3351 CB LYS E 8 3.213 15.162 -4.711 1.00 36.57 C ATOM 3352 CG LYS E 8 2.725 15.776 -6.017 1.00 42.89 C ATOM 3353 CD LYS E 8 2.969 17.282 -6.030 1.00 45.72 C ATOM 3354 CE LYS E 8 2.409 17.949 -7.286 1.00 48.81 C ATOM 3355 NZ LYS E 8 3.058 17.461 -8.536 1.00 49.72 N ATOM 0 H LYS E 8 1.073 13.993 -4.478 1.00 34.35 H new ATOM 0 HA LYS E 8 3.391 13.229 -5.400 1.00 35.15 H new ATOM 0 HB2 LYS E 8 2.749 15.588 -3.973 1.00 36.57 H new ATOM 0 HB3 LYS E 8 4.157 15.361 -4.605 1.00 36.57 H new ATOM 0 HG2 LYS E 8 3.184 15.363 -6.765 1.00 42.89 H new ATOM 0 HG3 LYS E 8 1.779 15.596 -6.130 1.00 42.89 H new ATOM 0 HD2 LYS E 8 2.561 17.681 -5.245 1.00 45.72 H new ATOM 0 HD3 LYS E 8 3.922 17.454 -5.972 1.00 45.72 H new ATOM 0 HE2 LYS E 8 1.454 17.785 -7.336 1.00 48.81 H new ATOM 0 HE3 LYS E 8 2.528 18.909 -7.218 1.00 48.81 H new ATOM 0 HZ1 LYS E 8 2.732 17.907 -9.234 1.00 49.72 H new ATOM 0 HZ2 LYS E 8 3.937 17.592 -8.485 1.00 49.72 H new ATOM 0 HZ3 LYS E 8 2.893 16.592 -8.637 1.00 49.72 H new ATOM 3356 N ILE E 9 3.097 13.251 -2.216 1.00 32.19 N ATOM 3357 CA ILE E 9 3.709 12.762 -0.990 1.00 30.85 C ATOM 3358 C ILE E 9 3.918 11.256 -1.081 1.00 29.08 C ATOM 3359 O ILE E 9 5.004 10.751 -0.789 1.00 29.31 O ATOM 3360 CB ILE E 9 2.848 13.101 0.237 1.00 31.37 C ATOM 3361 CG1 ILE E 9 2.821 14.620 0.431 1.00 30.63 C ATOM 3362 CG2 ILE E 9 3.419 12.426 1.480 1.00 32.35 C ATOM 3363 CD1 ILE E 9 2.000 15.088 1.623 1.00 33.85 C ATOM 0 H ILE E 9 2.324 13.615 -2.118 1.00 32.19 H new ATOM 0 HA ILE E 9 4.567 13.201 -0.884 1.00 30.85 H new ATOM 0 HB ILE E 9 1.945 12.777 0.096 1.00 31.37 H new ATOM 0 HG12 ILE E 9 3.732 14.938 0.535 1.00 30.63 H new ATOM 0 HG13 ILE E 9 2.467 15.031 -0.373 1.00 30.63 H new ATOM 0 HG21 ILE E 9 2.870 12.645 2.249 1.00 32.35 H new ATOM 0 HG22 ILE E 9 3.426 11.465 1.352 1.00 32.35 H new ATOM 0 HG23 ILE E 9 4.325 12.738 1.631 1.00 32.35 H new ATOM 0 HD11 ILE E 9 2.032 16.056 1.678 1.00 33.85 H new ATOM 0 HD12 ILE E 9 1.080 14.801 1.515 1.00 33.85 H new ATOM 0 HD13 ILE E 9 2.364 14.706 2.437 1.00 33.85 H new ATOM 3364 N PHE E 10 2.883 10.551 -1.524 1.00 28.99 N ATOM 3365 CA PHE E 10 2.929 9.100 -1.658 1.00 27.98 C ATOM 3366 C PHE E 10 4.010 8.625 -2.632 1.00 27.46 C ATOM 3367 O PHE E 10 4.654 7.603 -2.405 1.00 26.68 O ATOM 3368 CB PHE E 10 1.571 8.580 -2.124 1.00 26.39 C ATOM 3369 CG PHE E 10 1.505 7.087 -2.229 1.00 27.20 C ATOM 3370 CD1 PHE E 10 1.074 6.318 -1.148 1.00 25.25 C ATOM 3371 CD2 PHE E 10 1.913 6.445 -3.393 1.00 23.40 C ATOM 3372 CE1 PHE E 10 1.052 4.927 -1.224 1.00 23.17 C ATOM 3373 CE2 PHE E 10 1.898 5.062 -3.484 1.00 26.47 C ATOM 3374 CZ PHE E 10 1.463 4.294 -2.389 1.00 27.13 C ATOM 0 H PHE E 10 2.133 10.901 -1.756 1.00 28.99 H new ATOM 0 HA PHE E 10 3.150 8.745 -0.783 1.00 27.98 H new ATOM 0 HB2 PHE E 10 0.887 8.884 -1.507 1.00 26.39 H new ATOM 0 HB3 PHE E 10 1.364 8.967 -2.989 1.00 26.39 H new ATOM 0 HD1 PHE E 10 0.798 6.739 -0.366 1.00 25.25 H new ATOM 0 HD2 PHE E 10 2.200 6.950 -4.120 1.00 23.40 H new ATOM 0 HE1 PHE E 10 0.763 4.424 -0.497 1.00 23.17 H new ATOM 0 HE2 PHE E 10 2.175 4.643 -4.267 1.00 26.47 H new ATOM 0 HZ PHE E 10 1.451 3.366 -2.445 1.00 27.13 H new ATOM 3375 N VAL E 11 4.199 9.366 -3.720 1.00 29.46 N ATOM 3376 CA VAL E 11 5.197 9.013 -4.725 1.00 29.23 C ATOM 3377 C VAL E 11 6.605 9.084 -4.157 1.00 29.52 C ATOM 3378 O VAL E 11 7.448 8.234 -4.430 1.00 30.49 O ATOM 3379 CB VAL E 11 5.110 9.960 -5.954 1.00 30.70 C ATOM 3380 CG1 VAL E 11 6.347 9.786 -6.850 1.00 30.69 C ATOM 3381 CG2 VAL E 11 3.850 9.662 -6.746 1.00 27.38 C ATOM 0 H VAL E 11 3.756 10.082 -3.896 1.00 29.46 H new ATOM 0 HA VAL E 11 5.008 8.102 -5.000 1.00 29.23 H new ATOM 0 HB VAL E 11 5.080 10.878 -5.641 1.00 30.70 H new ATOM 0 HG11 VAL E 11 6.281 10.382 -7.613 1.00 30.69 H new ATOM 0 HG12 VAL E 11 7.146 9.998 -6.343 1.00 30.69 H new ATOM 0 HG13 VAL E 11 6.395 8.868 -7.160 1.00 30.69 H new ATOM 0 HG21 VAL E 11 3.801 10.256 -7.512 1.00 27.38 H new ATOM 0 HG22 VAL E 11 3.870 8.742 -7.052 1.00 27.38 H new ATOM 0 HG23 VAL E 11 3.073 9.798 -6.182 1.00 27.38 H new ATOM 3382 N GLN E 12 6.858 10.102 -3.351 1.00 30.70 N ATOM 3383 CA GLN E 12 8.178 10.274 -2.777 1.00 30.90 C ATOM 3384 C GLN E 12 8.485 9.433 -1.546 1.00 29.50 C ATOM 3385 O GLN E 12 9.620 8.982 -1.377 1.00 30.87 O ATOM 3386 CB GLN E 12 8.402 11.735 -2.415 1.00 32.56 C ATOM 3387 CG GLN E 12 9.789 12.015 -1.865 1.00 35.44 C ATOM 3388 CD GLN E 12 9.840 13.305 -1.081 1.00 37.69 C ATOM 3389 OE1 GLN E 12 9.243 14.307 -1.477 1.00 39.20 O ATOM 3390 NE2 GLN E 12 10.565 13.295 0.033 1.00 38.77 N ATOM 0 H GLN E 12 6.283 10.700 -3.125 1.00 30.70 H new ATOM 0 HA GLN E 12 8.779 9.965 -3.473 1.00 30.90 H new ATOM 0 HB2 GLN E 12 8.257 12.282 -3.203 1.00 32.56 H new ATOM 0 HB3 GLN E 12 7.741 12.003 -1.758 1.00 32.56 H new ATOM 0 HG2 GLN E 12 10.064 11.280 -1.294 1.00 35.44 H new ATOM 0 HG3 GLN E 12 10.423 12.058 -2.598 1.00 35.44 H new ATOM 0 HE21 GLN E 12 10.968 12.576 0.277 1.00 38.77 H new ATOM 0 HE22 GLN E 12 10.631 14.008 0.509 1.00 38.77 H new ATOM 3391 N LYS E 13 7.490 9.211 -0.694 1.00 29.97 N ATOM 3392 CA LYS E 13 7.726 8.477 0.552 1.00 29.88 C ATOM 3393 C LYS E 13 7.055 7.120 0.760 1.00 29.78 C ATOM 3394 O LYS E 13 7.359 6.439 1.739 1.00 30.41 O ATOM 3395 CB LYS E 13 7.358 9.372 1.745 1.00 31.30 C ATOM 3396 CG LYS E 13 7.975 10.774 1.726 1.00 30.04 C ATOM 3397 CD LYS E 13 7.613 11.558 2.990 1.00 30.14 C ATOM 3398 CE LYS E 13 8.214 12.965 2.952 1.00 32.28 C ATOM 3399 NZ LYS E 13 7.964 13.768 4.194 1.00 30.18 N ATOM 0 H LYS E 13 6.679 9.472 -0.813 1.00 29.97 H new ATOM 0 HA LYS E 13 8.668 8.258 0.482 1.00 29.88 H new ATOM 0 HB2 LYS E 13 6.393 9.460 1.779 1.00 31.30 H new ATOM 0 HB3 LYS E 13 7.631 8.926 2.562 1.00 31.30 H new ATOM 0 HG2 LYS E 13 8.940 10.704 1.651 1.00 30.04 H new ATOM 0 HG3 LYS E 13 7.664 11.256 0.944 1.00 30.04 H new ATOM 0 HD2 LYS E 13 6.648 11.617 3.073 1.00 30.14 H new ATOM 0 HD3 LYS E 13 7.937 11.085 3.772 1.00 30.14 H new ATOM 0 HE2 LYS E 13 9.171 12.894 2.811 1.00 32.28 H new ATOM 0 HE3 LYS E 13 7.849 13.442 2.190 1.00 32.28 H new ATOM 0 HZ1 LYS E 13 8.465 14.503 4.178 1.00 30.18 H new ATOM 0 HZ2 LYS E 13 7.105 13.996 4.232 1.00 30.18 H new ATOM 0 HZ3 LYS E 13 8.174 13.282 4.909 1.00 30.18 H new ATOM 3400 N CYS E 14 6.154 6.718 -0.131 1.00 28.71 N ATOM 3401 CA CYS E 14 5.462 5.449 0.052 1.00 28.59 C ATOM 3402 C CYS E 14 5.545 4.474 -1.114 1.00 29.40 C ATOM 3403 O CYS E 14 5.643 3.260 -0.905 1.00 31.69 O ATOM 3404 CB CYS E 14 3.979 5.699 0.354 1.00 30.02 C ATOM 3405 SG CYS E 14 3.635 6.973 1.604 1.00 29.48 S ATOM 0 H CYS E 14 5.932 7.157 -0.836 1.00 28.71 H new ATOM 0 HA CYS E 14 5.928 5.030 0.792 1.00 28.59 H new ATOM 0 HB2 CYS E 14 3.535 5.950 -0.471 1.00 30.02 H new ATOM 0 HB3 CYS E 14 3.580 4.865 0.648 1.00 30.02 H new ATOM 3406 N ALA E 15 5.486 5.000 -2.335 1.00 30.27 N ATOM 3407 CA ALA E 15 5.517 4.179 -3.547 1.00 29.66 C ATOM 3408 C ALA E 15 6.559 3.058 -3.554 1.00 29.98 C ATOM 3409 O ALA E 15 6.282 1.947 -4.003 1.00 29.33 O ATOM 3410 CB ALA E 15 5.713 5.074 -4.770 1.00 29.74 C ATOM 0 H ALA E 15 5.427 5.845 -2.486 1.00 30.27 H new ATOM 0 HA ALA E 15 4.659 3.728 -3.572 1.00 29.66 H new ATOM 0 HB1 ALA E 15 5.733 4.528 -5.571 1.00 29.74 H new ATOM 0 HB2 ALA E 15 4.980 5.707 -4.829 1.00 29.74 H new ATOM 0 HB3 ALA E 15 6.550 5.557 -4.687 1.00 29.74 H new ATOM 3411 N GLN E 16 7.756 3.352 -3.063 1.00 30.10 N ATOM 3412 CA GLN E 16 8.828 2.368 -3.030 1.00 33.12 C ATOM 3413 C GLN E 16 8.479 1.075 -2.286 1.00 32.76 C ATOM 3414 O GLN E 16 9.096 0.043 -2.525 1.00 34.46 O ATOM 3415 CB GLN E 16 10.088 2.981 -2.406 1.00 35.56 C ATOM 3416 CG GLN E 16 9.876 3.553 -1.013 1.00 42.32 C ATOM 3417 CD GLN E 16 9.722 5.069 -1.012 1.00 46.15 C ATOM 3418 OE1 GLN E 16 8.958 5.639 -1.808 1.00 47.59 O ATOM 3419 NE2 GLN E 16 10.446 5.732 -0.112 1.00 46.22 N ATOM 0 H GLN E 16 7.969 4.121 -2.742 1.00 30.10 H new ATOM 0 HA GLN E 16 8.980 2.121 -3.956 1.00 33.12 H new ATOM 0 HB2 GLN E 16 10.780 2.302 -2.365 1.00 35.56 H new ATOM 0 HB3 GLN E 16 10.416 3.685 -2.988 1.00 35.56 H new ATOM 0 HG2 GLN E 16 9.085 3.152 -0.621 1.00 42.32 H new ATOM 0 HG3 GLN E 16 10.627 3.308 -0.450 1.00 42.32 H new ATOM 0 HE21 GLN E 16 10.965 5.303 0.423 1.00 46.22 H new ATOM 0 HE22 GLN E 16 10.395 6.589 -0.066 1.00 46.22 H new ATOM 3420 N CYS E 17 7.503 1.119 -1.386 1.00 31.01 N ATOM 3421 CA CYS E 17 7.137 -0.086 -0.638 1.00 30.66 C ATOM 3422 C CYS E 17 5.675 -0.496 -0.753 1.00 31.31 C ATOM 3423 O CYS E 17 5.322 -1.620 -0.390 1.00 31.15 O ATOM 3424 CB CYS E 17 7.460 0.092 0.847 1.00 29.92 C ATOM 3425 SG CYS E 17 9.225 0.296 1.225 1.00 26.22 S ATOM 0 H CYS E 17 7.046 1.821 -1.193 1.00 31.01 H new ATOM 0 HA CYS E 17 7.664 -0.793 -1.043 1.00 30.66 H new ATOM 0 HB2 CYS E 17 6.980 0.867 1.179 1.00 29.92 H new ATOM 0 HB3 CYS E 17 7.125 -0.678 1.332 1.00 29.92 H new ATOM 3426 N HIS E 18 4.835 0.404 -1.261 1.00 31.19 N ATOM 3427 CA HIS E 18 3.400 0.139 -1.381 1.00 30.44 C ATOM 3428 C HIS E 18 2.771 0.486 -2.735 1.00 31.36 C ATOM 3429 O HIS E 18 3.138 1.480 -3.356 1.00 30.65 O ATOM 3430 CB HIS E 18 2.635 0.945 -0.321 1.00 27.91 C ATOM 3431 CG HIS E 18 2.942 0.561 1.096 1.00 27.66 C ATOM 3432 ND1 HIS E 18 2.497 -0.614 1.663 1.00 26.86 N ATOM 3433 CD2 HIS E 18 3.607 1.223 2.075 1.00 24.23 C ATOM 3434 CE1 HIS E 18 2.872 -0.658 2.930 1.00 28.77 C ATOM 3435 NE2 HIS E 18 3.546 0.444 3.205 1.00 25.97 N ATOM 0 H HIS E 18 5.077 1.179 -1.544 1.00 31.19 H new ATOM 0 HA HIS E 18 3.326 -0.821 -1.266 1.00 30.44 H new ATOM 0 HB2 HIS E 18 2.837 1.886 -0.440 1.00 27.91 H new ATOM 0 HB3 HIS E 18 1.683 0.837 -0.474 1.00 27.91 H new ATOM 0 HD1 HIS E 18 2.046 -1.223 1.256 1.00 26.86 H new ATOM 0 HD2 HIS E 18 4.026 2.050 1.996 1.00 24.23 H new ATOM 0 HE1 HIS E 18 2.692 -1.348 3.527 1.00 28.77 H new ATOM 3436 N THR E 19 1.815 -0.339 -3.167 1.00 32.02 N ATOM 3437 CA THR E 19 1.041 -0.095 -4.388 1.00 33.52 C ATOM 3438 C THR E 19 -0.363 0.188 -3.848 1.00 33.45 C ATOM 3439 O THR E 19 -0.675 -0.184 -2.714 1.00 35.23 O ATOM 3440 CB THR E 19 0.962 -1.327 -5.328 1.00 32.77 C ATOM 3441 OG1 THR E 19 0.331 -2.418 -4.645 1.00 33.45 O ATOM 3442 CG2 THR E 19 2.349 -1.739 -5.795 1.00 32.59 C ATOM 0 H THR E 19 1.595 -1.062 -2.756 1.00 32.02 H new ATOM 0 HA THR E 19 1.442 0.612 -4.917 1.00 33.52 H new ATOM 0 HB THR E 19 0.436 -1.088 -6.107 1.00 32.77 H new ATOM 0 HG1 THR E 19 0.864 -3.066 -4.599 1.00 33.45 H new ATOM 0 HG21 THR E 19 2.278 -2.509 -6.380 1.00 32.59 H new ATOM 0 HG22 THR E 19 2.760 -1.004 -6.277 1.00 32.59 H new ATOM 0 HG23 THR E 19 2.895 -1.967 -5.026 1.00 32.59 H new ATOM 3443 N VAL E 20 -1.208 0.836 -4.642 1.00 34.09 N ATOM 3444 CA VAL E 20 -2.557 1.168 -4.190 1.00 35.45 C ATOM 3445 C VAL E 20 -3.701 0.598 -5.039 1.00 37.68 C ATOM 3446 O VAL E 20 -4.808 0.369 -4.532 1.00 33.65 O ATOM 3447 CB VAL E 20 -2.735 2.695 -4.122 1.00 35.57 C ATOM 3448 CG1 VAL E 20 -1.892 3.275 -2.990 1.00 34.41 C ATOM 3449 CG2 VAL E 20 -2.325 3.316 -5.450 1.00 34.48 C ATOM 0 H VAL E 20 -1.023 1.092 -5.442 1.00 34.09 H new ATOM 0 HA VAL E 20 -2.623 0.749 -3.318 1.00 35.45 H new ATOM 0 HB VAL E 20 -3.667 2.898 -3.948 1.00 35.57 H new ATOM 0 HG11 VAL E 20 -2.012 4.237 -2.957 1.00 34.41 H new ATOM 0 HG12 VAL E 20 -2.171 2.886 -2.146 1.00 34.41 H new ATOM 0 HG13 VAL E 20 -0.956 3.072 -3.146 1.00 34.41 H new ATOM 0 HG21 VAL E 20 -2.438 4.278 -5.406 1.00 34.48 H new ATOM 0 HG22 VAL E 20 -1.395 3.108 -5.631 1.00 34.48 H new ATOM 0 HG23 VAL E 20 -2.881 2.958 -6.160 1.00 34.48 H new ATOM 3450 N GLU E 21 -3.429 0.374 -6.323 1.00 40.08 N ATOM 3451 CA GLU E 21 -4.432 -0.135 -7.258 1.00 42.45 C ATOM 3452 C GLU E 21 -4.965 -1.512 -6.899 1.00 43.71 C ATOM 3453 O GLU E 21 -4.253 -2.335 -6.323 1.00 41.98 O ATOM 3454 CB GLU E 21 -3.857 -0.198 -8.674 1.00 44.68 C ATOM 3455 CG GLU E 21 -2.638 0.681 -8.906 1.00 50.64 C ATOM 3456 CD GLU E 21 -1.386 0.129 -8.238 1.00 53.04 C ATOM 3457 OE1 GLU E 21 -0.983 -1.006 -8.582 1.00 53.68 O ATOM 3458 OE2 GLU E 21 -0.809 0.831 -7.374 1.00 52.38 O ATOM 0 H GLU E 21 -2.658 0.513 -6.677 1.00 40.08 H new ATOM 0 HA GLU E 21 -5.173 0.489 -7.206 1.00 42.45 H new ATOM 0 HB2 GLU E 21 -3.620 -1.117 -8.873 1.00 44.68 H new ATOM 0 HB3 GLU E 21 -4.550 0.059 -9.303 1.00 44.68 H new ATOM 0 HG2 GLU E 21 -2.481 0.767 -9.859 1.00 50.64 H new ATOM 0 HG3 GLU E 21 -2.816 1.572 -8.567 1.00 50.64 H new ATOM 3459 N LYS E 22 -6.224 -1.763 -7.251 1.00 45.01 N ATOM 3460 CA LYS E 22 -6.823 -3.059 -6.979 1.00 46.54 C ATOM 3461 C LYS E 22 -6.032 -4.058 -7.803 1.00 45.75 C ATOM 3462 O LYS E 22 -5.735 -3.807 -8.967 1.00 46.17 O ATOM 3463 CB LYS E 22 -8.294 -3.078 -7.401 1.00 49.89 C ATOM 3464 CG LYS E 22 -9.003 -4.398 -7.116 1.00 51.52 C ATOM 3465 CD LYS E 22 -10.483 -4.313 -7.459 1.00 54.60 C ATOM 3466 CE LYS E 22 -11.209 -5.608 -7.126 1.00 55.95 C ATOM 3467 NZ LYS E 22 -12.684 -5.477 -7.304 1.00 59.02 N ATOM 0 H LYS E 22 -6.741 -1.200 -7.645 1.00 45.01 H new ATOM 0 HA LYS E 22 -6.797 -3.267 -6.032 1.00 46.54 H new ATOM 0 HB2 LYS E 22 -8.762 -2.364 -6.941 1.00 49.89 H new ATOM 0 HB3 LYS E 22 -8.351 -2.889 -8.351 1.00 49.89 H new ATOM 0 HG2 LYS E 22 -8.589 -5.108 -7.631 1.00 51.52 H new ATOM 0 HG3 LYS E 22 -8.898 -4.629 -6.180 1.00 51.52 H new ATOM 0 HD2 LYS E 22 -10.888 -3.579 -6.970 1.00 54.60 H new ATOM 0 HD3 LYS E 22 -10.587 -4.116 -8.403 1.00 54.60 H new ATOM 0 HE2 LYS E 22 -10.877 -6.321 -7.694 1.00 55.95 H new ATOM 0 HE3 LYS E 22 -11.015 -5.861 -6.210 1.00 55.95 H new ATOM 0 HZ1 LYS E 22 -13.077 -6.249 -7.102 1.00 59.02 H new ATOM 0 HZ2 LYS E 22 -12.992 -4.838 -6.767 1.00 59.02 H new ATOM 0 HZ3 LYS E 22 -12.864 -5.266 -8.150 1.00 59.02 H new ATOM 3468 N GLY E 23 -5.684 -5.183 -7.193 1.00 45.41 N ATOM 3469 CA GLY E 23 -4.907 -6.187 -7.894 1.00 44.76 C ATOM 3470 C GLY E 23 -3.431 -5.846 -7.820 1.00 43.84 C ATOM 3471 O GLY E 23 -2.586 -6.577 -8.333 1.00 44.03 O ATOM 0 H GLY E 23 -5.887 -5.381 -6.381 1.00 45.41 H new ATOM 0 HA2 GLY E 23 -5.065 -7.060 -7.503 1.00 44.76 H new ATOM 0 HA3 GLY E 23 -5.189 -6.236 -8.821 1.00 44.76 H new ATOM 3472 N GLY E 24 -3.124 -4.725 -7.174 1.00 42.98 N ATOM 3473 CA GLY E 24 -1.744 -4.292 -7.041 1.00 41.46 C ATOM 3474 C GLY E 24 -0.876 -5.306 -6.326 1.00 40.83 C ATOM 3475 O GLY E 24 -1.340 -6.038 -5.448 1.00 40.56 O ATOM 0 H GLY E 24 -3.701 -4.204 -6.807 1.00 42.98 H new ATOM 0 HA2 GLY E 24 -1.376 -4.122 -7.922 1.00 41.46 H new ATOM 0 HA3 GLY E 24 -1.718 -3.452 -6.557 1.00 41.46 H new ATOM 3476 N LYS E 25 0.399 -5.336 -6.694 1.00 39.59 N ATOM 3477 CA LYS E 25 1.341 -6.275 -6.106 1.00 38.58 C ATOM 3478 C LYS E 25 1.846 -5.913 -4.717 1.00 37.76 C ATOM 3479 O LYS E 25 1.832 -4.749 -4.310 1.00 35.15 O ATOM 3480 CB LYS E 25 2.551 -6.445 -7.026 1.00 39.70 C ATOM 3481 CG LYS E 25 2.499 -7.688 -7.892 1.00 43.90 C ATOM 3482 CD LYS E 25 2.272 -8.937 -7.040 1.00 46.02 C ATOM 3483 CE LYS E 25 2.596 -10.214 -7.801 1.00 47.99 C ATOM 3484 NZ LYS E 25 4.054 -10.315 -8.103 1.00 48.16 N ATOM 0 H LYS E 25 0.740 -4.816 -7.288 1.00 39.59 H new ATOM 0 HA LYS E 25 0.835 -7.097 -6.007 1.00 38.58 H new ATOM 0 HB2 LYS E 25 2.622 -5.666 -7.599 1.00 39.70 H new ATOM 0 HB3 LYS E 25 3.356 -6.473 -6.485 1.00 39.70 H new ATOM 0 HG2 LYS E 25 1.786 -7.603 -8.544 1.00 43.90 H new ATOM 0 HG3 LYS E 25 3.328 -7.776 -8.388 1.00 43.90 H new ATOM 0 HD2 LYS E 25 2.823 -8.888 -6.243 1.00 46.02 H new ATOM 0 HD3 LYS E 25 1.348 -8.963 -6.745 1.00 46.02 H new ATOM 0 HE2 LYS E 25 2.318 -10.983 -7.279 1.00 47.99 H new ATOM 0 HE3 LYS E 25 2.091 -10.236 -8.629 1.00 47.99 H new ATOM 0 HZ1 LYS E 25 4.264 -11.163 -8.276 1.00 48.16 H new ATOM 0 HZ2 LYS E 25 4.246 -9.812 -8.812 1.00 48.16 H new ATOM 0 HZ3 LYS E 25 4.523 -10.031 -7.402 1.00 48.16 H new ATOM 3485 N HIS E 26 2.281 -6.934 -3.988 1.00 35.51 N ATOM 3486 CA HIS E 26 2.849 -6.725 -2.671 1.00 34.76 C ATOM 3487 C HIS E 26 4.332 -6.518 -2.934 1.00 33.73 C ATOM 3488 O HIS E 26 4.902 -7.177 -3.794 1.00 34.19 O ATOM 3489 CB HIS E 26 2.671 -7.959 -1.785 1.00 33.48 C ATOM 3490 CG HIS E 26 1.247 -8.267 -1.448 1.00 33.09 C ATOM 3491 ND1 HIS E 26 0.335 -7.293 -1.102 1.00 33.63 N ATOM 3492 CD2 HIS E 26 0.585 -9.445 -1.372 1.00 32.71 C ATOM 3493 CE1 HIS E 26 -0.826 -7.858 -0.827 1.00 31.32 C ATOM 3494 NE2 HIS E 26 -0.701 -9.163 -0.983 1.00 32.49 N ATOM 0 H HIS E 26 2.255 -7.755 -4.241 1.00 35.51 H new ATOM 0 HA HIS E 26 2.424 -5.983 -2.214 1.00 34.76 H new ATOM 0 HB2 HIS E 26 3.061 -8.726 -2.233 1.00 33.48 H new ATOM 0 HB3 HIS E 26 3.167 -7.829 -0.962 1.00 33.48 H new ATOM 0 HD2 HIS E 26 0.936 -10.288 -1.550 1.00 32.71 H new ATOM 0 HE1 HIS E 26 -1.600 -7.413 -0.568 1.00 31.32 H new ATOM 0 HE2 HIS E 26 -1.324 -9.743 -0.861 1.00 32.49 H new ATOM 3495 N LYS E 27 4.948 -5.591 -2.213 1.00 33.35 N ATOM 3496 CA LYS E 27 6.375 -5.330 -2.358 1.00 31.89 C ATOM 3497 C LYS E 27 6.939 -5.497 -0.952 1.00 31.67 C ATOM 3498 O LYS E 27 6.637 -6.492 -0.293 1.00 31.70 O ATOM 3499 CB LYS E 27 6.588 -3.914 -2.900 1.00 31.48 C ATOM 3500 CG LYS E 27 6.013 -3.754 -4.311 1.00 34.31 C ATOM 3501 CD LYS E 27 5.874 -2.306 -4.754 1.00 33.75 C ATOM 3502 CE LYS E 27 7.217 -1.628 -4.913 1.00 33.91 C ATOM 3503 NZ LYS E 27 7.046 -0.240 -5.414 1.00 33.92 N ATOM 0 H LYS E 27 4.554 -5.097 -1.629 1.00 33.35 H new ATOM 0 HA LYS E 27 6.815 -5.926 -2.984 1.00 31.89 H new ATOM 0 HB2 LYS E 27 6.168 -3.273 -2.305 1.00 31.48 H new ATOM 0 HB3 LYS E 27 7.536 -3.711 -2.912 1.00 31.48 H new ATOM 0 HG2 LYS E 27 6.584 -4.223 -4.939 1.00 34.31 H new ATOM 0 HG3 LYS E 27 5.142 -4.180 -4.347 1.00 34.31 H new ATOM 0 HD2 LYS E 27 5.394 -2.271 -5.596 1.00 33.75 H new ATOM 0 HD3 LYS E 27 5.343 -1.820 -4.104 1.00 33.75 H new ATOM 0 HE2 LYS E 27 7.681 -1.615 -4.061 1.00 33.91 H new ATOM 0 HE3 LYS E 27 7.769 -2.134 -5.529 1.00 33.91 H new ATOM 0 HZ1 LYS E 27 7.818 0.053 -5.747 1.00 33.92 H new ATOM 0 HZ2 LYS E 27 6.425 -0.229 -6.052 1.00 33.92 H new ATOM 0 HZ3 LYS E 27 6.793 0.288 -4.744 1.00 33.92 H new ATOM 3504 N THR E 28 7.752 -4.555 -0.485 1.00 31.31 N ATOM 3505 CA THR E 28 8.275 -4.661 0.874 1.00 30.51 C ATOM 3506 C THR E 28 7.044 -4.625 1.781 1.00 29.81 C ATOM 3507 O THR E 28 6.929 -5.407 2.739 1.00 27.53 O ATOM 3508 CB THR E 28 9.223 -3.483 1.214 1.00 31.18 C ATOM 3509 OG1 THR E 28 10.361 -3.524 0.344 1.00 30.68 O ATOM 3510 CG2 THR E 28 9.718 -3.581 2.662 1.00 31.09 C ATOM 0 H THR E 28 8.009 -3.862 -0.926 1.00 31.31 H new ATOM 0 HA THR E 28 8.797 -5.471 0.986 1.00 30.51 H new ATOM 0 HB THR E 28 8.732 -2.654 1.099 1.00 31.18 H new ATOM 0 HG1 THR E 28 10.157 -3.193 -0.401 1.00 30.68 H new ATOM 0 HG21 THR E 28 10.309 -2.836 2.853 1.00 31.09 H new ATOM 0 HG22 THR E 28 8.959 -3.555 3.266 1.00 31.09 H new ATOM 0 HG23 THR E 28 10.200 -4.414 2.784 1.00 31.09 H new ATOM 3511 N GLY E 29 6.124 -3.720 1.442 1.00 27.10 N ATOM 3512 CA GLY E 29 4.881 -3.564 2.175 1.00 28.30 C ATOM 3513 C GLY E 29 3.702 -4.134 1.393 1.00 27.52 C ATOM 3514 O GLY E 29 3.849 -4.493 0.227 1.00 28.08 O ATOM 0 H GLY E 29 6.209 -3.181 0.778 1.00 27.10 H new ATOM 0 HA2 GLY E 29 4.950 -4.012 3.032 1.00 28.30 H new ATOM 0 HA3 GLY E 29 4.727 -2.624 2.358 1.00 28.30 H new ATOM 3515 N PRO E 30 2.513 -4.226 2.006 1.00 28.11 N ATOM 3516 CA PRO E 30 1.335 -4.768 1.322 1.00 27.59 C ATOM 3517 C PRO E 30 0.587 -3.781 0.423 1.00 27.48 C ATOM 3518 O PRO E 30 0.572 -2.574 0.679 1.00 25.58 O ATOM 3519 CB PRO E 30 0.465 -5.228 2.480 1.00 26.66 C ATOM 3520 CG PRO E 30 0.695 -4.135 3.471 1.00 27.02 C ATOM 3521 CD PRO E 30 2.208 -3.958 3.424 1.00 27.46 C ATOM 0 HA PRO E 30 1.587 -5.464 0.695 1.00 27.59 H new ATOM 0 HB2 PRO E 30 -0.469 -5.303 2.229 1.00 26.66 H new ATOM 0 HB3 PRO E 30 0.738 -6.094 2.821 1.00 26.66 H new ATOM 0 HG2 PRO E 30 0.229 -3.321 3.225 1.00 27.02 H new ATOM 0 HG3 PRO E 30 0.388 -4.381 4.358 1.00 27.02 H new ATOM 0 HD2 PRO E 30 2.476 -3.064 3.689 1.00 27.46 H new ATOM 0 HD3 PRO E 30 2.663 -4.578 4.015 1.00 27.46 H new ATOM 3522 N ASN E 31 -0.032 -4.301 -0.635 1.00 29.28 N ATOM 3523 CA ASN E 31 -0.822 -3.458 -1.526 1.00 30.18 C ATOM 3524 C ASN E 31 -1.849 -2.838 -0.589 1.00 29.83 C ATOM 3525 O ASN E 31 -2.337 -3.510 0.316 1.00 30.96 O ATOM 3526 CB ASN E 31 -1.499 -4.308 -2.600 1.00 31.80 C ATOM 3527 CG ASN E 31 -2.648 -3.592 -3.265 1.00 32.45 C ATOM 3528 OD1 ASN E 31 -3.758 -3.559 -2.740 1.00 32.11 O ATOM 3529 ND2 ASN E 31 -2.384 -2.996 -4.418 1.00 32.98 N ATOM 0 H ASN E 31 -0.007 -5.133 -0.852 1.00 29.28 H new ATOM 0 HA ASN E 31 -0.297 -2.796 -2.003 1.00 30.18 H new ATOM 0 HB2 ASN E 31 -0.845 -4.556 -3.272 1.00 31.80 H new ATOM 0 HB3 ASN E 31 -1.822 -5.131 -2.201 1.00 31.80 H new ATOM 0 HD21 ASN E 31 -3.003 -2.564 -4.830 1.00 32.98 H new ATOM 0 HD22 ASN E 31 -1.594 -3.041 -4.754 1.00 32.98 H new ATOM 3530 N LEU E 32 -2.173 -1.565 -0.788 1.00 30.37 N ATOM 3531 CA LEU E 32 -3.102 -0.891 0.116 1.00 29.94 C ATOM 3532 C LEU E 32 -4.548 -0.753 -0.354 1.00 30.60 C ATOM 3533 O LEU E 32 -5.340 -0.046 0.268 1.00 28.95 O ATOM 3534 CB LEU E 32 -2.542 0.491 0.469 1.00 28.37 C ATOM 3535 CG LEU E 32 -1.139 0.467 1.086 1.00 29.46 C ATOM 3536 CD1 LEU E 32 -0.590 1.876 1.187 1.00 27.16 C ATOM 3537 CD2 LEU E 32 -1.188 -0.194 2.467 1.00 27.01 C ATOM 0 H LEU E 32 -1.872 -1.078 -1.430 1.00 30.37 H new ATOM 0 HA LEU E 32 -3.162 -1.478 0.886 1.00 29.94 H new ATOM 0 HB2 LEU E 32 -2.521 1.034 -0.334 1.00 28.37 H new ATOM 0 HB3 LEU E 32 -3.149 0.925 1.089 1.00 28.37 H new ATOM 0 HG LEU E 32 -0.549 -0.051 0.516 1.00 29.46 H new ATOM 0 HD11 LEU E 32 0.297 1.851 1.578 1.00 27.16 H new ATOM 0 HD12 LEU E 32 -0.541 2.269 0.301 1.00 27.16 H new ATOM 0 HD13 LEU E 32 -1.174 2.412 1.746 1.00 27.16 H new ATOM 0 HD21 LEU E 32 -0.298 -0.206 2.852 1.00 27.01 H new ATOM 0 HD22 LEU E 32 -1.783 0.308 3.045 1.00 27.01 H new ATOM 0 HD23 LEU E 32 -1.514 -1.103 2.379 1.00 27.01 H new ATOM 3538 N HIS E 33 -4.908 -1.431 -1.434 1.00 32.89 N ATOM 3539 CA HIS E 33 -6.275 -1.309 -1.917 1.00 35.99 C ATOM 3540 C HIS E 33 -7.271 -1.852 -0.901 1.00 35.95 C ATOM 3541 O HIS E 33 -7.093 -2.949 -0.375 1.00 34.34 O ATOM 3542 CB HIS E 33 -6.465 -2.045 -3.242 1.00 38.62 C ATOM 3543 CG HIS E 33 -7.740 -1.684 -3.936 1.00 42.03 C ATOM 3544 ND1 HIS E 33 -7.908 -0.490 -4.604 1.00 42.79 N ATOM 3545 CD2 HIS E 33 -8.932 -2.325 -4.001 1.00 42.04 C ATOM 3546 CE1 HIS E 33 -9.149 -0.410 -5.050 1.00 42.93 C ATOM 3547 NE2 HIS E 33 -9.791 -1.510 -4.698 1.00 43.01 N ATOM 0 H HIS E 33 -4.396 -1.951 -1.889 1.00 32.89 H new ATOM 0 HA HIS E 33 -6.440 -0.363 -2.052 1.00 35.99 H new ATOM 0 HB2 HIS E 33 -5.717 -1.846 -3.827 1.00 38.62 H new ATOM 0 HB3 HIS E 33 -6.451 -3.001 -3.080 1.00 38.62 H new ATOM 0 HD2 HIS E 33 -9.131 -3.159 -3.642 1.00 42.04 H new ATOM 0 HE1 HIS E 33 -9.510 0.300 -5.530 1.00 42.93 H new ATOM 0 HE2 HIS E 33 -10.613 -1.687 -4.876 1.00 43.01 H new ATOM 3548 N GLY E 34 -8.317 -1.073 -0.633 1.00 36.72 N ATOM 3549 CA GLY E 34 -9.339 -1.490 0.312 1.00 37.31 C ATOM 3550 C GLY E 34 -8.949 -1.250 1.758 1.00 38.19 C ATOM 3551 O GLY E 34 -9.549 -1.815 2.671 1.00 39.44 O ATOM 0 H GLY E 34 -8.450 -0.301 -0.989 1.00 36.72 H new ATOM 0 HA2 GLY E 34 -10.162 -1.013 0.121 1.00 37.31 H new ATOM 0 HA3 GLY E 34 -9.523 -2.434 0.185 1.00 37.31 H new ATOM 3552 N LEU E 35 -7.949 -0.401 1.964 1.00 36.43 N ATOM 3553 CA LEU E 35 -7.458 -0.089 3.302 1.00 36.90 C ATOM 3554 C LEU E 35 -8.528 0.456 4.246 1.00 36.88 C ATOM 3555 O LEU E 35 -8.662 -0.004 5.383 1.00 36.58 O ATOM 3556 CB LEU E 35 -6.315 0.928 3.215 1.00 36.43 C ATOM 3557 CG LEU E 35 -5.555 1.187 4.516 1.00 36.93 C ATOM 3558 CD1 LEU E 35 -4.754 -0.055 4.877 1.00 39.09 C ATOM 3559 CD2 LEU E 35 -4.631 2.378 4.352 1.00 34.97 C ATOM 0 H LEU E 35 -7.535 0.011 1.332 1.00 36.43 H new ATOM 0 HA LEU E 35 -7.154 -0.932 3.674 1.00 36.90 H new ATOM 0 HB2 LEU E 35 -5.683 0.622 2.546 1.00 36.43 H new ATOM 0 HB3 LEU E 35 -6.677 1.770 2.899 1.00 36.43 H new ATOM 0 HG LEU E 35 -6.184 1.384 5.227 1.00 36.93 H new ATOM 0 HD11 LEU E 35 -4.268 0.101 5.702 1.00 39.09 H new ATOM 0 HD12 LEU E 35 -5.356 -0.806 4.994 1.00 39.09 H new ATOM 0 HD13 LEU E 35 -4.126 -0.253 4.165 1.00 39.09 H new ATOM 0 HD21 LEU E 35 -4.154 2.534 5.182 1.00 34.97 H new ATOM 0 HD22 LEU E 35 -3.995 2.199 3.642 1.00 34.97 H new ATOM 0 HD23 LEU E 35 -5.153 3.164 4.127 1.00 34.97 H new ATOM 3560 N PHE E 36 -9.280 1.444 3.777 1.00 35.67 N ATOM 3561 CA PHE E 36 -10.306 2.060 4.600 1.00 36.21 C ATOM 3562 C PHE E 36 -11.497 1.162 4.925 1.00 35.94 C ATOM 3563 O PHE E 36 -12.071 0.511 4.049 1.00 35.05 O ATOM 3564 CB PHE E 36 -10.789 3.361 3.944 1.00 37.48 C ATOM 3565 CG PHE E 36 -9.760 4.464 3.949 1.00 36.89 C ATOM 3566 CD1 PHE E 36 -8.663 4.417 3.095 1.00 36.45 C ATOM 3567 CD2 PHE E 36 -9.881 5.542 4.824 1.00 36.66 C ATOM 3568 CE1 PHE E 36 -7.698 5.430 3.110 1.00 36.41 C ATOM 3569 CE2 PHE E 36 -8.925 6.558 4.849 1.00 36.69 C ATOM 3570 CZ PHE E 36 -7.830 6.502 3.988 1.00 37.71 C ATOM 0 H PHE E 36 -9.211 1.771 2.985 1.00 35.67 H new ATOM 0 HA PHE E 36 -9.882 2.240 5.453 1.00 36.21 H new ATOM 0 HB2 PHE E 36 -11.047 3.175 3.028 1.00 37.48 H new ATOM 0 HB3 PHE E 36 -11.584 3.670 4.405 1.00 37.48 H new ATOM 0 HD1 PHE E 36 -8.570 3.703 2.506 1.00 36.45 H new ATOM 0 HD2 PHE E 36 -10.610 5.585 5.400 1.00 36.66 H new ATOM 0 HE1 PHE E 36 -6.969 5.387 2.534 1.00 36.41 H new ATOM 0 HE2 PHE E 36 -9.018 7.271 5.439 1.00 36.69 H new ATOM 0 HZ PHE E 36 -7.191 7.178 4.000 1.00 37.71 H new ATOM 3571 N GLY E 37 -11.856 1.138 6.204 1.00 36.56 N ATOM 3572 CA GLY E 37 -12.978 0.341 6.662 1.00 37.75 C ATOM 3573 C GLY E 37 -12.591 -1.088 6.980 1.00 38.70 C ATOM 3574 O GLY E 37 -13.448 -1.916 7.293 1.00 38.07 O ATOM 0 H GLY E 37 -11.457 1.581 6.824 1.00 36.56 H new ATOM 0 HA2 GLY E 37 -13.360 0.752 7.453 1.00 37.75 H new ATOM 0 HA3 GLY E 37 -13.669 0.341 5.981 1.00 37.75 H new ATOM 3575 N ARG E 38 -11.296 -1.376 6.904 1.00 39.53 N ATOM 3576 CA ARG E 38 -10.793 -2.716 7.172 1.00 41.16 C ATOM 3577 C ARG E 38 -9.893 -2.714 8.403 1.00 41.12 C ATOM 3578 O ARG E 38 -9.325 -1.684 8.759 1.00 43.82 O ATOM 3579 CB ARG E 38 -10.020 -3.218 5.954 1.00 42.37 C ATOM 3580 CG ARG E 38 -9.584 -4.665 6.027 1.00 43.73 C ATOM 3581 CD ARG E 38 -9.027 -5.111 4.682 1.00 44.28 C ATOM 3582 NE ARG E 38 -7.797 -4.406 4.324 1.00 43.13 N ATOM 3583 CZ ARG E 38 -7.252 -4.415 3.109 1.00 43.73 C ATOM 3584 NH1 ARG E 38 -7.829 -5.090 2.119 1.00 42.11 N ATOM 3585 NH2 ARG E 38 -6.123 -3.750 2.882 1.00 42.92 N ATOM 0 H ARG E 38 -10.688 -0.804 6.697 1.00 39.53 H new ATOM 0 HA ARG E 38 -11.542 -3.307 7.346 1.00 41.16 H new ATOM 0 HB2 ARG E 38 -10.573 -3.100 5.166 1.00 42.37 H new ATOM 0 HB3 ARG E 38 -9.234 -2.663 5.835 1.00 42.37 H new ATOM 0 HG2 ARG E 38 -8.910 -4.773 6.716 1.00 43.73 H new ATOM 0 HG3 ARG E 38 -10.336 -5.225 6.276 1.00 43.73 H new ATOM 0 HD2 ARG E 38 -8.854 -6.065 4.707 1.00 44.28 H new ATOM 0 HD3 ARG E 38 -9.694 -4.962 3.994 1.00 44.28 H new ATOM 0 HE ARG E 38 -7.399 -3.956 4.939 1.00 43.13 H new ATOM 0 HH11 ARG E 38 -8.558 -5.524 2.262 1.00 42.11 H new ATOM 0 HH12 ARG E 38 -7.473 -5.093 1.336 1.00 42.11 H new ATOM 0 HH21 ARG E 38 -5.745 -3.314 3.520 1.00 42.92 H new ATOM 0 HH22 ARG E 38 -5.771 -3.756 2.097 1.00 42.92 H new ATOM 3586 N LYS E 39 -9.780 -3.863 9.061 1.00 40.94 N ATOM 3587 CA LYS E 39 -8.930 -3.978 10.242 1.00 40.68 C ATOM 3588 C LYS E 39 -7.471 -4.016 9.804 1.00 39.44 C ATOM 3589 O LYS E 39 -7.168 -4.329 8.649 1.00 37.17 O ATOM 3590 CB LYS E 39 -9.248 -5.259 11.021 1.00 41.92 C ATOM 3591 CG LYS E 39 -10.598 -5.271 11.716 1.00 43.64 C ATOM 3592 CD LYS E 39 -10.710 -4.133 12.717 1.00 43.95 C ATOM 3593 CE LYS E 39 -11.924 -4.307 13.598 1.00 44.86 C ATOM 3594 NZ LYS E 39 -11.826 -5.572 14.378 1.00 47.53 N ATOM 0 H LYS E 39 -10.187 -4.588 8.840 1.00 40.94 H new ATOM 0 HA LYS E 39 -9.094 -3.214 10.817 1.00 40.68 H new ATOM 0 HB2 LYS E 39 -9.208 -6.011 10.410 1.00 41.92 H new ATOM 0 HB3 LYS E 39 -8.556 -5.397 11.686 1.00 41.92 H new ATOM 0 HG2 LYS E 39 -11.305 -5.196 11.056 1.00 43.64 H new ATOM 0 HG3 LYS E 39 -10.723 -6.119 12.171 1.00 43.64 H new ATOM 0 HD2 LYS E 39 -9.910 -4.100 13.265 1.00 43.95 H new ATOM 0 HD3 LYS E 39 -10.766 -3.287 12.246 1.00 43.95 H new ATOM 0 HE2 LYS E 39 -12.002 -3.553 14.203 1.00 44.86 H new ATOM 0 HE3 LYS E 39 -12.727 -4.318 13.053 1.00 44.86 H new ATOM 0 HZ1 LYS E 39 -12.027 -5.412 15.230 1.00 47.53 H new ATOM 0 HZ2 LYS E 39 -12.396 -6.170 14.047 1.00 47.53 H new ATOM 0 HZ3 LYS E 39 -10.997 -5.891 14.324 1.00 47.53 H new ATOM 3595 N THR E 40 -6.572 -3.701 10.728 1.00 36.39 N ATOM 3596 CA THR E 40 -5.147 -3.723 10.431 1.00 34.92 C ATOM 3597 C THR E 40 -4.674 -5.119 9.998 1.00 33.94 C ATOM 3598 O THR E 40 -5.237 -6.136 10.406 1.00 33.10 O ATOM 3599 CB THR E 40 -4.321 -3.269 11.659 1.00 34.88 C ATOM 3600 OG1 THR E 40 -4.774 -3.962 12.827 1.00 36.31 O ATOM 3601 CG2 THR E 40 -4.472 -1.784 11.882 1.00 34.23 C ATOM 0 H THR E 40 -6.767 -3.472 11.534 1.00 36.39 H new ATOM 0 HA THR E 40 -5.006 -3.106 9.696 1.00 34.92 H new ATOM 0 HB THR E 40 -3.387 -3.472 11.492 1.00 34.88 H new ATOM 0 HG1 THR E 40 -4.988 -4.748 12.621 1.00 36.31 H new ATOM 0 HG21 THR E 40 -3.949 -1.518 12.654 1.00 34.23 H new ATOM 0 HG22 THR E 40 -4.159 -1.305 11.099 1.00 34.23 H new ATOM 0 HG23 THR E 40 -5.406 -1.573 12.037 1.00 34.23 H new ATOM 3602 N GLY E 41 -3.648 -5.148 9.152 1.00 33.34 N ATOM 3603 CA GLY E 41 -3.078 -6.397 8.681 1.00 34.20 C ATOM 3604 C GLY E 41 -4.031 -7.367 8.020 1.00 36.43 C ATOM 3605 O GLY E 41 -3.928 -8.574 8.225 1.00 36.31 O ATOM 0 H GLY E 41 -3.266 -4.444 8.838 1.00 33.34 H new ATOM 0 HA2 GLY E 41 -2.371 -6.189 8.051 1.00 34.20 H new ATOM 0 HA3 GLY E 41 -2.663 -6.845 9.435 1.00 34.20 H new ATOM 3606 N GLN E 42 -4.951 -6.854 7.213 1.00 38.86 N ATOM 3607 CA GLN E 42 -5.918 -7.710 6.544 1.00 40.94 C ATOM 3608 C GLN E 42 -5.702 -7.827 5.036 1.00 41.89 C ATOM 3609 O GLN E 42 -6.523 -8.416 4.338 1.00 43.41 O ATOM 3610 CB GLN E 42 -7.335 -7.202 6.815 1.00 42.74 C ATOM 3611 CG GLN E 42 -7.781 -7.295 8.270 1.00 44.06 C ATOM 3612 CD GLN E 42 -8.071 -8.717 8.708 1.00 45.49 C ATOM 3613 OE1 GLN E 42 -7.168 -9.548 8.816 1.00 44.22 O ATOM 3614 NE2 GLN E 42 -9.344 -9.006 8.960 1.00 48.60 N ATOM 0 H GLN E 42 -5.032 -6.015 7.040 1.00 38.86 H new ATOM 0 HA GLN E 42 -5.791 -8.598 6.912 1.00 40.94 H new ATOM 0 HB2 GLN E 42 -7.393 -6.276 6.531 1.00 42.74 H new ATOM 0 HB3 GLN E 42 -7.956 -7.706 6.267 1.00 42.74 H new ATOM 0 HG2 GLN E 42 -7.091 -6.920 8.840 1.00 44.06 H new ATOM 0 HG3 GLN E 42 -8.577 -6.754 8.395 1.00 44.06 H new ATOM 0 HE21 GLN E 42 -9.948 -8.400 8.874 1.00 48.60 H new ATOM 0 HE22 GLN E 42 -9.564 -9.799 9.209 1.00 48.60 H new ATOM 3615 N ALA E 43 -4.608 -7.277 4.523 1.00 41.68 N ATOM 3616 CA ALA E 43 -4.368 -7.363 3.086 1.00 41.77 C ATOM 3617 C ALA E 43 -4.086 -8.802 2.686 1.00 41.06 C ATOM 3618 O ALA E 43 -3.107 -9.404 3.127 1.00 41.79 O ATOM 3619 CB ALA E 43 -3.206 -6.468 2.677 1.00 41.05 C ATOM 0 H ALA E 43 -4.006 -6.860 4.974 1.00 41.68 H new ATOM 0 HA ALA E 43 -5.165 -7.058 2.626 1.00 41.77 H new ATOM 0 HB1 ALA E 43 -3.063 -6.540 1.720 1.00 41.05 H new ATOM 0 HB2 ALA E 43 -3.410 -5.548 2.905 1.00 41.05 H new ATOM 0 HB3 ALA E 43 -2.403 -6.746 3.145 1.00 41.05 H new ATOM 3620 N PRO E 44 -4.953 -9.376 1.844 1.00 40.82 N ATOM 3621 CA PRO E 44 -4.816 -10.756 1.368 1.00 39.99 C ATOM 3622 C PRO E 44 -3.467 -11.034 0.709 1.00 38.43 C ATOM 3623 O PRO E 44 -3.023 -10.278 -0.149 1.00 38.74 O ATOM 3624 CB PRO E 44 -5.966 -10.890 0.373 1.00 39.64 C ATOM 3625 CG PRO E 44 -7.007 -9.985 0.946 1.00 41.43 C ATOM 3626 CD PRO E 44 -6.200 -8.771 1.347 1.00 40.89 C ATOM 0 HA PRO E 44 -4.851 -11.398 2.094 1.00 39.99 H new ATOM 0 HB2 PRO E 44 -5.703 -10.616 -0.520 1.00 39.64 H new ATOM 0 HB3 PRO E 44 -6.281 -11.805 0.308 1.00 39.64 H new ATOM 0 HG2 PRO E 44 -7.692 -9.765 0.295 1.00 41.43 H new ATOM 0 HG3 PRO E 44 -7.456 -10.387 1.706 1.00 41.43 H new ATOM 0 HD2 PRO E 44 -6.041 -8.178 0.596 1.00 40.89 H new ATOM 0 HD3 PRO E 44 -6.647 -8.249 2.031 1.00 40.89 H new ATOM 3627 N GLY E 45 -2.821 -12.121 1.116 1.00 37.36 N ATOM 3628 CA GLY E 45 -1.547 -12.485 0.521 1.00 36.77 C ATOM 3629 C GLY E 45 -0.299 -11.865 1.115 1.00 36.18 C ATOM 3630 O GLY E 45 0.797 -12.083 0.604 1.00 36.41 O ATOM 0 H GLY E 45 -3.102 -12.655 1.729 1.00 37.36 H new ATOM 0 HA2 GLY E 45 -1.457 -13.449 0.573 1.00 36.77 H new ATOM 0 HA3 GLY E 45 -1.578 -12.253 -0.420 1.00 36.77 H new ATOM 3631 N PHE E 46 -0.439 -11.094 2.186 1.00 35.96 N ATOM 3632 CA PHE E 46 0.735 -10.476 2.792 1.00 36.13 C ATOM 3633 C PHE E 46 0.985 -10.993 4.207 1.00 35.46 C ATOM 3634 O PHE E 46 0.051 -11.183 4.988 1.00 35.00 O ATOM 3635 CB PHE E 46 0.589 -8.948 2.822 1.00 35.52 C ATOM 3636 CG PHE E 46 1.837 -8.231 3.262 1.00 35.27 C ATOM 3637 CD1 PHE E 46 2.891 -8.031 2.375 1.00 34.83 C ATOM 3638 CD2 PHE E 46 1.978 -7.795 4.576 1.00 34.49 C ATOM 3639 CE1 PHE E 46 4.072 -7.405 2.789 1.00 34.79 C ATOM 3640 CE2 PHE E 46 3.151 -7.172 5.000 1.00 36.52 C ATOM 3641 CZ PHE E 46 4.201 -6.977 4.103 1.00 35.71 C ATOM 0 H PHE E 46 -1.187 -10.918 2.571 1.00 35.96 H new ATOM 0 HA PHE E 46 1.497 -10.717 2.243 1.00 36.13 H new ATOM 0 HB2 PHE E 46 0.342 -8.637 1.937 1.00 35.52 H new ATOM 0 HB3 PHE E 46 -0.138 -8.712 3.419 1.00 35.52 H new ATOM 0 HD1 PHE E 46 2.809 -8.318 1.494 1.00 34.83 H new ATOM 0 HD2 PHE E 46 1.281 -7.921 5.179 1.00 34.49 H new ATOM 0 HE1 PHE E 46 4.768 -7.276 2.186 1.00 34.79 H new ATOM 0 HE2 PHE E 46 3.233 -6.886 5.881 1.00 36.52 H new ATOM 0 HZ PHE E 46 4.984 -6.562 4.384 1.00 35.71 H new ATOM 3642 N THR E 47 2.251 -11.233 4.529 1.00 34.97 N ATOM 3643 CA THR E 47 2.612 -11.708 5.859 1.00 34.46 C ATOM 3644 C THR E 47 3.080 -10.522 6.690 1.00 33.21 C ATOM 3645 O THR E 47 4.181 -10.007 6.498 1.00 31.85 O ATOM 3646 CB THR E 47 3.745 -12.752 5.815 1.00 35.86 C ATOM 3647 OG1 THR E 47 3.362 -13.846 4.974 1.00 36.23 O ATOM 3648 CG2 THR E 47 4.033 -13.284 7.221 1.00 37.58 C ATOM 0 H THR E 47 2.915 -11.127 3.993 1.00 34.97 H new ATOM 0 HA THR E 47 1.829 -12.129 6.248 1.00 34.46 H new ATOM 0 HB THR E 47 4.542 -12.327 5.463 1.00 35.86 H new ATOM 0 HG1 THR E 47 3.982 -14.412 4.951 1.00 36.23 H new ATOM 0 HG21 THR E 47 4.747 -13.939 7.179 1.00 37.58 H new ATOM 0 HG22 THR E 47 4.301 -12.550 7.796 1.00 37.58 H new ATOM 0 HG23 THR E 47 3.234 -13.700 7.580 1.00 37.58 H new ATOM 3649 N TYR E 48 2.218 -10.096 7.605 1.00 33.35 N ATOM 3650 CA TYR E 48 2.486 -8.979 8.501 1.00 34.22 C ATOM 3651 C TYR E 48 3.218 -9.449 9.753 1.00 34.12 C ATOM 3652 O TYR E 48 3.420 -10.644 9.962 1.00 31.50 O ATOM 3653 CB TYR E 48 1.171 -8.352 8.960 1.00 35.81 C ATOM 3654 CG TYR E 48 0.361 -7.679 7.884 1.00 36.55 C ATOM 3655 CD1 TYR E 48 0.393 -6.297 7.733 1.00 35.75 C ATOM 3656 CD2 TYR E 48 -0.465 -8.420 7.034 1.00 37.36 C ATOM 3657 CE1 TYR E 48 -0.377 -5.663 6.773 1.00 35.05 C ATOM 3658 CE2 TYR E 48 -1.243 -7.791 6.061 1.00 35.66 C ATOM 3659 CZ TYR E 48 -1.194 -6.411 5.943 1.00 34.31 C ATOM 3660 OH TYR E 48 -1.982 -5.765 5.025 1.00 32.03 O ATOM 0 H TYR E 48 1.446 -10.455 7.725 1.00 33.35 H new ATOM 0 HA TYR E 48 3.029 -8.340 8.014 1.00 34.22 H new ATOM 0 HB2 TYR E 48 0.626 -9.043 9.368 1.00 35.81 H new ATOM 0 HB3 TYR E 48 1.366 -7.700 9.651 1.00 35.81 H new ATOM 0 HD1 TYR E 48 0.941 -5.790 8.287 1.00 35.75 H new ATOM 0 HD2 TYR E 48 -0.497 -9.346 7.118 1.00 37.36 H new ATOM 0 HE1 TYR E 48 -0.345 -4.738 6.686 1.00 35.05 H new ATOM 0 HE2 TYR E 48 -1.788 -8.292 5.498 1.00 35.66 H new ATOM 0 HH TYR E 48 -2.149 -4.988 5.296 1.00 32.03 H new ATOM 3661 N THR E 49 3.608 -8.493 10.589 1.00 34.39 N ATOM 3662 CA THR E 49 4.248 -8.828 11.851 1.00 31.40 C ATOM 3663 C THR E 49 3.064 -9.207 12.737 1.00 31.76 C ATOM 3664 O THR E 49 1.929 -8.836 12.444 1.00 31.14 O ATOM 3665 CB THR E 49 4.971 -7.609 12.475 1.00 31.69 C ATOM 3666 OG1 THR E 49 4.049 -6.516 12.606 1.00 27.19 O ATOM 3667 CG2 THR E 49 6.154 -7.182 11.608 1.00 29.38 C ATOM 0 H THR E 49 3.511 -7.651 10.444 1.00 34.39 H new ATOM 0 HA THR E 49 4.921 -9.519 11.747 1.00 31.40 H new ATOM 0 HB THR E 49 5.304 -7.861 13.350 1.00 31.69 H new ATOM 0 HG1 THR E 49 4.268 -5.900 12.079 1.00 27.19 H new ATOM 0 HG21 THR E 49 6.594 -6.419 12.014 1.00 29.38 H new ATOM 0 HG22 THR E 49 6.784 -7.916 11.535 1.00 29.38 H new ATOM 0 HG23 THR E 49 5.837 -6.940 10.724 1.00 29.38 H new ATOM 3668 N ASP E 50 3.306 -9.961 13.801 1.00 31.77 N ATOM 3669 CA ASP E 50 2.210 -10.316 14.683 1.00 31.98 C ATOM 3670 C ASP E 50 1.615 -9.023 15.225 1.00 31.44 C ATOM 3671 O ASP E 50 0.410 -8.931 15.457 1.00 30.93 O ATOM 3672 CB ASP E 50 2.699 -11.207 15.829 1.00 34.16 C ATOM 3673 CG ASP E 50 2.792 -12.675 15.430 1.00 37.49 C ATOM 3674 OD1 ASP E 50 3.246 -13.487 16.263 1.00 38.79 O ATOM 3675 OD2 ASP E 50 2.407 -13.022 14.289 1.00 39.27 O ATOM 0 H ASP E 50 4.077 -10.269 14.025 1.00 31.77 H new ATOM 0 HA ASP E 50 1.538 -10.819 14.196 1.00 31.98 H new ATOM 0 HB2 ASP E 50 3.570 -10.900 16.124 1.00 34.16 H new ATOM 0 HB3 ASP E 50 2.096 -11.118 16.584 1.00 34.16 H new ATOM 3676 N ALA E 51 2.467 -8.020 15.414 1.00 29.67 N ATOM 3677 CA ALA E 51 2.014 -6.727 15.916 1.00 29.24 C ATOM 3678 C ALA E 51 1.016 -6.092 14.946 1.00 28.31 C ATOM 3679 O ALA E 51 -0.100 -5.740 15.328 1.00 28.48 O ATOM 3680 CB ALA E 51 3.208 -5.792 16.128 1.00 27.91 C ATOM 0 H ALA E 51 3.311 -8.068 15.258 1.00 29.67 H new ATOM 0 HA ALA E 51 1.570 -6.868 16.767 1.00 29.24 H new ATOM 0 HB1 ALA E 51 2.894 -4.937 16.461 1.00 27.91 H new ATOM 0 HB2 ALA E 51 3.817 -6.186 16.772 1.00 27.91 H new ATOM 0 HB3 ALA E 51 3.670 -5.660 15.285 1.00 27.91 H new ATOM 3681 N ASN E 52 1.408 -5.955 13.687 1.00 28.06 N ATOM 3682 CA ASN E 52 0.517 -5.347 12.703 1.00 30.01 C ATOM 3683 C ASN E 52 -0.705 -6.237 12.482 1.00 29.29 C ATOM 3684 O ASN E 52 -1.812 -5.749 12.271 1.00 31.49 O ATOM 3685 CB ASN E 52 1.267 -5.128 11.383 1.00 28.47 C ATOM 3686 CG ASN E 52 0.581 -4.112 10.474 1.00 30.31 C ATOM 3687 OD1 ASN E 52 1.241 -3.367 9.754 1.00 29.06 O ATOM 3688 ND2 ASN E 52 -0.745 -4.089 10.496 1.00 30.48 N ATOM 0 H ASN E 52 2.173 -6.202 13.383 1.00 28.06 H new ATOM 0 HA ASN E 52 0.216 -4.487 13.036 1.00 30.01 H new ATOM 0 HB2 ASN E 52 2.169 -4.827 11.575 1.00 28.47 H new ATOM 0 HB3 ASN E 52 1.344 -5.974 10.915 1.00 28.47 H new ATOM 0 HD21 ASN E 52 -1.174 -3.538 9.994 1.00 30.48 H new ATOM 0 HD22 ASN E 52 -1.176 -4.625 11.012 1.00 30.48 H new ATOM 3689 N LYS E 53 -0.496 -7.546 12.547 1.00 29.55 N ATOM 3690 CA LYS E 53 -1.568 -8.507 12.342 1.00 31.57 C ATOM 3691 C LYS E 53 -2.659 -8.382 13.409 1.00 33.48 C ATOM 3692 O LYS E 53 -3.833 -8.595 13.125 1.00 33.24 O ATOM 3693 CB LYS E 53 -0.993 -9.927 12.356 0.50 31.07 C ATOM 3694 CG LYS E 53 -1.932 -11.016 11.854 0.50 33.29 C ATOM 3695 CD LYS E 53 -1.200 -12.354 11.796 0.50 34.48 C ATOM 3696 CE LYS E 53 -2.014 -13.436 11.098 0.50 35.74 C ATOM 3697 NZ LYS E 53 -3.231 -13.830 11.857 0.50 36.14 N ATOM 0 H LYS E 53 0.270 -7.901 12.711 1.00 29.55 H new ATOM 0 HA LYS E 53 -1.974 -8.320 11.481 1.00 31.57 H new ATOM 0 HB2 LYS E 53 -0.189 -9.939 11.814 0.50 31.07 H new ATOM 0 HB3 LYS E 53 -0.727 -10.143 13.263 0.50 31.07 H new ATOM 0 HG2 LYS E 53 -2.701 -11.085 12.441 0.50 33.29 H new ATOM 0 HG3 LYS E 53 -2.267 -10.784 10.974 0.50 33.29 H new ATOM 0 HD2 LYS E 53 -0.357 -12.238 11.331 0.50 34.48 H new ATOM 0 HD3 LYS E 53 -0.989 -12.643 12.698 0.50 34.48 H new ATOM 0 HE2 LYS E 53 -2.276 -13.120 10.219 0.50 35.74 H new ATOM 0 HE3 LYS E 53 -1.456 -14.218 10.964 0.50 35.74 H new ATOM 0 HZ1 LYS E 53 -3.669 -14.462 11.409 0.50 36.14 H new ATOM 0 HZ2 LYS E 53 -2.994 -14.143 12.656 0.50 36.14 H new ATOM 0 HZ3 LYS E 53 -3.759 -13.121 11.961 0.50 36.14 H new ATOM 3698 N ASN E 54 -2.278 -8.003 14.626 1.00 33.66 N ATOM 3699 CA ASN E 54 -3.251 -7.913 15.707 1.00 34.95 C ATOM 3700 C ASN E 54 -3.466 -6.572 16.393 1.00 35.11 C ATOM 3701 O ASN E 54 -4.000 -6.538 17.499 1.00 35.72 O ATOM 3702 CB ASN E 54 -2.913 -8.965 16.760 1.00 38.24 C ATOM 3703 CG ASN E 54 -2.720 -10.338 16.154 1.00 39.77 C ATOM 3704 OD1 ASN E 54 -3.615 -10.865 15.489 1.00 42.40 O ATOM 3705 ND2 ASN E 54 -1.547 -10.923 16.369 1.00 38.46 N ATOM 0 H ASN E 54 -1.472 -7.796 14.844 1.00 33.66 H new ATOM 0 HA ASN E 54 -4.097 -8.060 15.256 1.00 34.95 H new ATOM 0 HB2 ASN E 54 -2.105 -8.703 17.229 1.00 38.24 H new ATOM 0 HB3 ASN E 54 -3.624 -9.001 17.419 1.00 38.24 H new ATOM 0 HD21 ASN E 54 -1.388 -11.701 16.039 1.00 38.46 H new ATOM 0 HD22 ASN E 54 -0.947 -10.524 16.838 1.00 38.46 H new ATOM 3706 N LYS E 55 -3.060 -5.472 15.761 1.00 34.69 N ATOM 3707 CA LYS E 55 -3.271 -4.156 16.362 1.00 33.93 C ATOM 3708 C LYS E 55 -4.774 -4.026 16.628 1.00 35.83 C ATOM 3709 O LYS E 55 -5.205 -3.370 17.577 1.00 35.28 O ATOM 3710 CB LYS E 55 -2.791 -3.050 15.414 1.00 31.63 C ATOM 3711 CG LYS E 55 -3.094 -1.640 15.888 1.00 29.98 C ATOM 3712 CD LYS E 55 -2.479 -1.336 17.239 1.00 27.39 C ATOM 3713 CE LYS E 55 -2.837 0.074 17.685 1.00 28.65 C ATOM 3714 NZ LYS E 55 -2.194 0.470 18.977 1.00 29.44 N ATOM 0 H LYS E 55 -2.667 -5.464 14.996 1.00 34.69 H new ATOM 0 HA LYS E 55 -2.767 -4.065 17.186 1.00 33.93 H new ATOM 0 HB2 LYS E 55 -1.833 -3.139 15.290 1.00 31.63 H new ATOM 0 HB3 LYS E 55 -3.203 -3.183 14.546 1.00 31.63 H new ATOM 0 HG2 LYS E 55 -2.762 -1.004 15.235 1.00 29.98 H new ATOM 0 HG3 LYS E 55 -4.055 -1.519 15.939 1.00 29.98 H new ATOM 0 HD2 LYS E 55 -2.793 -1.978 17.895 1.00 27.39 H new ATOM 0 HD3 LYS E 55 -1.515 -1.430 17.190 1.00 27.39 H new ATOM 0 HE2 LYS E 55 -2.573 0.701 16.994 1.00 28.65 H new ATOM 0 HE3 LYS E 55 -3.800 0.142 17.777 1.00 28.65 H new ATOM 0 HZ1 LYS E 55 -2.586 1.205 19.291 1.00 29.44 H new ATOM 0 HZ2 LYS E 55 -2.284 -0.190 19.568 1.00 29.44 H new ATOM 0 HZ3 LYS E 55 -1.329 0.631 18.841 1.00 29.44 H new ATOM 3715 N GLY E 56 -5.566 -4.667 15.774 1.00 36.62 N ATOM 3716 CA GLY E 56 -7.009 -4.662 15.944 1.00 38.87 C ATOM 3717 C GLY E 56 -7.814 -3.401 15.686 1.00 39.40 C ATOM 3718 O GLY E 56 -8.971 -3.330 16.096 1.00 40.88 O ATOM 0 H GLY E 56 -5.286 -5.109 15.092 1.00 36.62 H new ATOM 0 HA2 GLY E 56 -7.367 -5.353 15.365 1.00 38.87 H new ATOM 0 HA3 GLY E 56 -7.190 -4.935 16.857 1.00 38.87 H new ATOM 3719 N ILE E 57 -7.243 -2.403 15.021 1.00 39.77 N ATOM 3720 CA ILE E 57 -8.015 -1.196 14.752 1.00 39.53 C ATOM 3721 C ILE E 57 -8.492 -1.180 13.311 1.00 38.81 C ATOM 3722 O ILE E 57 -8.039 -1.973 12.485 1.00 38.35 O ATOM 3723 CB ILE E 57 -7.208 0.103 15.038 1.00 39.48 C ATOM 3724 CG1 ILE E 57 -5.976 0.186 14.135 1.00 38.72 C ATOM 3725 CG2 ILE E 57 -6.821 0.156 16.503 1.00 40.79 C ATOM 3726 CD1 ILE E 57 -6.253 0.804 12.772 1.00 37.95 C ATOM 0 H ILE E 57 -6.436 -2.402 14.725 1.00 39.77 H new ATOM 0 HA ILE E 57 -8.775 -1.214 15.354 1.00 39.53 H new ATOM 0 HB ILE E 57 -7.766 0.871 14.840 1.00 39.48 H new ATOM 0 HG12 ILE E 57 -5.291 0.707 14.584 1.00 38.72 H new ATOM 0 HG13 ILE E 57 -5.617 -0.706 14.009 1.00 38.72 H new ATOM 0 HG21 ILE E 57 -6.318 0.967 16.676 1.00 40.79 H new ATOM 0 HG22 ILE E 57 -7.622 0.150 17.050 1.00 40.79 H new ATOM 0 HG23 ILE E 57 -6.275 -0.615 16.722 1.00 40.79 H new ATOM 0 HD11 ILE E 57 -5.433 0.826 12.254 1.00 37.95 H new ATOM 0 HD12 ILE E 57 -6.917 0.273 12.305 1.00 37.95 H new ATOM 0 HD13 ILE E 57 -6.586 1.708 12.888 1.00 37.95 H new ATOM 3727 N THR E 58 -9.426 -0.282 13.025 1.00 38.79 N ATOM 3728 CA THR E 58 -9.967 -0.143 11.684 1.00 37.87 C ATOM 3729 C THR E 58 -9.329 1.071 11.038 1.00 35.60 C ATOM 3730 O THR E 58 -9.319 2.162 11.615 1.00 35.34 O ATOM 3731 CB THR E 58 -11.493 0.059 11.710 1.00 38.65 C ATOM 3732 OG1 THR E 58 -12.110 -1.093 12.298 1.00 41.04 O ATOM 3733 CG2 THR E 58 -12.029 0.255 10.296 1.00 35.43 C ATOM 0 H THR E 58 -9.762 0.261 13.601 1.00 38.79 H new ATOM 0 HA THR E 58 -9.775 -0.953 11.186 1.00 37.87 H new ATOM 0 HB THR E 58 -11.698 0.850 12.233 1.00 38.65 H new ATOM 0 HG1 THR E 58 -12.943 -0.987 12.316 1.00 41.04 H new ATOM 0 HG21 THR E 58 -12.990 0.381 10.329 1.00 35.43 H new ATOM 0 HG22 THR E 58 -11.614 1.036 9.898 1.00 35.43 H new ATOM 0 HG23 THR E 58 -11.824 -0.527 9.761 1.00 35.43 H new ATOM 3734 N TRP E 59 -8.791 0.875 9.841 1.00 33.76 N ATOM 3735 CA TRP E 59 -8.155 1.965 9.127 1.00 34.03 C ATOM 3736 C TRP E 59 -9.189 2.967 8.636 1.00 34.70 C ATOM 3737 O TRP E 59 -10.081 2.639 7.856 1.00 33.63 O ATOM 3738 CB TRP E 59 -7.333 1.423 7.958 1.00 33.10 C ATOM 3739 CG TRP E 59 -6.045 0.780 8.395 1.00 31.27 C ATOM 3740 CD1 TRP E 59 -5.589 -0.452 8.041 1.00 31.08 C ATOM 3741 CD2 TRP E 59 -5.043 1.350 9.248 1.00 28.34 C ATOM 3742 NE1 TRP E 59 -4.364 -0.689 8.617 1.00 33.23 N ATOM 3743 CE2 TRP E 59 -4.005 0.401 9.363 1.00 29.74 C ATOM 3744 CE3 TRP E 59 -4.922 2.571 9.926 1.00 28.19 C ATOM 3745 CZ2 TRP E 59 -2.855 0.631 10.129 1.00 29.37 C ATOM 3746 CZ3 TRP E 59 -3.776 2.803 10.690 1.00 29.95 C ATOM 3747 CH2 TRP E 59 -2.758 1.833 10.783 1.00 30.10 C ATOM 0 H TRP E 59 -8.785 0.120 9.428 1.00 33.76 H new ATOM 0 HA TRP E 59 -7.559 2.425 9.738 1.00 34.03 H new ATOM 0 HB2 TRP E 59 -7.863 0.774 7.469 1.00 33.10 H new ATOM 0 HB3 TRP E 59 -7.135 2.148 7.344 1.00 33.10 H new ATOM 0 HD1 TRP E 59 -6.041 -1.048 7.489 1.00 31.08 H new ATOM 0 HE1 TRP E 59 -3.898 -1.406 8.524 1.00 33.23 H new ATOM 0 HE3 TRP E 59 -5.592 3.214 9.868 1.00 28.19 H new ATOM 0 HZ2 TRP E 59 -2.182 -0.008 10.192 1.00 29.37 H new ATOM 0 HZ3 TRP E 59 -3.683 3.609 11.144 1.00 29.95 H new ATOM 0 HH2 TRP E 59 -2.005 2.011 11.298 1.00 30.10 H new ATOM 3748 N LYS E 60 -9.046 4.190 9.128 1.00 35.48 N ATOM 3749 CA LYS E 60 -9.917 5.306 8.806 1.00 38.36 C ATOM 3750 C LYS E 60 -9.046 6.546 8.966 1.00 38.17 C ATOM 3751 O LYS E 60 -7.888 6.437 9.364 1.00 38.95 O ATOM 3752 CB LYS E 60 -11.095 5.338 9.786 1.00 39.47 C ATOM 3753 CG LYS E 60 -10.689 4.999 11.217 1.00 40.99 C ATOM 3754 CD LYS E 60 -11.874 4.529 12.058 1.00 45.75 C ATOM 3755 CE LYS E 60 -12.699 5.689 12.565 1.00 46.41 C ATOM 3756 NZ LYS E 60 -11.940 6.497 13.566 1.00 50.48 N ATOM 0 H LYS E 60 -8.418 4.398 9.677 1.00 35.48 H new ATOM 0 HA LYS E 60 -10.290 5.245 7.913 1.00 38.36 H new ATOM 0 HB2 LYS E 60 -11.499 6.220 9.770 1.00 39.47 H new ATOM 0 HB3 LYS E 60 -11.773 4.710 9.490 1.00 39.47 H new ATOM 0 HG2 LYS E 60 -10.010 4.307 11.203 1.00 40.99 H new ATOM 0 HG3 LYS E 60 -10.290 5.780 11.632 1.00 40.99 H new ATOM 0 HD2 LYS E 60 -12.434 3.941 11.527 1.00 45.75 H new ATOM 0 HD3 LYS E 60 -11.551 4.009 12.810 1.00 45.75 H new ATOM 0 HE2 LYS E 60 -12.959 6.254 11.820 1.00 46.41 H new ATOM 0 HE3 LYS E 60 -13.516 5.356 12.968 1.00 46.41 H new ATOM 0 HZ1 LYS E 60 -12.322 6.414 14.366 1.00 50.48 H new ATOM 0 HZ2 LYS E 60 -11.100 6.206 13.607 1.00 50.48 H new ATOM 0 HZ3 LYS E 60 -11.945 7.353 13.322 1.00 50.48 H new ATOM 3757 N GLU E 61 -9.586 7.717 8.656 1.00 37.95 N ATOM 3758 CA GLU E 61 -8.812 8.940 8.776 1.00 38.64 C ATOM 3759 C GLU E 61 -8.183 9.097 10.157 1.00 38.72 C ATOM 3760 O GLU E 61 -6.980 9.331 10.281 1.00 39.14 O ATOM 3761 CB GLU E 61 -9.689 10.149 8.461 1.00 39.95 C ATOM 3762 CG GLU E 61 -9.825 10.432 6.973 1.00 43.39 C ATOM 3763 CD GLU E 61 -10.755 11.593 6.689 1.00 45.33 C ATOM 3764 OE1 GLU E 61 -10.804 12.528 7.518 1.00 44.98 O ATOM 3765 OE2 GLU E 61 -11.427 11.579 5.634 1.00 46.42 O ATOM 0 H GLU E 61 -10.392 7.824 8.377 1.00 37.95 H new ATOM 0 HA GLU E 61 -8.087 8.885 8.134 1.00 38.64 H new ATOM 0 HB2 GLU E 61 -10.572 10.006 8.837 1.00 39.95 H new ATOM 0 HB3 GLU E 61 -9.318 10.931 8.899 1.00 39.95 H new ATOM 0 HG2 GLU E 61 -8.950 10.624 6.601 1.00 43.39 H new ATOM 0 HG3 GLU E 61 -10.156 9.638 6.524 1.00 43.39 H new ATOM 3766 N GLU E 62 -8.998 8.965 11.193 1.00 38.43 N ATOM 3767 CA GLU E 62 -8.519 9.101 12.558 1.00 39.22 C ATOM 3768 C GLU E 62 -7.347 8.168 12.870 1.00 36.70 C ATOM 3769 O GLU E 62 -6.316 8.614 13.372 1.00 37.22 O ATOM 3770 CB GLU E 62 -9.673 8.858 13.541 1.00 43.27 C ATOM 3771 CG GLU E 62 -10.758 9.949 13.511 1.00 49.62 C ATOM 3772 CD GLU E 62 -11.530 10.023 12.184 1.00 52.66 C ATOM 3773 OE1 GLU E 62 -12.076 11.109 11.879 1.00 53.73 O ATOM 3774 OE2 GLU E 62 -11.605 9.005 11.455 1.00 53.13 O ATOM 0 H GLU E 62 -9.838 8.795 11.126 1.00 38.43 H new ATOM 0 HA GLU E 62 -8.187 10.007 12.658 1.00 39.22 H new ATOM 0 HB2 GLU E 62 -10.082 8.002 13.340 1.00 43.27 H new ATOM 0 HB3 GLU E 62 -9.313 8.797 14.440 1.00 43.27 H new ATOM 0 HG2 GLU E 62 -11.386 9.788 14.232 1.00 49.62 H new ATOM 0 HG3 GLU E 62 -10.344 10.809 13.683 1.00 49.62 H new ATOM 3775 N THR E 63 -7.492 6.881 12.566 1.00 35.91 N ATOM 3776 CA THR E 63 -6.421 5.926 12.842 1.00 34.07 C ATOM 3777 C THR E 63 -5.168 6.154 11.985 1.00 33.20 C ATOM 3778 O THR E 63 -4.046 6.096 12.496 1.00 33.36 O ATOM 3779 CB THR E 63 -6.917 4.477 12.693 1.00 33.21 C ATOM 3780 OG1 THR E 63 -7.671 4.335 11.484 1.00 32.66 O ATOM 3781 CG2 THR E 63 -7.794 4.108 13.875 1.00 34.94 C ATOM 0 H THR E 63 -8.194 6.543 12.203 1.00 35.91 H new ATOM 0 HA THR E 63 -6.160 6.078 13.764 1.00 34.07 H new ATOM 0 HB THR E 63 -6.147 3.887 12.662 1.00 33.21 H new ATOM 0 HG1 THR E 63 -8.119 3.625 11.515 1.00 32.66 H new ATOM 0 HG21 THR E 63 -8.104 3.194 13.776 1.00 34.94 H new ATOM 0 HG22 THR E 63 -7.282 4.188 14.695 1.00 34.94 H new ATOM 0 HG23 THR E 63 -8.557 4.705 13.911 1.00 34.94 H new ATOM 3782 N LEU E 64 -5.351 6.428 10.695 1.00 30.54 N ATOM 3783 CA LEU E 64 -4.212 6.686 9.813 1.00 30.23 C ATOM 3784 C LEU E 64 -3.460 7.943 10.213 1.00 28.44 C ATOM 3785 O LEU E 64 -2.229 7.970 10.163 1.00 28.86 O ATOM 3786 CB LEU E 64 -4.652 6.823 8.352 1.00 27.68 C ATOM 3787 CG LEU E 64 -4.924 5.512 7.620 1.00 30.37 C ATOM 3788 CD1 LEU E 64 -5.450 5.800 6.225 1.00 29.25 C ATOM 3789 CD2 LEU E 64 -3.644 4.695 7.547 1.00 30.09 C ATOM 0 H LEU E 64 -6.120 6.469 10.312 1.00 30.54 H new ATOM 0 HA LEU E 64 -3.623 5.921 9.903 1.00 30.23 H new ATOM 0 HB2 LEU E 64 -5.456 7.364 8.323 1.00 27.68 H new ATOM 0 HB3 LEU E 64 -3.966 7.309 7.868 1.00 27.68 H new ATOM 0 HG LEU E 64 -5.594 5.004 8.104 1.00 30.37 H new ATOM 0 HD11 LEU E 64 -5.621 4.964 5.764 1.00 29.25 H new ATOM 0 HD12 LEU E 64 -6.274 6.308 6.288 1.00 29.25 H new ATOM 0 HD13 LEU E 64 -4.792 6.312 5.730 1.00 29.25 H new ATOM 0 HD21 LEU E 64 -3.818 3.862 7.082 1.00 30.09 H new ATOM 0 HD22 LEU E 64 -2.966 5.197 7.068 1.00 30.09 H new ATOM 0 HD23 LEU E 64 -3.330 4.504 8.445 1.00 30.09 H new ATOM 3790 N MET E 65 -4.185 8.991 10.599 1.00 28.79 N ATOM 3791 CA MET E 65 -3.523 10.228 11.004 1.00 27.90 C ATOM 3792 C MET E 65 -2.512 9.942 12.115 1.00 28.56 C ATOM 3793 O MET E 65 -1.383 10.431 12.076 1.00 30.49 O ATOM 3794 CB MET E 65 -4.537 11.263 11.500 1.00 31.60 C ATOM 3795 CG MET E 65 -5.222 12.077 10.410 1.00 30.95 C ATOM 3796 SD MET E 65 -4.076 13.017 9.387 1.00 33.40 S ATOM 3797 CE MET E 65 -3.754 14.440 10.434 1.00 30.20 C ATOM 0 H MET E 65 -5.044 9.007 10.633 1.00 28.79 H new ATOM 0 HA MET E 65 -3.067 10.588 10.227 1.00 27.90 H new ATOM 0 HB2 MET E 65 -5.218 10.805 12.017 1.00 31.60 H new ATOM 0 HB3 MET E 65 -4.085 11.873 12.103 1.00 31.60 H new ATOM 0 HG2 MET E 65 -5.734 11.479 9.843 1.00 30.95 H new ATOM 0 HG3 MET E 65 -5.853 12.688 10.821 1.00 30.95 H new ATOM 0 HE1 MET E 65 -3.022 14.956 10.062 1.00 30.20 H new ATOM 0 HE2 MET E 65 -4.549 14.994 10.481 1.00 30.20 H new ATOM 0 HE3 MET E 65 -3.517 14.139 11.325 1.00 30.20 H new ATOM 3798 N GLU E 66 -2.909 9.140 13.099 1.00 28.26 N ATOM 3799 CA GLU E 66 -2.013 8.819 14.215 1.00 27.63 C ATOM 3800 C GLU E 66 -0.891 7.868 13.790 1.00 25.43 C ATOM 3801 O GLU E 66 0.266 8.067 14.141 1.00 22.20 O ATOM 3802 CB GLU E 66 -2.803 8.199 15.371 1.00 29.52 C ATOM 3803 CG GLU E 66 -2.091 8.282 16.725 1.00 32.60 C ATOM 3804 CD GLU E 66 -2.813 7.505 17.821 1.00 35.04 C ATOM 3805 OE1 GLU E 66 -4.060 7.513 17.835 1.00 32.27 O ATOM 3806 OE2 GLU E 66 -2.132 6.895 18.676 1.00 36.87 O ATOM 0 H GLU E 66 -3.685 8.773 13.143 1.00 28.26 H new ATOM 0 HA GLU E 66 -1.607 9.650 14.507 1.00 27.63 H new ATOM 0 HB2 GLU E 66 -3.662 8.644 15.439 1.00 29.52 H new ATOM 0 HB3 GLU E 66 -2.982 7.268 15.166 1.00 29.52 H new ATOM 0 HG2 GLU E 66 -1.188 7.939 16.633 1.00 32.60 H new ATOM 0 HG3 GLU E 66 -2.016 9.212 16.990 1.00 32.60 H new ATOM 3807 N TYR E 67 -1.243 6.834 13.032 1.00 25.63 N ATOM 3808 CA TYR E 67 -0.263 5.862 12.565 1.00 25.84 C ATOM 3809 C TYR E 67 0.851 6.522 11.767 1.00 26.16 C ATOM 3810 O TYR E 67 2.030 6.325 12.055 1.00 25.43 O ATOM 3811 CB TYR E 67 -0.939 4.804 11.694 1.00 23.82 C ATOM 3812 CG TYR E 67 0.023 3.847 11.012 1.00 25.54 C ATOM 3813 CD1 TYR E 67 0.750 2.902 11.742 1.00 24.34 C ATOM 3814 CD2 TYR E 67 0.186 3.873 9.629 1.00 25.47 C ATOM 3815 CE1 TYR E 67 1.612 2.004 11.103 1.00 24.65 C ATOM 3816 CE2 TYR E 67 1.041 2.984 8.981 1.00 25.78 C ATOM 3817 CZ TYR E 67 1.749 2.053 9.716 1.00 25.82 C ATOM 3818 OH TYR E 67 2.569 1.167 9.052 1.00 22.70 O ATOM 0 H TYR E 67 -2.049 6.678 12.776 1.00 25.63 H new ATOM 0 HA TYR E 67 0.125 5.447 13.351 1.00 25.84 H new ATOM 0 HB2 TYR E 67 -1.553 4.292 12.244 1.00 23.82 H new ATOM 0 HB3 TYR E 67 -1.470 5.250 11.016 1.00 23.82 H new ATOM 0 HD1 TYR E 67 0.659 2.870 12.667 1.00 24.34 H new ATOM 0 HD2 TYR E 67 -0.286 4.497 9.127 1.00 25.47 H new ATOM 0 HE1 TYR E 67 2.090 1.379 11.599 1.00 24.65 H new ATOM 0 HE2 TYR E 67 1.135 3.017 8.056 1.00 25.78 H new ATOM 0 HH TYR E 67 2.189 0.906 8.349 1.00 22.70 H new ATOM 3819 N LEU E 68 0.464 7.310 10.769 1.00 26.02 N ATOM 3820 CA LEU E 68 1.420 7.986 9.903 1.00 27.37 C ATOM 3821 C LEU E 68 2.343 8.977 10.602 1.00 27.32 C ATOM 3822 O LEU E 68 3.447 9.221 10.130 1.00 27.41 O ATOM 3823 CB LEU E 68 0.680 8.661 8.739 1.00 26.40 C ATOM 3824 CG LEU E 68 0.140 7.630 7.740 1.00 23.79 C ATOM 3825 CD1 LEU E 68 -0.753 8.291 6.708 1.00 28.48 C ATOM 3826 CD2 LEU E 68 1.306 6.934 7.062 1.00 26.57 C ATOM 0 H LEU E 68 -0.359 7.467 10.576 1.00 26.02 H new ATOM 0 HA LEU E 68 2.012 7.291 9.575 1.00 27.37 H new ATOM 0 HB2 LEU E 68 -0.054 9.192 9.086 1.00 26.40 H new ATOM 0 HB3 LEU E 68 1.281 9.271 8.283 1.00 26.40 H new ATOM 0 HG LEU E 68 -0.394 6.977 8.219 1.00 23.79 H new ATOM 0 HD11 LEU E 68 -1.082 7.621 6.088 1.00 28.48 H new ATOM 0 HD12 LEU E 68 -1.503 8.715 7.153 1.00 28.48 H new ATOM 0 HD13 LEU E 68 -0.246 8.960 6.222 1.00 28.48 H new ATOM 0 HD21 LEU E 68 0.969 6.281 6.429 1.00 26.57 H new ATOM 0 HD22 LEU E 68 1.846 7.589 6.593 1.00 26.57 H new ATOM 0 HD23 LEU E 68 1.849 6.487 7.730 1.00 26.57 H new ATOM 3827 N GLU E 69 1.911 9.543 11.724 1.00 27.77 N ATOM 3828 CA GLU E 69 2.776 10.478 12.436 1.00 29.18 C ATOM 3829 C GLU E 69 3.979 9.732 13.032 1.00 28.03 C ATOM 3830 O GLU E 69 5.088 10.252 13.051 1.00 27.90 O ATOM 3831 CB GLU E 69 2.002 11.209 13.547 1.00 31.07 C ATOM 3832 CG GLU E 69 2.890 12.113 14.414 1.00 36.27 C ATOM 3833 CD GLU E 69 2.097 13.008 15.359 1.00 38.34 C ATOM 3834 OE1 GLU E 69 1.132 12.522 15.982 1.00 41.21 O ATOM 3835 OE2 GLU E 69 2.446 14.198 15.490 1.00 38.87 O ATOM 0 H GLU E 69 1.142 9.405 12.083 1.00 27.77 H new ATOM 0 HA GLU E 69 3.094 11.141 11.803 1.00 29.18 H new ATOM 0 HB2 GLU E 69 1.301 11.745 13.145 1.00 31.07 H new ATOM 0 HB3 GLU E 69 1.567 10.553 14.115 1.00 31.07 H new ATOM 0 HG2 GLU E 69 3.495 11.560 14.933 1.00 36.27 H new ATOM 0 HG3 GLU E 69 3.438 12.668 13.837 1.00 36.27 H new ATOM 3836 N ASN E 70 3.754 8.509 13.508 1.00 28.51 N ATOM 3837 CA ASN E 70 4.824 7.692 14.095 1.00 28.19 C ATOM 3838 C ASN E 70 4.342 6.239 14.142 1.00 25.88 C ATOM 3839 O ASN E 70 3.784 5.793 15.148 1.00 23.79 O ATOM 3840 CB ASN E 70 5.147 8.175 15.513 1.00 26.49 C ATOM 3841 CG ASN E 70 6.353 7.463 16.116 1.00 28.77 C ATOM 3842 OD1 ASN E 70 6.671 6.331 15.746 1.00 24.72 O ATOM 3843 ND2 ASN E 70 7.019 8.123 17.066 1.00 25.39 N ATOM 0 H ASN E 70 2.983 8.128 13.502 1.00 28.51 H new ATOM 0 HA ASN E 70 5.628 7.767 13.558 1.00 28.19 H new ATOM 0 HB2 ASN E 70 5.316 9.130 15.495 1.00 26.49 H new ATOM 0 HB3 ASN E 70 4.375 8.034 16.083 1.00 26.49 H new ATOM 0 HD21 ASN E 70 7.699 7.759 17.446 1.00 25.39 H new ATOM 0 HD22 ASN E 70 6.768 8.912 17.298 1.00 25.39 H new ATOM 3844 N PRO E 71 4.563 5.485 13.050 1.00 23.60 N ATOM 3845 CA PRO E 71 4.168 4.084 12.900 1.00 22.63 C ATOM 3846 C PRO E 71 4.518 3.148 14.057 1.00 23.73 C ATOM 3847 O PRO E 71 3.645 2.483 14.612 1.00 22.00 O ATOM 3848 CB PRO E 71 4.863 3.671 11.603 1.00 21.62 C ATOM 3849 CG PRO E 71 4.862 4.936 10.822 1.00 24.64 C ATOM 3850 CD PRO E 71 5.291 5.942 11.852 1.00 23.56 C ATOM 0 HA PRO E 71 3.201 4.008 12.889 1.00 22.63 H new ATOM 0 HB2 PRO E 71 5.763 3.346 11.763 1.00 21.62 H new ATOM 0 HB3 PRO E 71 4.383 2.963 11.145 1.00 21.62 H new ATOM 0 HG2 PRO E 71 5.476 4.900 10.072 1.00 24.64 H new ATOM 0 HG3 PRO E 71 3.985 5.138 10.460 1.00 24.64 H new ATOM 0 HD2 PRO E 71 6.252 5.936 11.987 1.00 23.56 H new ATOM 0 HD3 PRO E 71 5.045 6.846 11.601 1.00 23.56 H new ATOM 3851 N LYS E 72 5.795 3.090 14.406 1.00 22.95 N ATOM 3852 CA LYS E 72 6.231 2.207 15.471 1.00 24.24 C ATOM 3853 C LYS E 72 5.645 2.548 16.833 1.00 25.24 C ATOM 3854 O LYS E 72 5.514 1.669 17.679 1.00 25.25 O ATOM 3855 CB LYS E 72 7.761 2.152 15.513 0.50 21.09 C ATOM 3856 CG LYS E 72 8.311 1.432 14.294 0.50 21.01 C ATOM 3857 CD LYS E 72 9.804 1.155 14.345 0.50 20.20 C ATOM 3858 CE LYS E 72 10.228 0.467 13.049 0.50 19.53 C ATOM 3859 NZ LYS E 72 11.638 -0.005 13.064 0.50 20.04 N ATOM 0 H LYS E 72 6.421 3.552 14.040 1.00 22.95 H new ATOM 0 HA LYS E 72 5.884 1.325 15.263 1.00 24.24 H new ATOM 0 HB2 LYS E 72 8.120 3.052 15.551 0.50 21.09 H new ATOM 0 HB3 LYS E 72 8.050 1.697 16.320 0.50 21.09 H new ATOM 0 HG2 LYS E 72 7.841 0.590 14.191 0.50 21.01 H new ATOM 0 HG3 LYS E 72 8.119 1.963 13.505 0.50 21.01 H new ATOM 0 HD2 LYS E 72 10.295 1.984 14.460 0.50 20.20 H new ATOM 0 HD3 LYS E 72 10.014 0.593 15.107 0.50 20.20 H new ATOM 0 HE2 LYS E 72 9.643 -0.289 12.886 0.50 19.53 H new ATOM 0 HE3 LYS E 72 10.108 1.083 12.310 0.50 19.53 H new ATOM 0 HZ1 LYS E 72 11.799 -0.484 12.331 0.50 20.04 H new ATOM 0 HZ2 LYS E 72 12.186 0.696 13.086 0.50 20.04 H new ATOM 0 HZ3 LYS E 72 11.774 -0.511 13.784 0.50 20.04 H new ATOM 3860 N LYS E 73 5.279 3.810 17.046 1.00 26.95 N ATOM 3861 CA LYS E 73 4.670 4.193 18.316 1.00 27.26 C ATOM 3862 C LYS E 73 3.237 3.673 18.306 1.00 28.99 C ATOM 3863 O LYS E 73 2.738 3.161 19.315 1.00 30.22 O ATOM 3864 CB LYS E 73 4.656 5.712 18.490 0.50 25.00 C ATOM 3865 CG LYS E 73 3.881 6.168 19.716 0.50 25.09 C ATOM 3866 CD LYS E 73 4.019 7.663 19.940 0.50 25.44 C ATOM 3867 CE LYS E 73 3.182 8.124 21.115 0.50 25.43 C ATOM 3868 NZ LYS E 73 3.402 9.569 21.409 0.50 26.55 N ATOM 0 H LYS E 73 5.373 4.449 16.479 1.00 26.95 H new ATOM 0 HA LYS E 73 5.182 3.818 19.050 1.00 27.26 H new ATOM 0 HB2 LYS E 73 5.569 6.033 18.554 0.50 25.00 H new ATOM 0 HB3 LYS E 73 4.268 6.119 17.700 0.50 25.00 H new ATOM 0 HG2 LYS E 73 2.944 5.941 19.610 0.50 25.09 H new ATOM 0 HG3 LYS E 73 4.202 5.692 20.498 0.50 25.09 H new ATOM 0 HD2 LYS E 73 4.950 7.884 20.097 0.50 25.44 H new ATOM 0 HD3 LYS E 73 3.746 8.138 19.140 0.50 25.44 H new ATOM 0 HE2 LYS E 73 2.243 7.971 20.925 0.50 25.43 H new ATOM 0 HE3 LYS E 73 3.403 7.596 21.898 0.50 25.43 H new ATOM 0 HZ1 LYS E 73 2.899 9.811 22.102 0.50 26.55 H new ATOM 0 HZ2 LYS E 73 4.260 9.705 21.604 0.50 26.55 H new ATOM 0 HZ3 LYS E 73 3.179 10.054 20.697 0.50 26.55 H new ATOM 3869 N TYR E 74 2.583 3.793 17.154 1.00 27.52 N ATOM 3870 CA TYR E 74 1.204 3.341 17.015 1.00 26.98 C ATOM 3871 C TYR E 74 1.121 1.824 17.031 1.00 26.30 C ATOM 3872 O TYR E 74 0.187 1.256 17.594 1.00 27.65 O ATOM 3873 CB TYR E 74 0.587 3.877 15.718 1.00 28.94 C ATOM 3874 CG TYR E 74 -0.928 3.747 15.653 1.00 28.69 C ATOM 3875 CD1 TYR E 74 -1.748 4.408 16.576 1.00 29.71 C ATOM 3876 CD2 TYR E 74 -1.541 2.995 14.650 1.00 29.83 C ATOM 3877 CE1 TYR E 74 -3.147 4.328 16.494 1.00 28.94 C ATOM 3878 CE2 TYR E 74 -2.931 2.907 14.557 1.00 29.40 C ATOM 3879 CZ TYR E 74 -3.728 3.577 15.479 1.00 30.01 C ATOM 3880 OH TYR E 74 -5.097 3.509 15.368 1.00 30.06 O ATOM 0 H TYR E 74 2.921 4.134 16.441 1.00 27.52 H new ATOM 0 HA TYR E 74 0.705 3.687 17.771 1.00 26.98 H new ATOM 0 HB2 TYR E 74 0.827 4.812 15.619 1.00 28.94 H new ATOM 0 HB3 TYR E 74 0.976 3.403 14.966 1.00 28.94 H new ATOM 0 HD1 TYR E 74 -1.358 4.909 17.256 1.00 29.71 H new ATOM 0 HD2 TYR E 74 -1.013 2.544 14.031 1.00 29.83 H new ATOM 0 HE1 TYR E 74 -3.680 4.773 17.113 1.00 28.94 H new ATOM 0 HE2 TYR E 74 -3.323 2.402 13.881 1.00 29.40 H new ATOM 0 HH TYR E 74 -5.301 3.024 14.713 1.00 30.06 H new ATOM 3881 N ILE E 75 2.092 1.162 16.410 1.00 23.34 N ATOM 3882 CA ILE E 75 2.095 -0.288 16.393 1.00 22.47 C ATOM 3883 C ILE E 75 3.483 -0.810 16.760 1.00 24.52 C ATOM 3884 O ILE E 75 4.264 -1.185 15.886 1.00 23.37 O ATOM 3885 CB ILE E 75 1.684 -0.854 14.998 1.00 22.48 C ATOM 3886 CG1 ILE E 75 0.348 -0.252 14.545 1.00 22.51 C ATOM 3887 CG2 ILE E 75 1.532 -2.366 15.086 1.00 18.02 C ATOM 3888 CD1 ILE E 75 -0.174 -0.831 13.238 1.00 23.26 C ATOM 0 H ILE E 75 2.750 1.532 15.998 1.00 23.34 H new ATOM 0 HA ILE E 75 1.442 -0.588 17.045 1.00 22.47 H new ATOM 0 HB ILE E 75 2.374 -0.622 14.358 1.00 22.48 H new ATOM 0 HG12 ILE E 75 -0.314 -0.395 15.240 1.00 22.51 H new ATOM 0 HG13 ILE E 75 0.452 0.707 14.445 1.00 22.51 H new ATOM 0 HG21 ILE E 75 1.277 -2.717 14.218 1.00 18.02 H new ATOM 0 HG22 ILE E 75 2.375 -2.761 15.358 1.00 18.02 H new ATOM 0 HG23 ILE E 75 0.847 -2.585 15.737 1.00 18.02 H new ATOM 0 HD11 ILE E 75 -1.017 -0.409 13.011 1.00 23.26 H new ATOM 0 HD12 ILE E 75 0.470 -0.667 12.531 1.00 23.26 H new ATOM 0 HD13 ILE E 75 -0.308 -1.787 13.338 1.00 23.26 H new ATOM 3889 N PRO E 76 3.812 -0.837 18.066 1.00 24.89 N ATOM 3890 CA PRO E 76 5.143 -1.338 18.418 1.00 24.53 C ATOM 3891 C PRO E 76 5.393 -2.752 17.893 1.00 24.84 C ATOM 3892 O PRO E 76 4.497 -3.605 17.883 1.00 26.15 O ATOM 3893 CB PRO E 76 5.178 -1.224 19.947 1.00 23.03 C ATOM 3894 CG PRO E 76 3.736 -1.086 20.351 1.00 26.09 C ATOM 3895 CD PRO E 76 3.108 -0.308 19.245 1.00 23.37 C ATOM 0 HA PRO E 76 5.861 -0.832 18.007 1.00 24.53 H new ATOM 0 HB2 PRO E 76 5.584 -2.008 20.350 1.00 23.03 H new ATOM 0 HB3 PRO E 76 5.699 -0.457 20.232 1.00 23.03 H new ATOM 0 HG2 PRO E 76 3.314 -1.953 20.456 1.00 26.09 H new ATOM 0 HG3 PRO E 76 3.650 -0.625 21.200 1.00 26.09 H new ATOM 0 HD2 PRO E 76 2.151 -0.456 19.194 1.00 23.37 H new ATOM 0 HD3 PRO E 76 3.242 0.647 19.350 1.00 23.37 H new ATOM 3896 N GLY E 77 6.613 -2.978 17.426 1.00 22.15 N ATOM 3897 CA GLY E 77 6.961 -4.269 16.876 1.00 23.94 C ATOM 3898 C GLY E 77 6.827 -4.305 15.362 1.00 24.23 C ATOM 3899 O GLY E 77 7.334 -5.227 14.718 1.00 24.46 O ATOM 0 H GLY E 77 7.248 -2.398 17.420 1.00 22.15 H new ATOM 0 HA2 GLY E 77 7.873 -4.489 17.123 1.00 23.94 H new ATOM 0 HA3 GLY E 77 6.390 -4.949 17.266 1.00 23.94 H new ATOM 3900 N THR E 78 6.149 -3.317 14.778 1.00 24.12 N ATOM 3901 CA THR E 78 5.995 -3.311 13.325 1.00 24.59 C ATOM 3902 C THR E 78 7.355 -3.116 12.657 1.00 24.51 C ATOM 3903 O THR E 78 8.208 -2.385 13.161 1.00 23.20 O ATOM 3904 CB THR E 78 5.026 -2.202 12.844 1.00 23.85 C ATOM 3905 OG1 THR E 78 4.834 -2.329 11.427 1.00 28.58 O ATOM 3906 CG2 THR E 78 5.585 -0.822 13.150 1.00 22.87 C ATOM 0 H THR E 78 5.780 -2.659 15.191 1.00 24.12 H new ATOM 0 HA THR E 78 5.617 -4.168 13.073 1.00 24.59 H new ATOM 0 HB THR E 78 4.182 -2.304 13.311 1.00 23.85 H new ATOM 0 HG1 THR E 78 4.593 -3.113 11.246 1.00 28.58 H new ATOM 0 HG21 THR E 78 4.963 -0.145 12.841 1.00 22.87 H new ATOM 0 HG22 THR E 78 5.713 -0.730 14.107 1.00 22.87 H new ATOM 0 HG23 THR E 78 6.436 -0.710 12.698 1.00 22.87 H new ATOM 3907 N LYS E 79 7.555 -3.779 11.524 1.00 25.26 N ATOM 3908 CA LYS E 79 8.816 -3.685 10.794 1.00 26.67 C ATOM 3909 C LYS E 79 8.602 -3.197 9.362 1.00 26.73 C ATOM 3910 O LYS E 79 7.768 -3.743 8.642 1.00 26.24 O ATOM 3911 CB LYS E 79 9.493 -5.058 10.770 1.00 28.84 C ATOM 3912 CG LYS E 79 9.654 -5.692 12.141 1.00 26.53 C ATOM 3913 CD LYS E 79 10.501 -4.822 13.049 1.00 31.65 C ATOM 3914 CE LYS E 79 10.615 -5.439 14.445 1.00 33.83 C ATOM 3915 NZ LYS E 79 11.449 -4.598 15.348 1.00 36.24 N ATOM 0 H LYS E 79 6.970 -4.292 11.158 1.00 25.26 H new ATOM 0 HA LYS E 79 9.380 -3.040 11.249 1.00 26.67 H new ATOM 0 HB2 LYS E 79 8.975 -5.654 10.207 1.00 28.84 H new ATOM 0 HB3 LYS E 79 10.368 -4.970 10.360 1.00 28.84 H new ATOM 0 HG2 LYS E 79 8.781 -5.829 12.542 1.00 26.53 H new ATOM 0 HG3 LYS E 79 10.065 -6.566 12.050 1.00 26.53 H new ATOM 0 HD2 LYS E 79 11.386 -4.713 12.666 1.00 31.65 H new ATOM 0 HD3 LYS E 79 10.109 -3.937 13.113 1.00 31.65 H new ATOM 0 HE2 LYS E 79 9.729 -5.545 14.826 1.00 33.83 H new ATOM 0 HE3 LYS E 79 11.003 -6.326 14.377 1.00 33.83 H new ATOM 0 HZ1 LYS E 79 11.077 -4.570 16.156 1.00 36.24 H new ATOM 0 HZ2 LYS E 79 12.265 -4.947 15.410 1.00 36.24 H new ATOM 0 HZ3 LYS E 79 11.504 -3.773 15.019 1.00 36.24 H new ATOM 3916 N MET E 80 9.368 -2.185 8.955 1.00 28.22 N ATOM 3917 CA MET E 80 9.265 -1.617 7.604 1.00 30.21 C ATOM 3918 C MET E 80 10.143 -2.324 6.569 1.00 29.64 C ATOM 3919 O MET E 80 9.942 -2.165 5.366 1.00 26.88 O ATOM 3920 CB MET E 80 9.635 -0.129 7.615 1.00 32.35 C ATOM 3921 CG MET E 80 8.473 0.815 7.323 1.00 37.61 C ATOM 3922 SD MET E 80 7.464 1.171 8.765 1.00 40.53 S ATOM 3923 CE MET E 80 6.429 -0.258 8.833 1.00 36.17 C ATOM 0 H MET E 80 9.961 -1.808 9.450 1.00 28.22 H new ATOM 0 HA MET E 80 8.340 -1.744 7.342 1.00 30.21 H new ATOM 0 HB2 MET E 80 10.007 0.093 8.483 1.00 32.35 H new ATOM 0 HB3 MET E 80 10.333 0.024 6.959 1.00 32.35 H new ATOM 0 HG2 MET E 80 8.823 1.647 6.968 1.00 37.61 H new ATOM 0 HG3 MET E 80 7.913 0.425 6.633 1.00 37.61 H new ATOM 0 HE1 MET E 80 5.567 -0.016 9.207 1.00 36.17 H new ATOM 0 HE2 MET E 80 6.305 -0.611 7.938 1.00 36.17 H new ATOM 0 HE3 MET E 80 6.845 -0.933 9.391 1.00 36.17 H new ATOM 3924 N ILE E 81 11.131 -3.081 7.033 1.00 28.64 N ATOM 3925 CA ILE E 81 12.012 -3.795 6.119 1.00 30.15 C ATOM 3926 C ILE E 81 12.174 -5.249 6.549 1.00 29.84 C ATOM 3927 O ILE E 81 11.811 -5.616 7.672 1.00 27.25 O ATOM 3928 CB ILE E 81 13.390 -3.117 6.027 1.00 30.98 C ATOM 3929 CG1 ILE E 81 14.064 -3.123 7.393 1.00 32.11 C ATOM 3930 CG2 ILE E 81 13.226 -1.681 5.515 1.00 30.81 C ATOM 3931 CD1 ILE E 81 15.379 -2.401 7.405 1.00 38.15 C ATOM 0 H ILE E 81 11.307 -3.194 7.867 1.00 28.64 H new ATOM 0 HA ILE E 81 11.602 -3.772 5.240 1.00 30.15 H new ATOM 0 HB ILE E 81 13.949 -3.608 5.405 1.00 30.98 H new ATOM 0 HG12 ILE E 81 13.471 -2.713 8.042 1.00 32.11 H new ATOM 0 HG13 ILE E 81 14.203 -4.041 7.675 1.00 32.11 H new ATOM 0 HG21 ILE E 81 14.096 -1.256 5.458 1.00 30.81 H new ATOM 0 HG22 ILE E 81 12.816 -1.695 4.636 1.00 30.81 H new ATOM 0 HG23 ILE E 81 12.662 -1.182 6.126 1.00 30.81 H new ATOM 0 HD11 ILE E 81 15.760 -2.437 8.296 1.00 38.15 H new ATOM 0 HD12 ILE E 81 15.986 -2.823 6.777 1.00 38.15 H new ATOM 0 HD13 ILE E 81 15.242 -1.475 7.150 1.00 38.15 H new ATOM 3932 N PHE E 82 12.705 -6.068 5.646 1.00 26.60 N ATOM 3933 CA PHE E 82 12.889 -7.488 5.904 1.00 28.97 C ATOM 3934 C PHE E 82 13.290 -7.826 7.340 1.00 28.93 C ATOM 3935 O PHE E 82 14.305 -7.347 7.847 1.00 27.69 O ATOM 3936 CB PHE E 82 13.925 -8.077 4.956 1.00 29.42 C ATOM 3937 CG PHE E 82 14.094 -9.548 5.115 1.00 31.71 C ATOM 3938 CD1 PHE E 82 13.041 -10.410 4.831 1.00 32.45 C ATOM 3939 CD2 PHE E 82 15.292 -10.077 5.580 1.00 32.05 C ATOM 3940 CE1 PHE E 82 13.177 -11.781 5.009 1.00 32.95 C ATOM 3941 CE2 PHE E 82 15.439 -11.443 5.760 1.00 32.56 C ATOM 3942 CZ PHE E 82 14.379 -12.299 5.474 1.00 32.83 C ATOM 0 H PHE E 82 12.968 -5.814 4.868 1.00 26.60 H new ATOM 0 HA PHE E 82 12.015 -7.882 5.755 1.00 28.97 H new ATOM 0 HB2 PHE E 82 13.665 -7.884 4.042 1.00 29.42 H new ATOM 0 HB3 PHE E 82 14.778 -7.641 5.107 1.00 29.42 H new ATOM 0 HD1 PHE E 82 12.236 -10.065 4.518 1.00 32.45 H new ATOM 0 HD2 PHE E 82 16.002 -9.508 5.772 1.00 32.05 H new ATOM 0 HE1 PHE E 82 12.466 -12.350 4.818 1.00 32.95 H new ATOM 0 HE2 PHE E 82 16.245 -11.788 6.071 1.00 32.56 H new ATOM 0 HZ PHE E 82 14.476 -13.216 5.594 1.00 32.83 H new ATOM 3943 N ALA E 83 12.481 -8.669 7.971 1.00 29.30 N ATOM 3944 CA ALA E 83 12.703 -9.095 9.341 1.00 29.92 C ATOM 3945 C ALA E 83 12.562 -10.606 9.455 1.00 31.00 C ATOM 3946 O ALA E 83 12.492 -11.141 10.560 1.00 31.00 O ATOM 3947 CB ALA E 83 11.705 -8.409 10.266 1.00 31.29 C ATOM 0 H ALA E 83 11.780 -9.012 7.609 1.00 29.30 H new ATOM 0 HA ALA E 83 13.603 -8.846 9.603 1.00 29.92 H new ATOM 0 HB1 ALA E 83 11.859 -8.698 11.179 1.00 31.29 H new ATOM 0 HB2 ALA E 83 11.818 -7.447 10.208 1.00 31.29 H new ATOM 0 HB3 ALA E 83 10.802 -8.645 10.000 1.00 31.29 H new ATOM 3948 N GLY E 84 12.509 -11.292 8.312 1.00 30.34 N ATOM 3949 CA GLY E 84 12.391 -12.740 8.327 1.00 30.51 C ATOM 3950 C GLY E 84 11.165 -13.316 7.642 1.00 31.17 C ATOM 3951 O GLY E 84 10.198 -12.604 7.379 1.00 30.89 O ATOM 0 H GLY E 84 12.540 -10.938 7.529 1.00 30.34 H new ATOM 0 HA2 GLY E 84 13.180 -13.115 7.907 1.00 30.51 H new ATOM 0 HA3 GLY E 84 12.393 -13.037 9.250 1.00 30.51 H new ATOM 3952 N ILE E 85 11.212 -14.613 7.354 1.00 31.30 N ATOM 3953 CA ILE E 85 10.104 -15.318 6.706 1.00 31.28 C ATOM 3954 C ILE E 85 9.474 -16.288 7.710 1.00 30.62 C ATOM 3955 O ILE E 85 10.112 -17.239 8.148 1.00 30.03 O ATOM 3956 CB ILE E 85 10.594 -16.125 5.494 1.00 31.70 C ATOM 3957 CG1 ILE E 85 11.358 -15.212 4.534 1.00 36.29 C ATOM 3958 CG2 ILE E 85 9.405 -16.788 4.793 1.00 33.31 C ATOM 3959 CD1 ILE E 85 10.552 -14.059 4.008 1.00 36.97 C ATOM 0 H ILE E 85 11.889 -15.113 7.529 1.00 31.30 H new ATOM 0 HA ILE E 85 9.458 -14.660 6.405 1.00 31.28 H new ATOM 0 HB ILE E 85 11.197 -16.823 5.794 1.00 31.70 H new ATOM 0 HG12 ILE E 85 12.142 -14.865 4.988 1.00 36.29 H new ATOM 0 HG13 ILE E 85 11.675 -15.740 3.785 1.00 36.29 H new ATOM 0 HG21 ILE E 85 9.721 -17.296 4.029 1.00 33.31 H new ATOM 0 HG22 ILE E 85 8.955 -17.383 5.412 1.00 33.31 H new ATOM 0 HG23 ILE E 85 8.785 -16.106 4.493 1.00 33.31 H new ATOM 0 HD11 ILE E 85 11.100 -13.528 3.409 1.00 36.97 H new ATOM 0 HD12 ILE E 85 9.781 -14.396 3.526 1.00 36.97 H new ATOM 0 HD13 ILE E 85 10.254 -13.508 4.748 1.00 36.97 H new ATOM 3960 N LYS E 86 8.217 -16.055 8.059 1.00 30.88 N ATOM 3961 CA LYS E 86 7.530 -16.896 9.034 1.00 32.74 C ATOM 3962 C LYS E 86 7.297 -18.339 8.578 1.00 34.80 C ATOM 3963 O LYS E 86 7.776 -19.282 9.216 1.00 33.94 O ATOM 3964 CB LYS E 86 6.190 -16.252 9.418 0.50 31.12 C ATOM 3965 CG LYS E 86 5.417 -16.993 10.502 0.50 30.61 C ATOM 3966 CD LYS E 86 4.146 -16.244 10.890 0.50 29.52 C ATOM 3967 CE LYS E 86 3.331 -17.023 11.913 0.50 29.88 C ATOM 3968 NZ LYS E 86 2.081 -16.312 12.305 0.50 27.94 N ATOM 0 H LYS E 86 7.740 -15.413 7.743 1.00 30.88 H new ATOM 0 HA LYS E 86 8.123 -16.953 9.800 1.00 32.74 H new ATOM 0 HB2 LYS E 86 6.355 -15.344 9.718 0.50 31.12 H new ATOM 0 HB3 LYS E 86 5.635 -16.192 8.625 0.50 31.12 H new ATOM 0 HG2 LYS E 86 5.188 -17.882 10.188 0.50 30.61 H new ATOM 0 HG3 LYS E 86 5.980 -17.105 11.284 0.50 30.61 H new ATOM 0 HD2 LYS E 86 4.379 -15.375 11.254 0.50 29.52 H new ATOM 0 HD3 LYS E 86 3.608 -16.085 10.099 0.50 29.52 H new ATOM 0 HE2 LYS E 86 3.104 -17.893 11.548 0.50 29.88 H new ATOM 0 HE3 LYS E 86 3.872 -17.179 12.703 0.50 29.88 H new ATOM 0 HZ1 LYS E 86 1.636 -16.800 12.902 0.50 27.94 H new ATOM 0 HZ2 LYS E 86 2.287 -15.523 12.662 0.50 27.94 H new ATOM 0 HZ3 LYS E 86 1.572 -16.188 11.586 0.50 27.94 H new ATOM 3969 N LYS E 87 6.575 -18.507 7.471 1.00 35.91 N ATOM 3970 CA LYS E 87 6.243 -19.837 6.953 1.00 38.18 C ATOM 3971 C LYS E 87 7.412 -20.749 6.568 1.00 38.83 C ATOM 3972 O LYS E 87 8.193 -20.447 5.666 1.00 38.03 O ATOM 3973 CB LYS E 87 5.284 -19.710 5.762 0.50 37.96 C ATOM 3974 CG LYS E 87 4.788 -21.049 5.228 0.50 38.93 C ATOM 3975 CD LYS E 87 3.742 -20.879 4.134 0.50 39.27 C ATOM 3976 CE LYS E 87 2.457 -20.274 4.676 0.50 39.66 C ATOM 3977 NZ LYS E 87 1.802 -21.160 5.681 0.50 40.95 N ATOM 0 H LYS E 87 6.265 -17.858 7.000 1.00 35.91 H new ATOM 0 HA LYS E 87 5.833 -20.281 7.711 1.00 38.18 H new ATOM 0 HB2 LYS E 87 4.520 -19.174 6.028 0.50 37.96 H new ATOM 0 HB3 LYS E 87 5.731 -19.231 5.047 0.50 37.96 H new ATOM 0 HG2 LYS E 87 5.539 -21.555 4.880 0.50 38.93 H new ATOM 0 HG3 LYS E 87 4.411 -21.566 5.957 0.50 38.93 H new ATOM 0 HD2 LYS E 87 4.097 -20.311 3.432 0.50 39.27 H new ATOM 0 HD3 LYS E 87 3.550 -21.741 3.732 0.50 39.27 H new ATOM 0 HE2 LYS E 87 2.651 -19.415 5.082 0.50 39.66 H new ATOM 0 HE3 LYS E 87 1.844 -20.109 3.943 0.50 39.66 H new ATOM 0 HZ1 LYS E 87 0.960 -20.900 5.803 0.50 40.95 H new ATOM 0 HZ2 LYS E 87 1.813 -22.000 5.388 0.50 40.95 H new ATOM 0 HZ3 LYS E 87 2.242 -21.110 6.453 0.50 40.95 H new ATOM 3978 N LYS E 88 7.502 -21.882 7.260 1.00 39.10 N ATOM 3979 CA LYS E 88 8.541 -22.877 7.021 1.00 40.23 C ATOM 3980 C LYS E 88 8.542 -23.310 5.554 1.00 40.14 C ATOM 3981 O LYS E 88 9.584 -23.668 5.003 1.00 37.82 O ATOM 3982 CB LYS E 88 8.294 -24.090 7.928 1.00 42.68 C ATOM 3983 CG LYS E 88 9.165 -25.316 7.658 1.00 45.32 C ATOM 3984 CD LYS E 88 8.739 -26.470 8.573 1.00 49.66 C ATOM 3985 CE LYS E 88 9.379 -27.801 8.187 1.00 51.81 C ATOM 3986 NZ LYS E 88 10.859 -27.812 8.364 1.00 54.30 N ATOM 0 H LYS E 88 6.955 -22.096 7.888 1.00 39.10 H new ATOM 0 HA LYS E 88 9.407 -22.489 7.224 1.00 40.23 H new ATOM 0 HB2 LYS E 88 8.429 -23.816 8.849 1.00 42.68 H new ATOM 0 HB3 LYS E 88 7.364 -24.351 7.843 1.00 42.68 H new ATOM 0 HG2 LYS E 88 9.083 -25.582 6.729 1.00 45.32 H new ATOM 0 HG3 LYS E 88 10.098 -25.100 7.810 1.00 45.32 H new ATOM 0 HD2 LYS E 88 8.977 -26.255 9.489 1.00 49.66 H new ATOM 0 HD3 LYS E 88 7.774 -26.560 8.544 1.00 49.66 H new ATOM 0 HE2 LYS E 88 8.989 -28.509 8.724 1.00 51.81 H new ATOM 0 HE3 LYS E 88 9.168 -27.999 7.261 1.00 51.81 H new ATOM 0 HZ1 LYS E 88 11.253 -27.857 7.567 1.00 54.30 H new ATOM 0 HZ2 LYS E 88 11.114 -27.067 8.779 1.00 54.30 H new ATOM 0 HZ3 LYS E 88 11.095 -28.519 8.851 1.00 54.30 H new ATOM 3987 N THR E 89 7.365 -23.273 4.936 1.00 40.99 N ATOM 3988 CA THR E 89 7.195 -23.660 3.537 1.00 43.04 C ATOM 3989 C THR E 89 7.958 -22.744 2.583 1.00 42.03 C ATOM 3990 O THR E 89 8.741 -23.207 1.747 1.00 41.51 O ATOM 3991 CB THR E 89 5.699 -23.640 3.142 1.00 44.09 C ATOM 3992 OG1 THR E 89 5.008 -24.680 3.844 1.00 46.02 O ATOM 3993 CG2 THR E 89 5.533 -23.840 1.641 1.00 46.24 C ATOM 0 H THR E 89 6.637 -23.021 5.319 1.00 40.99 H new ATOM 0 HA THR E 89 7.554 -24.558 3.458 1.00 43.04 H new ATOM 0 HB THR E 89 5.327 -22.777 3.380 1.00 44.09 H new ATOM 0 HG1 THR E 89 4.195 -24.670 3.632 1.00 46.02 H new ATOM 0 HG21 THR E 89 4.590 -23.824 1.415 1.00 46.24 H new ATOM 0 HG22 THR E 89 5.991 -23.128 1.167 1.00 46.24 H new ATOM 0 HG23 THR E 89 5.912 -24.695 1.384 1.00 46.24 H new ATOM 3994 N GLU E 90 7.713 -21.444 2.706 1.00 40.95 N ATOM 3995 CA GLU E 90 8.378 -20.466 1.859 1.00 39.55 C ATOM 3996 C GLU E 90 9.885 -20.520 2.065 1.00 36.65 C ATOM 3997 O GLU E 90 10.655 -20.434 1.107 1.00 33.94 O ATOM 3998 CB GLU E 90 7.865 -19.065 2.178 1.00 42.71 C ATOM 3999 CG GLU E 90 6.379 -18.909 1.965 1.00 47.06 C ATOM 4000 CD GLU E 90 5.868 -17.547 2.390 1.00 48.98 C ATOM 4001 OE1 GLU E 90 4.633 -17.353 2.360 1.00 52.37 O ATOM 4002 OE2 GLU E 90 6.691 -16.676 2.747 1.00 48.96 O ATOM 0 H GLU E 90 7.163 -21.108 3.276 1.00 40.95 H new ATOM 0 HA GLU E 90 8.181 -20.676 0.933 1.00 39.55 H new ATOM 0 HB2 GLU E 90 8.077 -18.852 3.100 1.00 42.71 H new ATOM 0 HB3 GLU E 90 8.334 -18.422 1.624 1.00 42.71 H new ATOM 0 HG2 GLU E 90 6.174 -19.049 1.027 1.00 47.06 H new ATOM 0 HG3 GLU E 90 5.910 -19.596 2.464 1.00 47.06 H new ATOM 4003 N ARG E 91 10.304 -20.658 3.320 1.00 34.68 N ATOM 4004 CA ARG E 91 11.724 -20.724 3.620 1.00 33.57 C ATOM 4005 C ARG E 91 12.358 -21.893 2.872 1.00 31.99 C ATOM 4006 O ARG E 91 13.448 -21.767 2.320 1.00 29.87 O ATOM 4007 CB ARG E 91 11.945 -20.857 5.128 1.00 35.48 C ATOM 4008 CG ARG E 91 11.721 -19.552 5.899 1.00 38.87 C ATOM 4009 CD ARG E 91 12.062 -19.715 7.378 1.00 40.17 C ATOM 4010 NE ARG E 91 10.963 -20.301 8.137 1.00 43.06 N ATOM 4011 CZ ARG E 91 11.118 -21.066 9.214 1.00 45.21 C ATOM 4012 NH1 ARG E 91 12.333 -21.353 9.661 1.00 45.92 N ATOM 4013 NH2 ARG E 91 10.054 -21.534 9.854 1.00 45.49 N ATOM 0 H ARG E 91 9.786 -20.715 4.004 1.00 34.68 H new ATOM 0 HA ARG E 91 12.148 -19.903 3.326 1.00 33.57 H new ATOM 0 HB2 ARG E 91 11.346 -21.536 5.476 1.00 35.48 H new ATOM 0 HB3 ARG E 91 12.850 -21.167 5.288 1.00 35.48 H new ATOM 0 HG2 ARG E 91 12.268 -18.849 5.515 1.00 38.87 H new ATOM 0 HG3 ARG E 91 10.796 -19.274 5.807 1.00 38.87 H new ATOM 0 HD2 ARG E 91 12.849 -20.275 7.467 1.00 40.17 H new ATOM 0 HD3 ARG E 91 12.287 -18.849 7.754 1.00 40.17 H new ATOM 0 HE ARG E 91 10.161 -20.141 7.870 1.00 43.06 H new ATOM 0 HH11 ARG E 91 13.025 -21.044 9.254 1.00 45.92 H new ATOM 0 HH12 ARG E 91 12.429 -21.848 10.358 1.00 45.92 H new ATOM 0 HH21 ARG E 91 9.264 -21.343 9.572 1.00 45.49 H new ATOM 0 HH22 ARG E 91 10.154 -22.029 10.550 1.00 45.49 H new ATOM 4014 N GLU E 92 11.667 -23.029 2.853 1.00 31.39 N ATOM 4015 CA GLU E 92 12.159 -24.208 2.151 1.00 32.74 C ATOM 4016 C GLU E 92 12.261 -23.931 0.646 1.00 30.76 C ATOM 4017 O GLU E 92 13.264 -24.260 0.015 1.00 30.55 O ATOM 4018 CB GLU E 92 11.228 -25.402 2.404 1.00 34.49 C ATOM 4019 CG GLU E 92 11.300 -25.958 3.825 1.00 38.24 C ATOM 4020 CD GLU E 92 10.249 -27.026 4.104 1.00 40.82 C ATOM 4021 OE1 GLU E 92 10.322 -27.673 5.172 1.00 41.41 O ATOM 4022 OE2 GLU E 92 9.344 -27.216 3.262 1.00 42.43 O ATOM 0 H GLU E 92 10.908 -23.137 3.242 1.00 31.39 H new ATOM 0 HA GLU E 92 13.043 -24.421 2.488 1.00 32.74 H new ATOM 0 HB2 GLU E 92 10.315 -25.133 2.218 1.00 34.49 H new ATOM 0 HB3 GLU E 92 11.448 -26.110 1.778 1.00 34.49 H new ATOM 0 HG2 GLU E 92 12.182 -26.333 3.975 1.00 38.24 H new ATOM 0 HG3 GLU E 92 11.190 -25.230 4.457 1.00 38.24 H new ATOM 4023 N ASP E 93 11.231 -23.314 0.077 1.00 30.03 N ATOM 4024 CA ASP E 93 11.236 -23.013 -1.352 1.00 32.11 C ATOM 4025 C ASP E 93 12.329 -22.005 -1.700 1.00 32.37 C ATOM 4026 O ASP E 93 13.076 -22.186 -2.667 1.00 30.68 O ATOM 4027 CB ASP E 93 9.867 -22.482 -1.784 1.00 32.77 C ATOM 4028 CG ASP E 93 8.776 -23.545 -1.706 1.00 35.24 C ATOM 4029 OD1 ASP E 93 7.600 -23.214 -1.967 1.00 35.75 O ATOM 4030 OD2 ASP E 93 9.095 -24.713 -1.386 1.00 36.75 O ATOM 0 H ASP E 93 10.524 -23.062 0.496 1.00 30.03 H new ATOM 0 HA ASP E 93 11.423 -23.835 -1.833 1.00 32.11 H new ATOM 0 HB2 ASP E 93 9.623 -21.731 -1.221 1.00 32.77 H new ATOM 0 HB3 ASP E 93 9.925 -22.149 -2.693 1.00 32.77 H new ATOM 4031 N LEU E 94 12.423 -20.952 -0.894 1.00 32.27 N ATOM 4032 CA LEU E 94 13.426 -19.915 -1.097 1.00 32.89 C ATOM 4033 C LEU E 94 14.815 -20.541 -1.070 1.00 33.26 C ATOM 4034 O LEU E 94 15.647 -20.288 -1.949 1.00 32.34 O ATOM 4035 CB LEU E 94 13.307 -18.852 0.003 1.00 30.66 C ATOM 4036 CG LEU E 94 14.264 -17.664 -0.066 1.00 30.10 C ATOM 4037 CD1 LEU E 94 14.153 -16.990 -1.434 1.00 28.79 C ATOM 4038 CD2 LEU E 94 13.928 -16.679 1.047 1.00 31.30 C ATOM 0 H LEU E 94 11.909 -20.820 -0.217 1.00 32.27 H new ATOM 0 HA LEU E 94 13.283 -19.492 -1.958 1.00 32.89 H new ATOM 0 HB2 LEU E 94 12.400 -18.508 -0.008 1.00 30.66 H new ATOM 0 HB3 LEU E 94 13.433 -19.290 0.859 1.00 30.66 H new ATOM 0 HG LEU E 94 15.177 -17.971 0.052 1.00 30.10 H new ATOM 0 HD11 LEU E 94 14.762 -16.236 -1.474 1.00 28.79 H new ATOM 0 HD12 LEU E 94 14.382 -17.627 -2.128 1.00 28.79 H new ATOM 0 HD13 LEU E 94 13.244 -16.678 -1.569 1.00 28.79 H new ATOM 0 HD21 LEU E 94 14.535 -15.924 1.005 1.00 31.30 H new ATOM 0 HD22 LEU E 94 13.016 -16.367 0.939 1.00 31.30 H new ATOM 0 HD23 LEU E 94 14.019 -17.119 1.907 1.00 31.30 H new ATOM 4039 N ILE E 95 15.051 -21.369 -0.056 1.00 32.74 N ATOM 4040 CA ILE E 95 16.324 -22.048 0.110 1.00 34.06 C ATOM 4041 C ILE E 95 16.590 -23.033 -1.027 1.00 34.12 C ATOM 4042 O ILE E 95 17.734 -23.219 -1.431 1.00 35.00 O ATOM 4043 CB ILE E 95 16.376 -22.776 1.472 1.00 35.20 C ATOM 4044 CG1 ILE E 95 16.456 -21.738 2.597 1.00 34.58 C ATOM 4045 CG2 ILE E 95 17.574 -23.705 1.532 1.00 35.27 C ATOM 4046 CD1 ILE E 95 16.316 -22.327 3.987 1.00 36.97 C ATOM 0 H ILE E 95 14.473 -21.551 0.555 1.00 32.74 H new ATOM 0 HA ILE E 95 17.020 -21.373 0.086 1.00 34.06 H new ATOM 0 HB ILE E 95 15.573 -23.309 1.579 1.00 35.20 H new ATOM 0 HG12 ILE E 95 17.305 -21.273 2.536 1.00 34.58 H new ATOM 0 HG13 ILE E 95 15.760 -21.076 2.464 1.00 34.58 H new ATOM 0 HG21 ILE E 95 17.593 -24.154 2.392 1.00 35.27 H new ATOM 0 HG22 ILE E 95 17.508 -24.365 0.824 1.00 35.27 H new ATOM 0 HG23 ILE E 95 18.389 -23.191 1.418 1.00 35.27 H new ATOM 0 HD11 ILE E 95 16.376 -21.618 4.647 1.00 36.97 H new ATOM 0 HD12 ILE E 95 15.457 -22.770 4.066 1.00 36.97 H new ATOM 0 HD13 ILE E 95 17.026 -22.970 4.139 1.00 36.97 H new ATOM 4047 N ALA E 96 15.543 -23.666 -1.547 1.00 34.46 N ATOM 4048 CA ALA E 96 15.733 -24.599 -2.656 1.00 35.47 C ATOM 4049 C ALA E 96 16.192 -23.790 -3.872 1.00 35.31 C ATOM 4050 O ALA E 96 17.099 -24.202 -4.597 1.00 35.21 O ATOM 4051 CB ALA E 96 14.435 -25.336 -2.964 1.00 35.47 C ATOM 0 H ALA E 96 14.731 -23.574 -1.280 1.00 34.46 H new ATOM 0 HA ALA E 96 16.398 -25.266 -2.424 1.00 35.47 H new ATOM 0 HB1 ALA E 96 14.578 -25.950 -3.701 1.00 35.47 H new ATOM 0 HB2 ALA E 96 14.151 -25.833 -2.181 1.00 35.47 H new ATOM 0 HB3 ALA E 96 13.748 -24.695 -3.207 1.00 35.47 H new ATOM 4052 N TYR E 97 15.572 -22.629 -4.079 1.00 34.60 N ATOM 4053 CA TYR E 97 15.936 -21.761 -5.197 1.00 34.33 C ATOM 4054 C TYR E 97 17.363 -21.235 -5.068 1.00 34.83 C ATOM 4055 O TYR E 97 18.112 -21.206 -6.050 1.00 34.03 O ATOM 4056 CB TYR E 97 14.982 -20.563 -5.302 1.00 33.67 C ATOM 4057 CG TYR E 97 15.501 -19.477 -6.229 1.00 36.07 C ATOM 4058 CD1 TYR E 97 15.703 -19.729 -7.587 1.00 33.66 C ATOM 4059 CD2 TYR E 97 15.848 -18.215 -5.736 1.00 34.73 C ATOM 4060 CE1 TYR E 97 16.244 -18.756 -8.431 1.00 35.42 C ATOM 4061 CE2 TYR E 97 16.390 -17.236 -6.573 1.00 34.78 C ATOM 4062 CZ TYR E 97 16.587 -17.515 -7.917 1.00 35.40 C ATOM 4063 OH TYR E 97 17.136 -16.563 -8.743 1.00 32.41 O ATOM 0 H TYR E 97 14.938 -22.326 -3.583 1.00 34.60 H new ATOM 0 HA TYR E 97 15.870 -22.305 -5.997 1.00 34.33 H new ATOM 0 HB2 TYR E 97 14.119 -20.869 -5.621 1.00 33.67 H new ATOM 0 HB3 TYR E 97 14.841 -20.188 -4.418 1.00 33.67 H new ATOM 0 HD1 TYR E 97 15.473 -20.560 -7.936 1.00 33.66 H new ATOM 0 HD2 TYR E 97 15.716 -18.024 -4.835 1.00 34.73 H new ATOM 0 HE1 TYR E 97 16.373 -18.940 -9.333 1.00 35.42 H new ATOM 0 HE2 TYR E 97 16.617 -16.402 -6.231 1.00 34.78 H new ATOM 0 HH TYR E 97 16.891 -16.703 -9.534 1.00 32.41 H new ATOM 4064 N LEU E 98 17.726 -20.798 -3.863 1.00 34.90 N ATOM 4065 CA LEU E 98 19.063 -20.267 -3.612 1.00 35.12 C ATOM 4066 C LEU E 98 20.097 -21.343 -3.890 1.00 35.08 C ATOM 4067 O LEU E 98 21.119 -21.085 -4.529 1.00 36.33 O ATOM 4068 CB LEU E 98 19.194 -19.793 -2.156 1.00 34.65 C ATOM 4069 CG LEU E 98 18.391 -18.562 -1.721 1.00 35.79 C ATOM 4070 CD1 LEU E 98 18.501 -18.375 -0.214 1.00 33.64 C ATOM 4071 CD2 LEU E 98 18.907 -17.333 -2.449 1.00 33.96 C ATOM 0 H LEU E 98 17.210 -20.801 -3.175 1.00 34.90 H new ATOM 0 HA LEU E 98 19.211 -19.509 -4.199 1.00 35.12 H new ATOM 0 HB2 LEU E 98 18.940 -20.531 -1.580 1.00 34.65 H new ATOM 0 HB3 LEU E 98 20.132 -19.610 -1.987 1.00 34.65 H new ATOM 0 HG LEU E 98 17.457 -18.691 -1.947 1.00 35.79 H new ATOM 0 HD11 LEU E 98 17.991 -17.595 0.054 1.00 33.64 H new ATOM 0 HD12 LEU E 98 18.151 -19.160 0.236 1.00 33.64 H new ATOM 0 HD13 LEU E 98 19.432 -18.251 0.030 1.00 33.64 H new ATOM 0 HD21 LEU E 98 18.398 -16.555 -2.172 1.00 33.96 H new ATOM 0 HD22 LEU E 98 19.843 -17.199 -2.234 1.00 33.96 H new ATOM 0 HD23 LEU E 98 18.810 -17.459 -3.406 1.00 33.96 H new ATOM 4072 N LYS E 99 19.816 -22.550 -3.406 1.00 36.41 N ATOM 4073 CA LYS E 99 20.709 -23.684 -3.583 1.00 37.95 C ATOM 4074 C LYS E 99 21.086 -23.836 -5.053 1.00 38.92 C ATOM 4075 O LYS E 99 22.242 -24.111 -5.384 1.00 37.71 O ATOM 4076 CB LYS E 99 20.040 -24.962 -3.071 1.00 37.96 C ATOM 4077 CG LYS E 99 21.007 -26.107 -2.794 1.00 39.04 C ATOM 4078 CD LYS E 99 20.317 -27.213 -2.002 1.00 41.28 C ATOM 4079 CE LYS E 99 21.301 -28.277 -1.538 1.00 42.06 C ATOM 4080 NZ LYS E 99 21.881 -29.046 -2.674 1.00 45.81 N ATOM 0 H LYS E 99 19.100 -22.732 -2.965 1.00 36.41 H new ATOM 0 HA LYS E 99 21.519 -23.528 -3.072 1.00 37.95 H new ATOM 0 HB2 LYS E 99 19.556 -24.757 -2.256 1.00 37.96 H new ATOM 0 HB3 LYS E 99 19.385 -25.256 -3.724 1.00 37.96 H new ATOM 0 HG2 LYS E 99 21.343 -26.463 -3.631 1.00 39.04 H new ATOM 0 HG3 LYS E 99 21.773 -25.777 -2.299 1.00 39.04 H new ATOM 0 HD2 LYS E 99 19.870 -26.828 -1.232 1.00 41.28 H new ATOM 0 HD3 LYS E 99 19.632 -27.624 -2.551 1.00 41.28 H new ATOM 0 HE2 LYS E 99 22.017 -27.856 -1.037 1.00 42.06 H new ATOM 0 HE3 LYS E 99 20.852 -28.888 -0.933 1.00 42.06 H new ATOM 0 HZ1 LYS E 99 22.449 -29.656 -2.361 1.00 45.81 H new ATOM 0 HZ2 LYS E 99 21.228 -29.452 -3.122 1.00 45.81 H new ATOM 0 HZ3 LYS E 99 22.313 -28.491 -3.219 1.00 45.81 H new ATOM 4081 N LYS E 100 20.115 -23.637 -5.936 1.00 39.03 N ATOM 4082 CA LYS E 100 20.382 -23.752 -7.363 1.00 41.49 C ATOM 4083 C LYS E 100 21.047 -22.498 -7.935 1.00 41.04 C ATOM 4084 O LYS E 100 22.152 -22.563 -8.477 1.00 40.38 O ATOM 4085 CB LYS E 100 19.084 -24.027 -8.128 1.00 42.31 C ATOM 4086 CG LYS E 100 19.308 -24.422 -9.585 1.00 45.62 C ATOM 4087 CD LYS E 100 17.995 -24.528 -10.352 1.00 48.58 C ATOM 4088 CE LYS E 100 17.047 -25.547 -9.728 1.00 50.73 C ATOM 4089 NZ LYS E 100 17.591 -26.935 -9.767 1.00 53.22 N ATOM 0 H LYS E 100 19.304 -23.437 -5.733 1.00 39.03 H new ATOM 0 HA LYS E 100 20.997 -24.494 -7.473 1.00 41.49 H new ATOM 0 HB2 LYS E 100 18.597 -24.736 -7.680 1.00 42.31 H new ATOM 0 HB3 LYS E 100 18.525 -23.235 -8.097 1.00 42.31 H new ATOM 0 HG2 LYS E 100 19.881 -23.767 -10.013 1.00 45.62 H new ATOM 0 HG3 LYS E 100 19.773 -25.272 -9.622 1.00 45.62 H new ATOM 0 HD2 LYS E 100 17.564 -23.659 -10.375 1.00 48.58 H new ATOM 0 HD3 LYS E 100 18.178 -24.779 -11.271 1.00 48.58 H new ATOM 0 HE2 LYS E 100 16.871 -25.298 -8.807 1.00 50.73 H new ATOM 0 HE3 LYS E 100 16.198 -25.523 -10.196 1.00 50.73 H new ATOM 0 HZ1 LYS E 100 16.989 -27.499 -9.434 1.00 53.22 H new ATOM 0 HZ2 LYS E 100 17.773 -27.159 -10.609 1.00 53.22 H new ATOM 0 HZ3 LYS E 100 18.336 -26.976 -9.282 1.00 53.22 H new ATOM 4090 N ALA E 101 20.372 -21.360 -7.795 1.00 40.36 N ATOM 4091 CA ALA E 101 20.858 -20.083 -8.318 1.00 40.56 C ATOM 4092 C ALA E 101 22.240 -19.613 -7.849 1.00 40.89 C ATOM 4093 O ALA E 101 23.012 -19.076 -8.649 1.00 41.90 O ATOM 4094 CB ALA E 101 19.821 -18.993 -8.046 1.00 39.52 C ATOM 0 H ALA E 101 19.614 -21.306 -7.392 1.00 40.36 H new ATOM 0 HA ALA E 101 20.981 -20.248 -9.266 1.00 40.56 H new ATOM 0 HB1 ALA E 101 20.143 -18.146 -8.393 1.00 39.52 H new ATOM 0 HB2 ALA E 101 18.986 -19.224 -8.482 1.00 39.52 H new ATOM 0 HB3 ALA E 101 19.675 -18.916 -7.090 1.00 39.52 H new ATOM 4095 N THR E 102 22.561 -19.803 -6.570 1.00 41.22 N ATOM 4096 CA THR E 102 23.861 -19.366 -6.050 1.00 41.56 C ATOM 4097 C THR E 102 24.991 -20.314 -6.443 1.00 45.31 C ATOM 4098 O THR E 102 26.172 -19.997 -6.282 1.00 44.25 O ATOM 4099 CB THR E 102 23.844 -19.235 -4.515 1.00 39.76 C ATOM 4100 OG1 THR E 102 23.678 -20.529 -3.924 1.00 35.70 O ATOM 4101 CG2 THR E 102 22.698 -18.331 -4.076 1.00 37.37 C ATOM 0 H THR E 102 22.048 -20.179 -5.991 1.00 41.22 H new ATOM 0 HA THR E 102 24.025 -18.498 -6.450 1.00 41.56 H new ATOM 0 HB THR E 102 24.684 -18.847 -4.225 1.00 39.76 H new ATOM 0 HG1 THR E 102 22.894 -20.800 -4.058 1.00 35.70 H new ATOM 0 HG21 THR E 102 22.697 -18.256 -3.109 1.00 37.37 H new ATOM 0 HG22 THR E 102 22.811 -17.451 -4.468 1.00 37.37 H new ATOM 0 HG23 THR E 102 21.855 -18.710 -4.371 1.00 37.37 H new ATOM 4102 N ASN E 103 24.625 -21.485 -6.949 1.00 49.40 N ATOM 4103 CA ASN E 103 25.614 -22.459 -7.385 1.00 53.39 C ATOM 4104 C ASN E 103 25.697 -22.318 -8.898 1.00 56.29 C ATOM 4105 O ASN E 103 26.293 -23.143 -9.588 1.00 55.65 O ATOM 4106 CB ASN E 103 25.173 -23.871 -6.999 1.00 53.93 C ATOM 4107 CG ASN E 103 26.186 -24.927 -7.396 1.00 55.27 C ATOM 4108 OD1 ASN E 103 27.355 -24.863 -7.008 1.00 54.67 O ATOM 4109 ND2 ASN E 103 25.742 -25.907 -8.172 1.00 56.49 N ATOM 0 H ASN E 103 23.808 -21.735 -7.048 1.00 49.40 H new ATOM 0 HA ASN E 103 26.476 -22.307 -6.968 1.00 53.39 H new ATOM 0 HB2 ASN E 103 25.028 -23.910 -6.041 1.00 53.93 H new ATOM 0 HB3 ASN E 103 24.323 -24.068 -7.422 1.00 53.93 H new ATOM 0 HD21 ASN E 103 26.277 -26.531 -8.424 1.00 56.49 H new ATOM 0 HD22 ASN E 103 24.919 -25.918 -8.423 1.00 56.49 H new ATOM 4110 N GLU E 104 25.087 -21.242 -9.390 1.00 59.95 N ATOM 4111 CA GLU E 104 25.036 -20.913 -10.812 1.00 62.73 C ATOM 4112 C GLU E 104 24.832 -22.150 -11.670 1.00 63.30 C ATOM 4113 O GLU E 104 25.683 -22.394 -12.552 1.00 63.61 O ATOM 4114 CB GLU E 104 26.316 -20.200 -11.244 1.00 64.50 C ATOM 4115 CG GLU E 104 26.176 -19.450 -12.557 1.00 69.07 C ATOM 4116 CD GLU E 104 27.507 -18.966 -13.100 1.00 72.17 C ATOM 4117 OE1 GLU E 104 27.510 -18.181 -14.074 1.00 73.27 O ATOM 4118 OE2 GLU E 104 28.554 -19.380 -12.556 1.00 73.99 O ATOM 4119 OXT GLU E 104 23.822 -22.854 -11.450 1.00 64.21 O ATOM 0 H GLU E 104 24.681 -20.669 -8.893 1.00 59.95 H new ATOM 0 HA GLU E 104 24.276 -20.324 -10.942 1.00 62.73 H new ATOM 0 HB2 GLU E 104 26.581 -19.576 -10.550 1.00 64.50 H new ATOM 0 HB3 GLU E 104 27.029 -20.852 -11.326 1.00 64.50 H new ATOM 0 HG2 GLU E 104 25.755 -20.028 -13.212 1.00 69.07 H new ATOM 0 HG3 GLU E 104 25.587 -18.690 -12.430 1.00 69.07 H new TER 4120 GLU E 104 ATOM 4121 N GLY F 1 41.417 12.263 -2.002 1.00 37.66 N ATOM 4122 CA GLY F 1 40.791 10.930 -2.247 1.00 39.59 C ATOM 4123 C GLY F 1 40.554 10.646 -3.720 1.00 41.52 C ATOM 4124 O GLY F 1 40.727 11.529 -4.567 1.00 42.27 O ATOM 0 H1 GLY F 1 42.234 12.151 -1.668 1.00 37.66 H new ATOM 0 H2 GLY F 1 41.469 12.712 -2.769 1.00 37.66 H new ATOM 0 H3 GLY F 1 40.921 12.722 -1.423 1.00 37.66 H new ATOM 0 HA2 GLY F 1 41.361 10.238 -1.877 1.00 39.59 H new ATOM 0 HA3 GLY F 1 39.945 10.884 -1.774 1.00 39.59 H new ATOM 4125 N ASP F 2 40.156 9.413 -4.029 1.00 41.25 N ATOM 4126 CA ASP F 2 39.901 9.012 -5.409 1.00 42.08 C ATOM 4127 C ASP F 2 38.439 9.279 -5.779 1.00 42.95 C ATOM 4128 O ASP F 2 37.529 8.575 -5.333 1.00 43.19 O ATOM 4129 CB ASP F 2 40.218 7.526 -5.587 1.00 43.16 C ATOM 4130 CG ASP F 2 40.194 7.094 -7.042 1.00 44.75 C ATOM 4131 OD1 ASP F 2 39.327 7.588 -7.791 1.00 44.81 O ATOM 4132 OD2 ASP F 2 41.033 6.250 -7.435 1.00 43.86 O ATOM 0 H ASP F 2 40.027 8.791 -3.449 1.00 41.25 H new ATOM 0 HA ASP F 2 40.472 9.533 -5.995 1.00 42.08 H new ATOM 0 HB2 ASP F 2 41.093 7.338 -5.212 1.00 43.16 H new ATOM 0 HB3 ASP F 2 39.575 6.999 -5.086 1.00 43.16 H new ATOM 4133 N VAL F 3 38.224 10.300 -6.600 1.00 43.37 N ATOM 4134 CA VAL F 3 36.883 10.682 -7.030 1.00 44.29 C ATOM 4135 C VAL F 3 36.139 9.556 -7.735 1.00 44.61 C ATOM 4136 O VAL F 3 35.008 9.235 -7.383 1.00 44.86 O ATOM 4137 CB VAL F 3 36.940 11.902 -7.970 1.00 44.76 C ATOM 4138 CG1 VAL F 3 35.564 12.185 -8.544 1.00 45.82 C ATOM 4139 CG2 VAL F 3 37.446 13.116 -7.204 1.00 44.78 C ATOM 0 H VAL F 3 38.851 10.792 -6.924 1.00 43.37 H new ATOM 0 HA VAL F 3 36.396 10.900 -6.220 1.00 44.29 H new ATOM 0 HB VAL F 3 37.548 11.711 -8.701 1.00 44.76 H new ATOM 0 HG11 VAL F 3 35.611 12.954 -9.134 1.00 45.82 H new ATOM 0 HG12 VAL F 3 35.257 11.413 -9.044 1.00 45.82 H new ATOM 0 HG13 VAL F 3 34.944 12.369 -7.822 1.00 45.82 H new ATOM 0 HG21 VAL F 3 37.481 13.882 -7.798 1.00 44.78 H new ATOM 0 HG22 VAL F 3 36.846 13.306 -6.466 1.00 44.78 H new ATOM 0 HG23 VAL F 3 38.334 12.934 -6.859 1.00 44.78 H new ATOM 4140 N GLU F 4 36.779 8.963 -8.735 1.00 45.31 N ATOM 4141 CA GLU F 4 36.175 7.876 -9.493 1.00 46.33 C ATOM 4142 C GLU F 4 35.735 6.760 -8.554 1.00 44.71 C ATOM 4143 O GLU F 4 34.566 6.360 -8.531 1.00 43.00 O ATOM 4144 CB GLU F 4 37.182 7.327 -10.505 1.00 49.01 C ATOM 4145 CG GLU F 4 37.729 8.370 -11.472 1.00 55.05 C ATOM 4146 CD GLU F 4 36.642 8.999 -12.325 1.00 58.91 C ATOM 4147 OE1 GLU F 4 35.890 8.239 -12.977 1.00 59.65 O ATOM 4148 OE2 GLU F 4 36.542 10.249 -12.347 1.00 60.89 O ATOM 0 H GLU F 4 37.571 9.178 -8.992 1.00 45.31 H new ATOM 0 HA GLU F 4 35.399 8.218 -9.963 1.00 46.33 H new ATOM 0 HB2 GLU F 4 37.923 6.927 -10.024 1.00 49.01 H new ATOM 0 HB3 GLU F 4 36.759 6.618 -11.015 1.00 49.01 H new ATOM 0 HG2 GLU F 4 38.185 9.064 -10.971 1.00 55.05 H new ATOM 0 HG3 GLU F 4 38.390 7.957 -12.049 1.00 55.05 H new ATOM 4149 N LYS F 5 36.692 6.266 -7.780 1.00 42.37 N ATOM 4150 CA LYS F 5 36.455 5.196 -6.827 1.00 40.78 C ATOM 4151 C LYS F 5 35.269 5.547 -5.929 1.00 39.77 C ATOM 4152 O LYS F 5 34.389 4.720 -5.687 1.00 39.92 O ATOM 4153 CB LYS F 5 37.704 4.998 -5.972 1.00 42.28 C ATOM 4154 CG LYS F 5 37.897 3.590 -5.462 1.00 44.45 C ATOM 4155 CD LYS F 5 39.028 2.892 -6.207 1.00 45.95 C ATOM 4156 CE LYS F 5 40.374 3.510 -5.866 1.00 46.74 C ATOM 4157 NZ LYS F 5 41.508 2.760 -6.483 1.00 47.28 N ATOM 0 H LYS F 5 37.505 6.546 -7.795 1.00 42.37 H new ATOM 0 HA LYS F 5 36.254 4.378 -7.308 1.00 40.78 H new ATOM 0 HB2 LYS F 5 38.482 5.251 -6.493 1.00 42.28 H new ATOM 0 HB3 LYS F 5 37.662 5.602 -5.214 1.00 42.28 H new ATOM 0 HG2 LYS F 5 38.094 3.610 -4.512 1.00 44.45 H new ATOM 0 HG3 LYS F 5 37.075 3.087 -5.570 1.00 44.45 H new ATOM 0 HD2 LYS F 5 39.035 1.949 -5.979 1.00 45.95 H new ATOM 0 HD3 LYS F 5 38.875 2.952 -7.163 1.00 45.95 H new ATOM 0 HE2 LYS F 5 40.393 4.431 -6.171 1.00 46.74 H new ATOM 0 HE3 LYS F 5 40.486 3.528 -4.903 1.00 46.74 H new ATOM 0 HZ1 LYS F 5 42.277 3.150 -6.262 1.00 47.28 H new ATOM 0 HZ2 LYS F 5 41.505 1.921 -6.187 1.00 47.28 H new ATOM 0 HZ3 LYS F 5 41.419 2.762 -7.368 1.00 47.28 H new ATOM 4158 N GLY F 6 35.254 6.783 -5.440 1.00 36.92 N ATOM 4159 CA GLY F 6 34.182 7.219 -4.566 1.00 37.59 C ATOM 4160 C GLY F 6 32.814 7.220 -5.226 1.00 36.91 C ATOM 4161 O GLY F 6 31.796 7.028 -4.557 1.00 34.91 O ATOM 0 H GLY F 6 35.853 7.378 -5.603 1.00 36.92 H new ATOM 0 HA2 GLY F 6 34.156 6.641 -3.787 1.00 37.59 H new ATOM 0 HA3 GLY F 6 34.379 8.114 -4.248 1.00 37.59 H new ATOM 4162 N LYS F 7 32.776 7.433 -6.537 1.00 35.82 N ATOM 4163 CA LYS F 7 31.499 7.456 -7.235 1.00 36.59 C ATOM 4164 C LYS F 7 30.864 6.070 -7.222 1.00 34.43 C ATOM 4165 O LYS F 7 29.663 5.946 -7.011 1.00 33.87 O ATOM 4166 CB LYS F 7 31.666 7.960 -8.676 1.00 37.87 C ATOM 4167 CG LYS F 7 30.339 8.125 -9.405 1.00 40.57 C ATOM 4168 CD LYS F 7 30.471 8.876 -10.722 1.00 43.78 C ATOM 4169 CE LYS F 7 29.091 9.085 -11.348 1.00 46.12 C ATOM 4170 NZ LYS F 7 29.128 9.962 -12.554 1.00 50.34 N ATOM 0 H LYS F 7 33.466 7.564 -7.033 1.00 35.82 H new ATOM 0 HA LYS F 7 30.911 8.072 -6.770 1.00 36.59 H new ATOM 0 HB2 LYS F 7 32.131 8.811 -8.664 1.00 37.87 H new ATOM 0 HB3 LYS F 7 32.225 7.338 -9.168 1.00 37.87 H new ATOM 0 HG2 LYS F 7 29.958 7.249 -9.575 1.00 40.57 H new ATOM 0 HG3 LYS F 7 29.717 8.598 -8.830 1.00 40.57 H new ATOM 0 HD2 LYS F 7 30.899 9.733 -10.572 1.00 43.78 H new ATOM 0 HD3 LYS F 7 31.038 8.378 -11.331 1.00 43.78 H new ATOM 0 HE2 LYS F 7 28.717 8.224 -11.591 1.00 46.12 H new ATOM 0 HE3 LYS F 7 28.497 9.475 -10.688 1.00 46.12 H new ATOM 0 HZ1 LYS F 7 28.305 10.053 -12.881 1.00 50.34 H new ATOM 0 HZ2 LYS F 7 29.448 10.762 -12.330 1.00 50.34 H new ATOM 0 HZ3 LYS F 7 29.653 9.595 -13.172 1.00 50.34 H new ATOM 4171 N LYS F 8 31.668 5.032 -7.443 1.00 32.69 N ATOM 4172 CA LYS F 8 31.158 3.662 -7.424 1.00 33.29 C ATOM 4173 C LYS F 8 30.564 3.354 -6.047 1.00 31.47 C ATOM 4174 O LYS F 8 29.564 2.642 -5.930 1.00 29.36 O ATOM 4175 CB LYS F 8 32.275 2.657 -7.718 1.00 32.44 C ATOM 4176 CG LYS F 8 32.747 2.627 -9.166 1.00 38.58 C ATOM 4177 CD LYS F 8 33.757 1.501 -9.386 1.00 39.05 C ATOM 4178 CE LYS F 8 34.132 1.374 -10.854 1.00 41.37 C ATOM 4179 NZ LYS F 8 34.639 2.664 -11.414 1.00 42.26 N ATOM 0 H LYS F 8 32.510 5.099 -7.605 1.00 32.69 H new ATOM 0 HA LYS F 8 30.476 3.584 -8.110 1.00 33.29 H new ATOM 0 HB2 LYS F 8 33.033 2.861 -7.149 1.00 32.44 H new ATOM 0 HB3 LYS F 8 31.967 1.770 -7.474 1.00 32.44 H new ATOM 0 HG2 LYS F 8 31.987 2.505 -9.756 1.00 38.58 H new ATOM 0 HG3 LYS F 8 33.151 3.478 -9.397 1.00 38.58 H new ATOM 0 HD2 LYS F 8 34.554 1.671 -8.860 1.00 39.05 H new ATOM 0 HD3 LYS F 8 33.384 0.663 -9.072 1.00 39.05 H new ATOM 0 HE2 LYS F 8 34.811 0.689 -10.956 1.00 41.37 H new ATOM 0 HE3 LYS F 8 33.358 1.084 -11.361 1.00 41.37 H new ATOM 0 HZ1 LYS F 8 35.316 2.502 -11.968 1.00 42.26 H new ATOM 0 HZ2 LYS F 8 33.985 3.073 -11.857 1.00 42.26 H new ATOM 0 HZ3 LYS F 8 34.919 3.187 -10.750 1.00 42.26 H new ATOM 4180 N ILE F 9 31.207 3.882 -5.010 1.00 29.86 N ATOM 4181 CA ILE F 9 30.753 3.681 -3.642 1.00 29.22 C ATOM 4182 C ILE F 9 29.407 4.374 -3.459 1.00 27.72 C ATOM 4183 O ILE F 9 28.455 3.775 -2.969 1.00 26.47 O ATOM 4184 CB ILE F 9 31.765 4.264 -2.627 1.00 30.03 C ATOM 4185 CG1 ILE F 9 33.099 3.526 -2.744 1.00 30.85 C ATOM 4186 CG2 ILE F 9 31.216 4.148 -1.206 1.00 29.67 C ATOM 4187 CD1 ILE F 9 34.241 4.201 -1.992 1.00 31.40 C ATOM 0 H ILE F 9 31.915 4.364 -5.081 1.00 29.86 H new ATOM 0 HA ILE F 9 30.671 2.728 -3.481 1.00 29.22 H new ATOM 0 HB ILE F 9 31.906 5.203 -2.825 1.00 30.03 H new ATOM 0 HG12 ILE F 9 32.990 2.623 -2.408 1.00 30.85 H new ATOM 0 HG13 ILE F 9 33.338 3.453 -3.681 1.00 30.85 H new ATOM 0 HG21 ILE F 9 31.859 4.516 -0.580 1.00 29.67 H new ATOM 0 HG22 ILE F 9 30.382 4.639 -1.140 1.00 29.67 H new ATOM 0 HG23 ILE F 9 31.058 3.214 -0.995 1.00 29.67 H new ATOM 0 HD11 ILE F 9 35.054 3.685 -2.107 1.00 31.40 H new ATOM 0 HD12 ILE F 9 34.375 5.096 -2.342 1.00 31.40 H new ATOM 0 HD13 ILE F 9 34.022 4.253 -1.049 1.00 31.40 H new ATOM 4188 N PHE F 10 29.332 5.637 -3.870 1.00 28.62 N ATOM 4189 CA PHE F 10 28.098 6.398 -3.741 1.00 29.17 C ATOM 4190 C PHE F 10 26.946 5.698 -4.451 1.00 30.91 C ATOM 4191 O PHE F 10 25.862 5.539 -3.884 1.00 32.17 O ATOM 4192 CB PHE F 10 28.259 7.801 -4.329 1.00 27.78 C ATOM 4193 CG PHE F 10 27.046 8.673 -4.136 1.00 30.28 C ATOM 4194 CD1 PHE F 10 26.874 9.393 -2.962 1.00 27.83 C ATOM 4195 CD2 PHE F 10 26.046 8.726 -5.107 1.00 27.57 C ATOM 4196 CE1 PHE F 10 25.724 10.151 -2.751 1.00 29.22 C ATOM 4197 CE2 PHE F 10 24.898 9.479 -4.903 1.00 28.91 C ATOM 4198 CZ PHE F 10 24.737 10.195 -3.717 1.00 28.35 C ATOM 0 H PHE F 10 29.985 6.069 -4.226 1.00 28.62 H new ATOM 0 HA PHE F 10 27.899 6.464 -2.794 1.00 29.17 H new ATOM 0 HB2 PHE F 10 29.026 8.230 -3.919 1.00 27.78 H new ATOM 0 HB3 PHE F 10 28.448 7.727 -5.277 1.00 27.78 H new ATOM 0 HD1 PHE F 10 27.535 9.369 -2.308 1.00 27.83 H new ATOM 0 HD2 PHE F 10 26.150 8.251 -5.900 1.00 27.57 H new ATOM 0 HE1 PHE F 10 25.621 10.628 -1.959 1.00 29.22 H new ATOM 0 HE2 PHE F 10 24.237 9.506 -5.556 1.00 28.91 H new ATOM 0 HZ PHE F 10 23.969 10.700 -3.577 1.00 28.35 H new ATOM 4199 N VAL F 11 27.189 5.292 -5.698 1.00 30.91 N ATOM 4200 CA VAL F 11 26.174 4.609 -6.499 1.00 31.76 C ATOM 4201 C VAL F 11 25.656 3.347 -5.814 1.00 31.41 C ATOM 4202 O VAL F 11 24.446 3.090 -5.791 1.00 30.67 O ATOM 4203 CB VAL F 11 26.727 4.216 -7.894 1.00 31.70 C ATOM 4204 CG1 VAL F 11 25.745 3.295 -8.607 1.00 31.42 C ATOM 4205 CG2 VAL F 11 26.972 5.463 -8.729 1.00 30.83 C ATOM 0 H VAL F 11 27.941 5.404 -6.100 1.00 30.91 H new ATOM 0 HA VAL F 11 25.443 5.239 -6.599 1.00 31.76 H new ATOM 0 HB VAL F 11 27.568 3.747 -7.776 1.00 31.70 H new ATOM 0 HG11 VAL F 11 26.100 3.055 -9.477 1.00 31.42 H new ATOM 0 HG12 VAL F 11 25.613 2.492 -8.080 1.00 31.42 H new ATOM 0 HG13 VAL F 11 24.896 3.751 -8.719 1.00 31.42 H new ATOM 0 HG21 VAL F 11 27.317 5.208 -9.599 1.00 30.83 H new ATOM 0 HG22 VAL F 11 26.138 5.946 -8.842 1.00 30.83 H new ATOM 0 HG23 VAL F 11 27.617 6.032 -8.280 1.00 30.83 H new ATOM 4206 N GLN F 12 26.569 2.563 -5.252 1.00 30.45 N ATOM 4207 CA GLN F 12 26.176 1.327 -4.591 1.00 30.36 C ATOM 4208 C GLN F 12 25.529 1.490 -3.223 1.00 29.52 C ATOM 4209 O GLN F 12 24.596 0.764 -2.893 1.00 29.45 O ATOM 4210 CB GLN F 12 27.373 0.390 -4.429 1.00 30.02 C ATOM 4211 CG GLN F 12 27.023 -0.872 -3.640 1.00 33.39 C ATOM 4212 CD GLN F 12 28.241 -1.712 -3.284 1.00 36.70 C ATOM 4213 OE1 GLN F 12 29.154 -1.871 -4.092 1.00 37.01 O ATOM 4214 NE2 GLN F 12 28.247 -2.270 -2.074 1.00 36.38 N ATOM 0 H GLN F 12 27.413 2.727 -5.242 1.00 30.45 H new ATOM 0 HA GLN F 12 25.501 0.958 -5.183 1.00 30.36 H new ATOM 0 HB2 GLN F 12 27.705 0.139 -5.305 1.00 30.02 H new ATOM 0 HB3 GLN F 12 28.091 0.861 -3.978 1.00 30.02 H new ATOM 0 HG2 GLN F 12 26.562 -0.620 -2.825 1.00 33.39 H new ATOM 0 HG3 GLN F 12 26.406 -1.411 -4.160 1.00 33.39 H new ATOM 0 HE21 GLN F 12 27.590 -2.136 -1.535 1.00 36.38 H new ATOM 0 HE22 GLN F 12 28.908 -2.764 -1.832 1.00 36.38 H new ATOM 4215 N LYS F 13 26.010 2.445 -2.435 1.00 28.93 N ATOM 4216 CA LYS F 13 25.500 2.613 -1.079 1.00 28.37 C ATOM 4217 C LYS F 13 24.696 3.864 -0.737 1.00 27.73 C ATOM 4218 O LYS F 13 24.098 3.926 0.342 1.00 26.09 O ATOM 4219 CB LYS F 13 26.675 2.520 -0.095 1.00 28.73 C ATOM 4220 CG LYS F 13 27.499 1.251 -0.212 1.00 30.53 C ATOM 4221 CD LYS F 13 28.639 1.211 0.814 1.00 32.10 C ATOM 4222 CE LYS F 13 29.461 -0.080 0.677 1.00 36.07 C ATOM 4223 NZ LYS F 13 30.557 -0.197 1.689 1.00 34.98 N ATOM 0 H LYS F 13 26.625 3.001 -2.663 1.00 28.93 H new ATOM 0 HA LYS F 13 24.848 1.899 -1.007 1.00 28.37 H new ATOM 0 HB2 LYS F 13 27.257 3.283 -0.232 1.00 28.73 H new ATOM 0 HB3 LYS F 13 26.330 2.585 0.809 1.00 28.73 H new ATOM 0 HG2 LYS F 13 26.924 0.480 -0.086 1.00 30.53 H new ATOM 0 HG3 LYS F 13 27.868 1.187 -1.107 1.00 30.53 H new ATOM 0 HD2 LYS F 13 29.217 1.980 0.690 1.00 32.10 H new ATOM 0 HD3 LYS F 13 28.274 1.272 1.710 1.00 32.10 H new ATOM 0 HE2 LYS F 13 28.868 -0.843 0.762 1.00 36.07 H new ATOM 0 HE3 LYS F 13 29.846 -0.118 -0.213 1.00 36.07 H new ATOM 0 HZ1 LYS F 13 30.988 -0.967 1.572 1.00 34.98 H new ATOM 0 HZ2 LYS F 13 31.126 0.480 1.590 1.00 34.98 H new ATOM 0 HZ3 LYS F 13 30.209 -0.174 2.508 1.00 34.98 H new ATOM 4224 N CYS F 14 24.672 4.857 -1.623 1.00 25.83 N ATOM 4225 CA CYS F 14 23.965 6.096 -1.307 1.00 25.54 C ATOM 4226 C CYS F 14 22.891 6.557 -2.297 1.00 25.70 C ATOM 4227 O CYS F 14 21.872 7.135 -1.896 1.00 24.84 O ATOM 4228 CB CYS F 14 24.986 7.229 -1.132 1.00 27.30 C ATOM 4229 SG CYS F 14 26.536 6.750 -0.282 1.00 25.13 S ATOM 0 H CYS F 14 25.049 4.836 -2.396 1.00 25.83 H new ATOM 0 HA CYS F 14 23.479 5.889 -0.494 1.00 25.54 H new ATOM 0 HB2 CYS F 14 25.209 7.583 -2.007 1.00 27.30 H new ATOM 0 HB3 CYS F 14 24.568 7.948 -0.633 1.00 27.30 H new ATOM 4230 N ALA F 15 23.123 6.315 -3.582 1.00 24.28 N ATOM 4231 CA ALA F 15 22.185 6.749 -4.622 1.00 26.70 C ATOM 4232 C ALA F 15 20.721 6.407 -4.370 1.00 26.75 C ATOM 4233 O ALA F 15 19.837 7.223 -4.631 1.00 26.21 O ATOM 4234 CB ALA F 15 22.613 6.197 -5.973 1.00 25.09 C ATOM 0 H ALA F 15 23.817 5.901 -3.877 1.00 24.28 H new ATOM 0 HA ALA F 15 22.228 7.718 -4.607 1.00 26.70 H new ATOM 0 HB1 ALA F 15 21.988 6.489 -6.655 1.00 25.09 H new ATOM 0 HB2 ALA F 15 23.501 6.522 -6.189 1.00 25.09 H new ATOM 0 HB3 ALA F 15 22.624 5.228 -5.938 1.00 25.09 H new ATOM 4235 N GLN F 16 20.452 5.208 -3.865 1.00 28.74 N ATOM 4236 CA GLN F 16 19.072 4.822 -3.627 1.00 29.89 C ATOM 4237 C GLN F 16 18.337 5.809 -2.728 1.00 28.29 C ATOM 4238 O GLN F 16 17.117 5.899 -2.786 1.00 29.75 O ATOM 4239 CB GLN F 16 18.982 3.402 -3.039 1.00 33.70 C ATOM 4240 CG GLN F 16 19.888 3.130 -1.851 1.00 39.42 C ATOM 4241 CD GLN F 16 21.155 2.383 -2.239 1.00 43.17 C ATOM 4242 OE1 GLN F 16 21.892 2.803 -3.141 1.00 45.67 O ATOM 4243 NE2 GLN F 16 21.419 1.271 -1.554 1.00 41.97 N ATOM 0 H GLN F 16 21.041 4.617 -3.658 1.00 28.74 H new ATOM 0 HA GLN F 16 18.634 4.832 -4.492 1.00 29.89 H new ATOM 0 HB2 GLN F 16 18.064 3.237 -2.771 1.00 33.70 H new ATOM 0 HB3 GLN F 16 19.192 2.765 -3.739 1.00 33.70 H new ATOM 0 HG2 GLN F 16 20.128 3.972 -1.433 1.00 39.42 H new ATOM 0 HG3 GLN F 16 19.402 2.613 -1.190 1.00 39.42 H new ATOM 0 HE21 GLN F 16 20.883 1.010 -0.934 1.00 41.97 H new ATOM 0 HE22 GLN F 16 22.125 0.814 -1.732 1.00 41.97 H new ATOM 4244 N CYS F 17 19.072 6.568 -1.922 1.00 25.25 N ATOM 4245 CA CYS F 17 18.442 7.527 -1.019 1.00 24.10 C ATOM 4246 C CYS F 17 18.821 8.991 -1.219 1.00 23.62 C ATOM 4247 O CYS F 17 18.124 9.871 -0.729 1.00 23.26 O ATOM 4248 CB CYS F 17 18.751 7.163 0.432 1.00 24.90 C ATOM 4249 SG CYS F 17 18.130 5.538 0.942 1.00 22.96 S ATOM 0 H CYS F 17 19.931 6.544 -1.882 1.00 25.25 H new ATOM 0 HA CYS F 17 17.498 7.458 -1.233 1.00 24.10 H new ATOM 0 HB2 CYS F 17 19.712 7.186 0.563 1.00 24.90 H new ATOM 0 HB3 CYS F 17 18.370 7.840 1.013 1.00 24.90 H new ATOM 4250 N HIS F 18 19.910 9.256 -1.935 1.00 23.85 N ATOM 4251 CA HIS F 18 20.369 10.636 -2.120 1.00 24.96 C ATOM 4252 C HIS F 18 20.682 11.068 -3.552 1.00 26.11 C ATOM 4253 O HIS F 18 21.156 10.270 -4.362 1.00 26.98 O ATOM 4254 CB HIS F 18 21.646 10.867 -1.301 1.00 23.90 C ATOM 4255 CG HIS F 18 21.462 10.769 0.180 1.00 23.89 C ATOM 4256 ND1 HIS F 18 20.883 11.772 0.926 1.00 24.00 N ATOM 4257 CD2 HIS F 18 21.829 9.807 1.061 1.00 21.82 C ATOM 4258 CE1 HIS F 18 20.905 11.435 2.204 1.00 23.85 C ATOM 4259 NE2 HIS F 18 21.475 10.248 2.312 1.00 23.36 N ATOM 0 H HIS F 18 20.395 8.659 -2.320 1.00 23.85 H new ATOM 0 HA HIS F 18 19.611 11.168 -1.830 1.00 24.96 H new ATOM 0 HB2 HIS F 18 22.314 10.219 -1.576 1.00 23.90 H new ATOM 0 HB3 HIS F 18 21.998 11.745 -1.514 1.00 23.90 H new ATOM 0 HD1 HIS F 18 20.558 12.503 0.610 1.00 24.00 H new ATOM 0 HD2 HIS F 18 22.243 9.000 0.857 1.00 21.82 H new ATOM 0 HE1 HIS F 18 20.575 11.946 2.907 1.00 23.85 H new ATOM 4260 N THR F 19 20.417 12.342 -3.844 1.00 28.83 N ATOM 4261 CA THR F 19 20.755 12.943 -5.138 1.00 29.71 C ATOM 4262 C THR F 19 21.820 13.980 -4.763 1.00 30.09 C ATOM 4263 O THR F 19 21.793 14.525 -3.657 1.00 28.51 O ATOM 4264 CB THR F 19 19.563 13.668 -5.816 1.00 29.74 C ATOM 4265 OG1 THR F 19 19.008 14.640 -4.919 1.00 32.39 O ATOM 4266 CG2 THR F 19 18.491 12.665 -6.228 1.00 31.56 C ATOM 0 H THR F 19 20.035 12.884 -3.296 1.00 28.83 H new ATOM 0 HA THR F 19 21.035 12.266 -5.774 1.00 29.71 H new ATOM 0 HB THR F 19 19.886 14.118 -6.612 1.00 29.74 H new ATOM 0 HG1 THR F 19 18.177 14.683 -5.031 1.00 32.39 H new ATOM 0 HG21 THR F 19 17.754 13.134 -6.650 1.00 31.56 H new ATOM 0 HG22 THR F 19 18.868 12.027 -6.854 1.00 31.56 H new ATOM 0 HG23 THR F 19 18.168 12.195 -5.443 1.00 31.56 H new ATOM 4267 N VAL F 20 22.751 14.253 -5.669 1.00 29.80 N ATOM 4268 CA VAL F 20 23.822 15.194 -5.375 1.00 31.87 C ATOM 4269 C VAL F 20 23.774 16.506 -6.158 1.00 33.17 C ATOM 4270 O VAL F 20 24.206 17.549 -5.660 1.00 32.96 O ATOM 4271 CB VAL F 20 25.184 14.527 -5.625 1.00 32.40 C ATOM 4272 CG1 VAL F 20 25.295 13.265 -4.791 1.00 33.65 C ATOM 4273 CG2 VAL F 20 25.342 14.200 -7.109 1.00 31.35 C ATOM 0 H VAL F 20 22.781 13.906 -6.455 1.00 29.80 H new ATOM 0 HA VAL F 20 23.695 15.430 -4.443 1.00 31.87 H new ATOM 0 HB VAL F 20 25.892 15.138 -5.367 1.00 32.40 H new ATOM 0 HG11 VAL F 20 26.155 12.846 -4.951 1.00 33.65 H new ATOM 0 HG12 VAL F 20 25.215 13.490 -3.851 1.00 33.65 H new ATOM 0 HG13 VAL F 20 24.586 12.651 -5.037 1.00 33.65 H new ATOM 0 HG21 VAL F 20 26.203 13.780 -7.258 1.00 31.35 H new ATOM 0 HG22 VAL F 20 24.636 13.595 -7.384 1.00 31.35 H new ATOM 0 HG23 VAL F 20 25.287 15.017 -7.628 1.00 31.35 H new ATOM 4274 N GLU F 21 23.240 16.453 -7.375 1.00 34.61 N ATOM 4275 CA GLU F 21 23.173 17.629 -8.236 1.00 36.95 C ATOM 4276 C GLU F 21 22.302 18.788 -7.754 1.00 35.46 C ATOM 4277 O GLU F 21 21.342 18.614 -7.003 1.00 32.96 O ATOM 4278 CB GLU F 21 22.746 17.222 -9.654 1.00 39.64 C ATOM 4279 CG GLU F 21 21.364 16.582 -9.767 1.00 46.63 C ATOM 4280 CD GLU F 21 21.247 15.259 -9.014 1.00 51.35 C ATOM 4281 OE1 GLU F 21 22.135 14.391 -9.173 1.00 52.35 O ATOM 4282 OE2 GLU F 21 20.257 15.084 -8.269 1.00 54.52 O ATOM 0 H GLU F 21 22.909 15.740 -7.723 1.00 34.61 H new ATOM 0 HA GLU F 21 24.077 17.981 -8.216 1.00 36.95 H new ATOM 0 HB2 GLU F 21 22.768 18.010 -10.220 1.00 39.64 H new ATOM 0 HB3 GLU F 21 23.402 16.601 -10.007 1.00 39.64 H new ATOM 0 HG2 GLU F 21 20.699 17.201 -9.426 1.00 46.63 H new ATOM 0 HG3 GLU F 21 21.159 16.433 -10.703 1.00 46.63 H new ATOM 4283 N LYS F 22 22.676 19.983 -8.203 1.00 35.25 N ATOM 4284 CA LYS F 22 21.979 21.221 -7.888 1.00 34.90 C ATOM 4285 C LYS F 22 20.538 21.058 -8.375 1.00 33.67 C ATOM 4286 O LYS F 22 20.308 20.639 -9.504 1.00 34.86 O ATOM 4287 CB LYS F 22 22.681 22.366 -8.621 1.00 37.68 C ATOM 4288 CG LYS F 22 22.364 23.763 -8.137 1.00 39.48 C ATOM 4289 CD LYS F 22 23.324 24.748 -8.802 1.00 41.49 C ATOM 4290 CE LYS F 22 23.006 26.190 -8.452 1.00 41.99 C ATOM 4291 NZ LYS F 22 23.956 27.127 -9.122 1.00 43.13 N ATOM 0 H LYS F 22 23.360 20.097 -8.712 1.00 35.25 H new ATOM 0 HA LYS F 22 21.983 21.417 -6.938 1.00 34.90 H new ATOM 0 HB2 LYS F 22 23.639 22.230 -8.553 1.00 37.68 H new ATOM 0 HB3 LYS F 22 22.453 22.310 -9.562 1.00 37.68 H new ATOM 0 HG2 LYS F 22 21.446 23.992 -8.352 1.00 39.48 H new ATOM 0 HG3 LYS F 22 22.450 23.811 -7.172 1.00 39.48 H new ATOM 0 HD2 LYS F 22 24.232 24.544 -8.530 1.00 41.49 H new ATOM 0 HD3 LYS F 22 23.284 24.635 -9.765 1.00 41.49 H new ATOM 0 HE2 LYS F 22 22.098 26.399 -8.721 1.00 41.99 H new ATOM 0 HE3 LYS F 22 23.052 26.310 -7.491 1.00 41.99 H new ATOM 0 HZ1 LYS F 22 23.751 27.965 -8.903 1.00 43.13 H new ATOM 0 HZ2 LYS F 22 24.787 26.947 -8.858 1.00 43.13 H new ATOM 0 HZ3 LYS F 22 23.897 27.029 -10.005 1.00 43.13 H new ATOM 4292 N GLY F 23 19.569 21.370 -7.524 1.00 32.88 N ATOM 4293 CA GLY F 23 18.182 21.211 -7.915 1.00 31.90 C ATOM 4294 C GLY F 23 17.720 19.758 -7.900 1.00 31.50 C ATOM 4295 O GLY F 23 16.557 19.474 -8.172 1.00 31.47 O ATOM 0 H GLY F 23 19.693 21.671 -6.728 1.00 32.88 H new ATOM 0 HA2 GLY F 23 17.621 21.729 -7.317 1.00 31.90 H new ATOM 0 HA3 GLY F 23 18.059 21.575 -8.806 1.00 31.90 H new ATOM 4296 N GLY F 24 18.627 18.832 -7.597 1.00 31.05 N ATOM 4297 CA GLY F 24 18.260 17.423 -7.544 1.00 30.42 C ATOM 4298 C GLY F 24 17.124 17.177 -6.562 1.00 30.88 C ATOM 4299 O GLY F 24 16.957 17.923 -5.593 1.00 31.07 O ATOM 0 H GLY F 24 19.452 18.998 -7.421 1.00 31.05 H new ATOM 0 HA2 GLY F 24 17.995 17.123 -8.428 1.00 30.42 H new ATOM 0 HA3 GLY F 24 19.032 16.896 -7.285 1.00 30.42 H new ATOM 4300 N LYS F 25 16.351 16.122 -6.788 1.00 30.10 N ATOM 4301 CA LYS F 25 15.215 15.827 -5.922 1.00 31.71 C ATOM 4302 C LYS F 25 15.543 15.135 -4.599 1.00 31.16 C ATOM 4303 O LYS F 25 16.562 14.452 -4.462 1.00 29.55 O ATOM 4304 CB LYS F 25 14.190 14.963 -6.669 1.00 31.82 C ATOM 4305 CG LYS F 25 14.601 13.507 -6.820 1.00 34.98 C ATOM 4306 CD LYS F 25 13.533 12.703 -7.554 1.00 39.87 C ATOM 4307 CE LYS F 25 13.892 11.229 -7.643 1.00 39.76 C ATOM 4308 NZ LYS F 25 12.811 10.434 -8.289 1.00 43.46 N ATOM 0 H LYS F 25 16.465 15.566 -7.434 1.00 30.10 H new ATOM 0 HA LYS F 25 14.865 16.702 -5.691 1.00 31.71 H new ATOM 0 HB2 LYS F 25 13.343 15.003 -6.198 1.00 31.82 H new ATOM 0 HB3 LYS F 25 14.043 15.341 -7.550 1.00 31.82 H new ATOM 0 HG2 LYS F 25 15.439 13.454 -7.305 1.00 34.98 H new ATOM 0 HG3 LYS F 25 14.755 13.120 -5.944 1.00 34.98 H new ATOM 0 HD2 LYS F 25 12.684 12.801 -7.096 1.00 39.87 H new ATOM 0 HD3 LYS F 25 13.417 13.061 -8.448 1.00 39.87 H new ATOM 0 HE2 LYS F 25 14.714 11.126 -8.147 1.00 39.76 H new ATOM 0 HE3 LYS F 25 14.060 10.883 -6.753 1.00 39.76 H new ATOM 0 HZ1 LYS F 25 13.053 9.578 -8.325 1.00 43.46 H new ATOM 0 HZ2 LYS F 25 12.062 10.511 -7.815 1.00 43.46 H new ATOM 0 HZ3 LYS F 25 12.672 10.737 -9.114 1.00 43.46 H new ATOM 4309 N HIS F 26 14.668 15.343 -3.621 1.00 30.32 N ATOM 4310 CA HIS F 26 14.805 14.683 -2.334 1.00 30.32 C ATOM 4311 C HIS F 26 14.183 13.320 -2.603 1.00 29.79 C ATOM 4312 O HIS F 26 13.290 13.199 -3.444 1.00 28.73 O ATOM 4313 CB HIS F 26 13.985 15.384 -1.243 1.00 28.50 C ATOM 4314 CG HIS F 26 14.453 16.768 -0.917 1.00 29.37 C ATOM 4315 ND1 HIS F 26 15.786 17.092 -0.790 1.00 29.92 N ATOM 4316 CD2 HIS F 26 13.764 17.902 -0.651 1.00 28.51 C ATOM 4317 CE1 HIS F 26 15.898 18.365 -0.458 1.00 26.71 C ATOM 4318 NE2 HIS F 26 14.686 18.880 -0.366 1.00 27.49 N ATOM 0 H HIS F 26 13.987 15.864 -3.685 1.00 30.32 H new ATOM 0 HA HIS F 26 15.724 14.669 -2.023 1.00 30.32 H new ATOM 0 HB2 HIS F 26 13.058 15.425 -1.526 1.00 28.50 H new ATOM 0 HB3 HIS F 26 14.012 14.846 -0.436 1.00 28.50 H new ATOM 0 HD2 HIS F 26 12.839 18.001 -0.660 1.00 28.51 H new ATOM 0 HE1 HIS F 26 16.695 18.821 -0.314 1.00 26.71 H new ATOM 0 HE2 HIS F 26 14.503 19.695 -0.161 1.00 27.49 H new ATOM 4319 N LYS F 27 14.659 12.299 -1.905 1.00 29.09 N ATOM 4320 CA LYS F 27 14.131 10.953 -2.048 1.00 29.68 C ATOM 4321 C LYS F 27 13.918 10.521 -0.603 1.00 29.60 C ATOM 4322 O LYS F 27 13.389 11.301 0.190 1.00 30.47 O ATOM 4323 CB LYS F 27 15.158 10.072 -2.760 1.00 30.90 C ATOM 4324 CG LYS F 27 15.615 10.654 -4.098 1.00 33.17 C ATOM 4325 CD LYS F 27 16.742 9.848 -4.731 1.00 34.72 C ATOM 4326 CE LYS F 27 16.278 8.475 -5.195 1.00 36.28 C ATOM 4327 NZ LYS F 27 17.394 7.673 -5.775 1.00 34.30 N ATOM 0 H LYS F 27 15.299 12.368 -1.334 1.00 29.09 H new ATOM 0 HA LYS F 27 13.319 10.893 -2.575 1.00 29.68 H new ATOM 0 HB2 LYS F 27 15.929 9.952 -2.184 1.00 30.90 H new ATOM 0 HB3 LYS F 27 14.776 9.193 -2.908 1.00 30.90 H new ATOM 0 HG2 LYS F 27 14.861 10.685 -4.708 1.00 33.17 H new ATOM 0 HG3 LYS F 27 15.910 11.568 -3.965 1.00 33.17 H new ATOM 0 HD2 LYS F 27 17.103 10.338 -5.487 1.00 34.72 H new ATOM 0 HD3 LYS F 27 17.463 9.744 -4.090 1.00 34.72 H new ATOM 0 HE2 LYS F 27 15.892 7.995 -4.446 1.00 36.28 H new ATOM 0 HE3 LYS F 27 15.577 8.578 -5.858 1.00 36.28 H new ATOM 0 HZ1 LYS F 27 17.123 6.834 -5.900 1.00 34.30 H new ATOM 0 HZ2 LYS F 27 17.639 8.025 -6.555 1.00 34.30 H new ATOM 0 HZ3 LYS F 27 18.087 7.680 -5.216 1.00 34.30 H new ATOM 4328 N THR F 28 14.317 9.306 -0.242 1.00 28.58 N ATOM 4329 CA THR F 28 14.166 8.894 1.148 1.00 26.02 C ATOM 4330 C THR F 28 14.991 9.906 1.949 1.00 25.40 C ATOM 4331 O THR F 28 14.558 10.396 2.987 1.00 26.56 O ATOM 4332 CB THR F 28 14.722 7.473 1.402 1.00 25.31 C ATOM 4333 OG1 THR F 28 14.013 6.522 0.602 1.00 26.60 O ATOM 4334 CG2 THR F 28 14.545 7.101 2.862 1.00 26.55 C ATOM 0 H THR F 28 14.667 8.722 -0.767 1.00 28.58 H new ATOM 0 HA THR F 28 13.229 8.871 1.397 1.00 26.02 H new ATOM 0 HB THR F 28 15.664 7.465 1.170 1.00 25.31 H new ATOM 0 HG1 THR F 28 13.876 5.825 1.050 1.00 26.60 H new ATOM 0 HG21 THR F 28 14.896 6.209 3.014 1.00 26.55 H new ATOM 0 HG22 THR F 28 15.024 7.735 3.418 1.00 26.55 H new ATOM 0 HG23 THR F 28 13.602 7.120 3.089 1.00 26.55 H new ATOM 4335 N GLY F 29 16.179 10.217 1.436 1.00 25.28 N ATOM 4336 CA GLY F 29 17.063 11.177 2.074 1.00 24.28 C ATOM 4337 C GLY F 29 17.108 12.494 1.312 1.00 25.47 C ATOM 4338 O GLY F 29 16.670 12.558 0.165 1.00 23.68 O ATOM 0 H GLY F 29 16.491 9.877 0.710 1.00 25.28 H new ATOM 0 HA2 GLY F 29 16.764 11.339 2.982 1.00 24.28 H new ATOM 0 HA3 GLY F 29 17.957 10.805 2.132 1.00 24.28 H new ATOM 4339 N PRO F 30 17.635 13.568 1.920 1.00 25.51 N ATOM 4340 CA PRO F 30 17.718 14.879 1.269 1.00 26.32 C ATOM 4341 C PRO F 30 18.758 15.003 0.161 1.00 26.19 C ATOM 4342 O PRO F 30 19.787 14.328 0.176 1.00 26.90 O ATOM 4343 CB PRO F 30 18.032 15.814 2.431 1.00 26.91 C ATOM 4344 CG PRO F 30 18.874 14.951 3.320 1.00 26.23 C ATOM 4345 CD PRO F 30 18.095 13.653 3.319 1.00 26.07 C ATOM 0 HA PRO F 30 16.895 15.076 0.794 1.00 26.32 H new ATOM 0 HB2 PRO F 30 18.509 16.606 2.139 1.00 26.91 H new ATOM 0 HB3 PRO F 30 17.227 16.117 2.879 1.00 26.91 H new ATOM 0 HG2 PRO F 30 19.772 14.837 2.972 1.00 26.23 H new ATOM 0 HG3 PRO F 30 18.961 15.323 4.212 1.00 26.23 H new ATOM 0 HD2 PRO F 30 18.651 12.897 3.565 1.00 26.07 H new ATOM 0 HD3 PRO F 30 17.353 13.675 3.944 1.00 26.07 H new ATOM 4346 N ASN F 31 18.480 15.867 -0.810 1.00 26.22 N ATOM 4347 CA ASN F 31 19.435 16.104 -1.881 1.00 24.54 C ATOM 4348 C ASN F 31 20.677 16.639 -1.154 1.00 25.22 C ATOM 4349 O ASN F 31 20.558 17.370 -0.163 1.00 23.21 O ATOM 4350 CB ASN F 31 18.873 17.130 -2.866 1.00 24.27 C ATOM 4351 CG ASN F 31 19.941 17.738 -3.741 1.00 23.51 C ATOM 4352 OD1 ASN F 31 20.609 18.678 -3.340 1.00 24.76 O ATOM 4353 ND2 ASN F 31 20.122 17.187 -4.934 1.00 22.08 N ATOM 0 H ASN F 31 17.752 16.321 -0.866 1.00 26.22 H new ATOM 0 HA ASN F 31 19.634 15.312 -2.404 1.00 24.54 H new ATOM 0 HB2 ASN F 31 18.205 16.704 -3.425 1.00 24.27 H new ATOM 0 HB3 ASN F 31 18.423 17.834 -2.373 1.00 24.27 H new ATOM 0 HD21 ASN F 31 20.730 17.491 -5.460 1.00 22.08 H new ATOM 0 HD22 ASN F 31 19.631 16.526 -5.181 1.00 22.08 H new ATOM 4354 N LEU F 32 21.860 16.260 -1.627 1.00 25.57 N ATOM 4355 CA LEU F 32 23.103 16.669 -0.976 1.00 25.51 C ATOM 4356 C LEU F 32 23.850 17.838 -1.624 1.00 26.89 C ATOM 4357 O LEU F 32 25.007 18.098 -1.282 1.00 28.50 O ATOM 4358 CB LEU F 32 24.047 15.465 -0.885 1.00 23.47 C ATOM 4359 CG LEU F 32 23.480 14.212 -0.208 1.00 23.60 C ATOM 4360 CD1 LEU F 32 24.484 13.086 -0.296 1.00 22.61 C ATOM 4361 CD2 LEU F 32 23.148 14.512 1.231 1.00 22.99 C ATOM 0 H LEU F 32 21.966 15.766 -2.323 1.00 25.57 H new ATOM 0 HA LEU F 32 22.830 16.994 -0.104 1.00 25.51 H new ATOM 0 HB2 LEU F 32 24.325 15.227 -1.783 1.00 23.47 H new ATOM 0 HB3 LEU F 32 24.844 15.738 -0.404 1.00 23.47 H new ATOM 0 HG LEU F 32 22.667 13.941 -0.662 1.00 23.60 H new ATOM 0 HD11 LEU F 32 24.122 12.295 0.133 1.00 22.61 H new ATOM 0 HD12 LEU F 32 24.671 12.891 -1.228 1.00 22.61 H new ATOM 0 HD13 LEU F 32 25.305 13.348 0.150 1.00 22.61 H new ATOM 0 HD21 LEU F 32 22.790 13.716 1.653 1.00 22.99 H new ATOM 0 HD22 LEU F 32 23.951 14.791 1.697 1.00 22.99 H new ATOM 0 HD23 LEU F 32 22.489 15.222 1.270 1.00 22.99 H new ATOM 4362 N HIS F 33 23.210 18.548 -2.545 1.00 26.88 N ATOM 4363 CA HIS F 33 23.896 19.667 -3.189 1.00 29.24 C ATOM 4364 C HIS F 33 24.277 20.791 -2.230 1.00 26.58 C ATOM 4365 O HIS F 33 23.436 21.294 -1.488 1.00 26.59 O ATOM 4366 CB HIS F 33 23.056 20.281 -4.303 1.00 31.65 C ATOM 4367 CG HIS F 33 23.659 21.535 -4.847 1.00 33.70 C ATOM 4368 ND1 HIS F 33 24.813 21.533 -5.598 1.00 36.40 N ATOM 4369 CD2 HIS F 33 23.336 22.835 -4.654 1.00 36.26 C ATOM 4370 CE1 HIS F 33 25.177 22.777 -5.846 1.00 37.67 C ATOM 4371 NE2 HIS F 33 24.298 23.587 -5.283 1.00 38.07 N ATOM 0 H HIS F 33 22.403 18.407 -2.807 1.00 26.88 H new ATOM 0 HA HIS F 33 24.708 19.273 -3.545 1.00 29.24 H new ATOM 0 HB2 HIS F 33 22.954 19.636 -5.021 1.00 31.65 H new ATOM 0 HB3 HIS F 33 22.167 20.473 -3.966 1.00 31.65 H new ATOM 0 HD2 HIS F 33 22.601 23.158 -4.184 1.00 36.26 H new ATOM 0 HE1 HIS F 33 25.924 23.039 -6.334 1.00 37.67 H new ATOM 0 HE2 HIS F 33 24.324 24.446 -5.307 1.00 38.07 H new ATOM 4372 N GLY F 34 25.543 21.199 -2.277 1.00 29.22 N ATOM 4373 CA GLY F 34 26.024 22.261 -1.410 1.00 29.86 C ATOM 4374 C GLY F 34 26.231 21.782 0.019 1.00 31.90 C ATOM 4375 O GLY F 34 26.157 22.568 0.967 1.00 32.93 O ATOM 0 H GLY F 34 26.137 20.871 -2.806 1.00 29.22 H new ATOM 0 HA2 GLY F 34 26.860 22.608 -1.758 1.00 29.86 H new ATOM 0 HA3 GLY F 34 25.389 22.994 -1.415 1.00 29.86 H new ATOM 4376 N LEU F 35 26.496 20.488 0.170 1.00 32.30 N ATOM 4377 CA LEU F 35 26.704 19.872 1.480 1.00 31.26 C ATOM 4378 C LEU F 35 27.855 20.490 2.273 1.00 32.19 C ATOM 4379 O LEU F 35 27.668 20.943 3.399 1.00 32.61 O ATOM 4380 CB LEU F 35 26.952 18.369 1.308 1.00 29.15 C ATOM 4381 CG LEU F 35 27.234 17.505 2.545 1.00 30.68 C ATOM 4382 CD1 LEU F 35 26.021 17.472 3.447 1.00 29.48 C ATOM 4383 CD2 LEU F 35 27.601 16.094 2.111 1.00 29.73 C ATOM 0 H LEU F 35 26.561 19.938 -0.488 1.00 32.30 H new ATOM 0 HA LEU F 35 25.896 20.034 1.991 1.00 31.26 H new ATOM 0 HB2 LEU F 35 26.176 17.995 0.863 1.00 29.15 H new ATOM 0 HB3 LEU F 35 27.703 18.265 0.703 1.00 29.15 H new ATOM 0 HG LEU F 35 27.976 17.890 3.038 1.00 30.68 H new ATOM 0 HD11 LEU F 35 26.210 16.924 4.224 1.00 29.48 H new ATOM 0 HD12 LEU F 35 25.805 18.374 3.732 1.00 29.48 H new ATOM 0 HD13 LEU F 35 25.268 17.097 2.964 1.00 29.48 H new ATOM 0 HD21 LEU F 35 27.779 15.550 2.894 1.00 29.73 H new ATOM 0 HD22 LEU F 35 26.866 15.708 1.610 1.00 29.73 H new ATOM 0 HD23 LEU F 35 28.393 16.123 1.552 1.00 29.73 H new ATOM 4384 N PHE F 36 29.043 20.499 1.680 1.00 34.04 N ATOM 4385 CA PHE F 36 30.237 21.031 2.330 1.00 34.59 C ATOM 4386 C PHE F 36 30.130 22.497 2.726 1.00 35.36 C ATOM 4387 O PHE F 36 29.839 23.362 1.895 1.00 32.63 O ATOM 4388 CB PHE F 36 31.454 20.832 1.423 1.00 36.86 C ATOM 4389 CG PHE F 36 31.825 19.390 1.217 1.00 38.69 C ATOM 4390 CD1 PHE F 36 30.969 18.525 0.544 1.00 37.57 C ATOM 4391 CD2 PHE F 36 33.020 18.888 1.725 1.00 38.83 C ATOM 4392 CE1 PHE F 36 31.295 17.182 0.382 1.00 37.22 C ATOM 4393 CE2 PHE F 36 33.353 17.548 1.568 1.00 38.45 C ATOM 4394 CZ PHE F 36 32.487 16.694 0.895 1.00 38.31 C ATOM 0 H PHE F 36 29.181 20.196 0.887 1.00 34.04 H new ATOM 0 HA PHE F 36 30.336 20.533 3.156 1.00 34.59 H new ATOM 0 HB2 PHE F 36 31.274 21.238 0.560 1.00 36.86 H new ATOM 0 HB3 PHE F 36 32.212 21.301 1.805 1.00 36.86 H new ATOM 0 HD1 PHE F 36 30.169 18.848 0.198 1.00 37.57 H new ATOM 0 HD2 PHE F 36 33.603 19.456 2.175 1.00 38.83 H new ATOM 0 HE1 PHE F 36 30.714 16.613 -0.070 1.00 37.22 H new ATOM 0 HE2 PHE F 36 34.154 17.223 1.912 1.00 38.45 H new ATOM 0 HZ PHE F 36 32.707 15.797 0.789 1.00 38.31 H new ATOM 4395 N GLY F 37 30.375 22.765 4.005 1.00 34.33 N ATOM 4396 CA GLY F 37 30.309 24.123 4.508 1.00 35.61 C ATOM 4397 C GLY F 37 28.937 24.476 5.042 1.00 37.48 C ATOM 4398 O GLY F 37 28.731 25.567 5.579 1.00 37.96 O ATOM 0 H GLY F 37 30.581 22.173 4.594 1.00 34.33 H new ATOM 0 HA2 GLY F 37 30.966 24.236 5.212 1.00 35.61 H new ATOM 0 HA3 GLY F 37 30.545 24.740 3.798 1.00 35.61 H new ATOM 4399 N ARG F 38 27.990 23.554 4.901 1.00 38.09 N ATOM 4400 CA ARG F 38 26.637 23.794 5.377 1.00 37.44 C ATOM 4401 C ARG F 38 26.376 23.063 6.693 1.00 38.12 C ATOM 4402 O ARG F 38 26.932 21.995 6.948 1.00 38.59 O ATOM 4403 CB ARG F 38 25.633 23.351 4.317 1.00 37.64 C ATOM 4404 CG ARG F 38 24.219 23.821 4.578 1.00 39.93 C ATOM 4405 CD ARG F 38 23.366 23.604 3.351 1.00 39.77 C ATOM 4406 NE ARG F 38 23.155 22.187 3.086 1.00 41.17 N ATOM 4407 CZ ARG F 38 22.749 21.699 1.920 1.00 42.72 C ATOM 4408 NH1 ARG F 38 22.578 20.391 1.770 1.00 43.50 N ATOM 4409 NH2 ARG F 38 22.529 22.517 0.896 1.00 43.53 N ATOM 0 H ARG F 38 28.112 22.786 4.534 1.00 38.09 H new ATOM 0 HA ARG F 38 26.534 24.745 5.541 1.00 37.44 H new ATOM 0 HB2 ARG F 38 25.921 23.684 3.452 1.00 37.64 H new ATOM 0 HB3 ARG F 38 25.638 22.382 4.264 1.00 37.64 H new ATOM 0 HG2 ARG F 38 23.844 23.338 5.331 1.00 39.93 H new ATOM 0 HG3 ARG F 38 24.222 24.761 4.817 1.00 39.93 H new ATOM 0 HD2 ARG F 38 22.509 24.042 3.471 1.00 39.77 H new ATOM 0 HD3 ARG F 38 23.791 24.017 2.583 1.00 39.77 H new ATOM 0 HE ARG F 38 23.303 21.631 3.726 1.00 41.17 H new ATOM 0 HH11 ARG F 38 22.730 19.859 2.428 1.00 43.50 H new ATOM 0 HH12 ARG F 38 22.315 20.076 1.014 1.00 43.50 H new ATOM 0 HH21 ARG F 38 22.650 23.363 0.988 1.00 43.53 H new ATOM 0 HH22 ARG F 38 22.266 22.200 0.141 1.00 43.53 H new ATOM 4410 N LYS F 39 25.528 23.650 7.527 1.00 38.33 N ATOM 4411 CA LYS F 39 25.191 23.064 8.819 1.00 38.43 C ATOM 4412 C LYS F 39 24.284 21.848 8.621 1.00 37.31 C ATOM 4413 O LYS F 39 23.595 21.739 7.604 1.00 36.26 O ATOM 4414 CB LYS F 39 24.482 24.108 9.682 1.00 39.02 C ATOM 4415 CG LYS F 39 25.045 24.262 11.086 1.00 42.75 C ATOM 4416 CD LYS F 39 26.500 24.692 11.056 1.00 41.47 C ATOM 4417 CE LYS F 39 26.978 25.140 12.432 1.00 42.06 C ATOM 4418 NZ LYS F 39 26.300 26.395 12.892 1.00 40.12 N ATOM 0 H LYS F 39 25.133 24.396 7.362 1.00 38.33 H new ATOM 0 HA LYS F 39 26.004 22.778 9.263 1.00 38.43 H new ATOM 0 HB2 LYS F 39 24.528 24.966 9.233 1.00 39.02 H new ATOM 0 HB3 LYS F 39 23.543 23.872 9.747 1.00 39.02 H new ATOM 0 HG2 LYS F 39 24.523 24.917 11.576 1.00 42.75 H new ATOM 0 HG3 LYS F 39 24.964 23.421 11.563 1.00 42.75 H new ATOM 0 HD2 LYS F 39 27.050 23.956 10.745 1.00 41.47 H new ATOM 0 HD3 LYS F 39 26.611 25.417 10.421 1.00 41.47 H new ATOM 0 HE2 LYS F 39 26.814 24.432 13.075 1.00 42.06 H new ATOM 0 HE3 LYS F 39 27.937 25.284 12.407 1.00 42.06 H new ATOM 0 HZ1 LYS F 39 26.756 26.748 13.570 1.00 40.12 H new ATOM 0 HZ2 LYS F 39 26.268 26.978 12.221 1.00 40.12 H new ATOM 0 HZ3 LYS F 39 25.473 26.205 13.159 1.00 40.12 H new ATOM 4419 N THR F 40 24.290 20.937 9.590 1.00 35.76 N ATOM 4420 CA THR F 40 23.465 19.735 9.509 1.00 34.73 C ATOM 4421 C THR F 40 21.980 20.063 9.433 1.00 34.60 C ATOM 4422 O THR F 40 21.518 21.046 10.011 1.00 33.53 O ATOM 4423 CB THR F 40 23.677 18.807 10.727 1.00 35.23 C ATOM 4424 OG1 THR F 40 23.542 19.565 11.936 1.00 33.77 O ATOM 4425 CG2 THR F 40 25.043 18.160 10.679 1.00 34.16 C ATOM 0 H THR F 40 24.766 20.996 10.304 1.00 35.76 H new ATOM 0 HA THR F 40 23.745 19.286 8.696 1.00 34.73 H new ATOM 0 HB THR F 40 23.006 18.107 10.703 1.00 35.23 H new ATOM 0 HG1 THR F 40 22.740 19.555 12.185 1.00 33.77 H new ATOM 0 HG21 THR F 40 25.155 17.583 11.451 1.00 34.16 H new ATOM 0 HG22 THR F 40 25.124 17.634 9.868 1.00 34.16 H new ATOM 0 HG23 THR F 40 25.727 18.847 10.688 1.00 34.16 H new ATOM 4426 N GLY F 41 21.241 19.225 8.714 1.00 34.14 N ATOM 4427 CA GLY F 41 19.809 19.413 8.579 1.00 34.95 C ATOM 4428 C GLY F 41 19.396 20.731 7.960 1.00 35.34 C ATOM 4429 O GLY F 41 18.447 21.360 8.428 1.00 35.07 O ATOM 0 H GLY F 41 21.554 18.541 8.297 1.00 34.14 H new ATOM 0 HA2 GLY F 41 19.450 18.691 8.040 1.00 34.95 H new ATOM 0 HA3 GLY F 41 19.402 19.341 9.457 1.00 34.95 H new ATOM 4430 N GLN F 42 20.076 21.148 6.895 1.00 36.09 N ATOM 4431 CA GLN F 42 19.733 22.417 6.269 1.00 37.66 C ATOM 4432 C GLN F 42 19.300 22.364 4.807 1.00 37.68 C ATOM 4433 O GLN F 42 19.120 23.410 4.191 1.00 38.64 O ATOM 4434 CB GLN F 42 20.896 23.403 6.411 1.00 38.54 C ATOM 4435 CG GLN F 42 21.283 23.700 7.849 1.00 41.69 C ATOM 4436 CD GLN F 42 20.100 24.142 8.696 1.00 43.25 C ATOM 4437 OE1 GLN F 42 19.394 25.095 8.353 1.00 43.05 O ATOM 4438 NE2 GLN F 42 19.880 23.452 9.815 1.00 43.26 N ATOM 0 H GLN F 42 20.725 20.720 6.527 1.00 36.09 H new ATOM 0 HA GLN F 42 18.944 22.708 6.752 1.00 37.66 H new ATOM 0 HB2 GLN F 42 21.669 23.047 5.945 1.00 38.54 H new ATOM 0 HB3 GLN F 42 20.658 24.234 5.972 1.00 38.54 H new ATOM 0 HG2 GLN F 42 21.680 22.908 8.243 1.00 41.69 H new ATOM 0 HG3 GLN F 42 21.961 24.393 7.861 1.00 41.69 H new ATOM 0 HE21 GLN F 42 20.393 22.794 10.022 1.00 43.26 H new ATOM 0 HE22 GLN F 42 19.225 23.665 10.330 1.00 43.26 H new ATOM 4439 N ALA F 43 19.135 21.173 4.238 1.00 37.45 N ATOM 4440 CA ALA F 43 18.696 21.084 2.841 1.00 36.56 C ATOM 4441 C ALA F 43 17.261 21.617 2.704 1.00 36.18 C ATOM 4442 O ALA F 43 16.319 21.065 3.280 1.00 35.32 O ATOM 4443 CB ALA F 43 18.770 19.644 2.357 1.00 36.35 C ATOM 0 H ALA F 43 19.267 20.419 4.630 1.00 37.45 H new ATOM 0 HA ALA F 43 19.285 21.626 2.293 1.00 36.56 H new ATOM 0 HB1 ALA F 43 18.478 19.597 1.433 1.00 36.35 H new ATOM 0 HB2 ALA F 43 19.684 19.327 2.423 1.00 36.35 H new ATOM 0 HB3 ALA F 43 18.195 19.088 2.906 1.00 36.35 H new ATOM 4444 N PRO F 44 17.074 22.699 1.928 1.00 35.90 N ATOM 4445 CA PRO F 44 15.743 23.289 1.738 1.00 35.60 C ATOM 4446 C PRO F 44 14.698 22.301 1.228 1.00 34.40 C ATOM 4447 O PRO F 44 14.939 21.582 0.255 1.00 35.00 O ATOM 4448 CB PRO F 44 16.003 24.406 0.728 1.00 35.96 C ATOM 4449 CG PRO F 44 17.423 24.780 0.982 1.00 36.37 C ATOM 4450 CD PRO F 44 18.077 23.427 1.133 1.00 36.17 C ATOM 0 HA PRO F 44 15.364 23.597 2.576 1.00 35.60 H new ATOM 0 HB2 PRO F 44 15.871 24.101 -0.183 1.00 35.96 H new ATOM 0 HB3 PRO F 44 15.406 25.158 0.865 1.00 35.96 H new ATOM 0 HG2 PRO F 44 17.802 25.288 0.248 1.00 36.37 H new ATOM 0 HG3 PRO F 44 17.519 25.322 1.781 1.00 36.37 H new ATOM 0 HD2 PRO F 44 18.240 23.003 0.276 1.00 36.17 H new ATOM 0 HD3 PRO F 44 18.932 23.484 1.588 1.00 36.17 H new ATOM 4451 N GLY F 45 13.545 22.268 1.891 1.00 33.19 N ATOM 4452 CA GLY F 45 12.470 21.381 1.475 1.00 33.27 C ATOM 4453 C GLY F 45 12.445 19.952 1.999 1.00 33.59 C ATOM 4454 O GLY F 45 11.586 19.168 1.595 1.00 33.77 O ATOM 0 H GLY F 45 13.368 22.750 2.581 1.00 33.19 H new ATOM 0 HA2 GLY F 45 11.632 21.799 1.727 1.00 33.27 H new ATOM 0 HA3 GLY F 45 12.486 21.337 0.506 1.00 33.27 H new ATOM 4455 N PHE F 46 13.367 19.592 2.887 1.00 31.12 N ATOM 4456 CA PHE F 46 13.384 18.234 3.420 1.00 30.80 C ATOM 4457 C PHE F 46 13.152 18.243 4.924 1.00 31.04 C ATOM 4458 O PHE F 46 13.761 19.026 5.650 1.00 31.14 O ATOM 4459 CB PHE F 46 14.722 17.548 3.123 1.00 31.75 C ATOM 4460 CG PHE F 46 14.764 16.102 3.536 1.00 28.33 C ATOM 4461 CD1 PHE F 46 14.297 15.109 2.684 1.00 29.85 C ATOM 4462 CD2 PHE F 46 15.234 15.739 4.794 1.00 29.89 C ATOM 4463 CE1 PHE F 46 14.296 13.771 3.079 1.00 28.13 C ATOM 4464 CE2 PHE F 46 15.238 14.411 5.202 1.00 26.31 C ATOM 4465 CZ PHE F 46 14.769 13.422 4.346 1.00 29.32 C ATOM 0 H PHE F 46 13.983 20.110 3.190 1.00 31.12 H new ATOM 0 HA PHE F 46 12.669 17.741 2.987 1.00 30.80 H new ATOM 0 HB2 PHE F 46 14.904 17.610 2.172 1.00 31.75 H new ATOM 0 HB3 PHE F 46 15.431 18.027 3.580 1.00 31.75 H new ATOM 0 HD1 PHE F 46 13.981 15.339 1.840 1.00 29.85 H new ATOM 0 HD2 PHE F 46 15.551 16.396 5.371 1.00 29.89 H new ATOM 0 HE1 PHE F 46 13.982 13.114 2.501 1.00 28.13 H new ATOM 0 HE2 PHE F 46 15.554 14.184 6.047 1.00 26.31 H new ATOM 0 HZ PHE F 46 14.770 12.532 4.615 1.00 29.32 H new ATOM 4466 N THR F 47 12.272 17.363 5.387 1.00 30.11 N ATOM 4467 CA THR F 47 11.964 17.275 6.807 1.00 30.76 C ATOM 4468 C THR F 47 12.871 16.267 7.495 1.00 30.05 C ATOM 4469 O THR F 47 12.711 15.060 7.320 1.00 30.27 O ATOM 4470 CB THR F 47 10.504 16.853 7.027 1.00 31.43 C ATOM 4471 OG1 THR F 47 9.639 17.875 6.523 1.00 32.27 O ATOM 4472 CG2 THR F 47 10.226 16.636 8.514 1.00 30.89 C ATOM 0 H THR F 47 11.841 16.806 4.893 1.00 30.11 H new ATOM 0 HA THR F 47 12.107 18.155 7.188 1.00 30.76 H new ATOM 0 HB THR F 47 10.342 16.020 6.557 1.00 31.43 H new ATOM 0 HG1 THR F 47 8.839 17.648 6.640 1.00 32.27 H new ATOM 0 HG21 THR F 47 9.301 16.370 8.635 1.00 30.89 H new ATOM 0 HG22 THR F 47 10.809 15.939 8.854 1.00 30.89 H new ATOM 0 HG23 THR F 47 10.391 17.460 8.998 1.00 30.89 H new ATOM 4473 N TYR F 48 13.819 16.777 8.274 1.00 30.29 N ATOM 4474 CA TYR F 48 14.783 15.951 9.005 1.00 30.31 C ATOM 4475 C TYR F 48 14.240 15.506 10.361 1.00 29.88 C ATOM 4476 O TYR F 48 13.173 15.943 10.786 1.00 28.29 O ATOM 4477 CB TYR F 48 16.052 16.756 9.274 1.00 30.05 C ATOM 4478 CG TYR F 48 16.853 17.152 8.060 1.00 31.29 C ATOM 4479 CD1 TYR F 48 17.876 16.338 7.590 1.00 31.30 C ATOM 4480 CD2 TYR F 48 16.632 18.371 7.419 1.00 30.98 C ATOM 4481 CE1 TYR F 48 18.671 16.727 6.521 1.00 32.38 C ATOM 4482 CE2 TYR F 48 17.418 18.769 6.344 1.00 30.25 C ATOM 4483 CZ TYR F 48 18.440 17.944 5.904 1.00 31.61 C ATOM 4484 OH TYR F 48 19.261 18.340 4.877 1.00 27.58 O ATOM 0 H TYR F 48 13.924 17.622 8.396 1.00 30.29 H new ATOM 0 HA TYR F 48 14.961 15.172 8.455 1.00 30.31 H new ATOM 0 HB2 TYR F 48 15.807 17.562 9.755 1.00 30.05 H new ATOM 0 HB3 TYR F 48 16.624 16.238 9.862 1.00 30.05 H new ATOM 0 HD1 TYR F 48 18.031 15.517 7.999 1.00 31.30 H new ATOM 0 HD2 TYR F 48 15.948 18.926 7.716 1.00 30.98 H new ATOM 0 HE1 TYR F 48 19.355 16.173 6.221 1.00 32.38 H new ATOM 0 HE2 TYR F 48 17.259 19.583 5.923 1.00 30.25 H new ATOM 0 HH TYR F 48 20.061 18.194 5.086 1.00 27.58 H new ATOM 4485 N THR F 49 14.985 14.627 11.034 1.00 29.35 N ATOM 4486 CA THR F 49 14.611 14.196 12.379 1.00 26.88 C ATOM 4487 C THR F 49 15.035 15.385 13.243 1.00 26.54 C ATOM 4488 O THR F 49 15.865 16.184 12.828 1.00 28.83 O ATOM 4489 CB THR F 49 15.422 12.962 12.871 1.00 25.63 C ATOM 4490 OG1 THR F 49 16.827 13.208 12.701 1.00 23.55 O ATOM 4491 CG2 THR F 49 15.024 11.700 12.118 1.00 24.22 C ATOM 0 H THR F 49 15.707 14.271 10.730 1.00 29.35 H new ATOM 0 HA THR F 49 13.674 13.948 12.414 1.00 26.88 H new ATOM 0 HB THR F 49 15.224 12.825 13.811 1.00 25.63 H new ATOM 0 HG1 THR F 49 17.093 12.839 11.995 1.00 23.55 H new ATOM 0 HG21 THR F 49 15.545 10.950 12.445 1.00 24.22 H new ATOM 0 HG22 THR F 49 14.080 11.524 12.258 1.00 24.22 H new ATOM 0 HG23 THR F 49 15.193 11.821 11.171 1.00 24.22 H new ATOM 4492 N ASP F 50 14.476 15.522 14.433 1.00 27.15 N ATOM 4493 CA ASP F 50 14.887 16.626 15.290 1.00 26.69 C ATOM 4494 C ASP F 50 16.384 16.495 15.557 1.00 25.18 C ATOM 4495 O ASP F 50 17.087 17.486 15.709 1.00 25.19 O ATOM 4496 CB ASP F 50 14.121 16.589 16.615 1.00 29.31 C ATOM 4497 CG ASP F 50 12.695 17.091 16.478 1.00 33.11 C ATOM 4498 OD1 ASP F 50 11.853 16.742 17.335 1.00 34.81 O ATOM 4499 OD2 ASP F 50 12.421 17.845 15.519 1.00 35.82 O ATOM 0 H ASP F 50 13.873 15.004 14.760 1.00 27.15 H new ATOM 0 HA ASP F 50 14.694 17.469 14.851 1.00 26.69 H new ATOM 0 HB2 ASP F 50 14.109 15.680 16.953 1.00 29.31 H new ATOM 0 HB3 ASP F 50 14.589 17.129 17.271 1.00 29.31 H new ATOM 4500 N ALA F 51 16.862 15.256 15.602 1.00 24.36 N ATOM 4501 CA ALA F 51 18.265 14.975 15.870 1.00 23.31 C ATOM 4502 C ALA F 51 19.193 15.509 14.780 1.00 23.12 C ATOM 4503 O ALA F 51 20.151 16.215 15.069 1.00 22.49 O ATOM 4504 CB ALA F 51 18.466 13.463 16.044 1.00 21.98 C ATOM 0 H ALA F 51 16.380 14.554 15.478 1.00 24.36 H new ATOM 0 HA ALA F 51 18.501 15.437 16.690 1.00 23.31 H new ATOM 0 HB1 ALA F 51 19.402 13.279 16.222 1.00 21.98 H new ATOM 0 HB2 ALA F 51 17.928 13.148 16.787 1.00 21.98 H new ATOM 0 HB3 ALA F 51 18.196 13.005 15.233 1.00 21.98 H new ATOM 4505 N ASN F 52 18.913 15.161 13.530 1.00 23.26 N ATOM 4506 CA ASN F 52 19.731 15.613 12.398 1.00 25.01 C ATOM 4507 C ASN F 52 19.535 17.124 12.251 1.00 25.09 C ATOM 4508 O ASN F 52 20.473 17.871 12.005 1.00 26.16 O ATOM 4509 CB ASN F 52 19.283 14.867 11.131 1.00 23.39 C ATOM 4510 CG ASN F 52 20.275 14.975 9.972 1.00 24.40 C ATOM 4511 OD1 ASN F 52 20.246 14.151 9.057 1.00 22.92 O ATOM 4512 ND2 ASN F 52 21.129 15.988 9.991 1.00 26.35 N ATOM 0 H ASN F 52 18.250 14.660 13.310 1.00 23.26 H new ATOM 0 HA ASN F 52 20.672 15.426 12.542 1.00 25.01 H new ATOM 0 HB2 ASN F 52 19.150 13.931 11.346 1.00 23.39 H new ATOM 0 HB3 ASN F 52 18.425 15.217 10.845 1.00 23.39 H new ATOM 0 HD21 ASN F 52 21.691 16.089 9.348 1.00 26.35 H new ATOM 0 HD22 ASN F 52 21.121 16.545 10.646 1.00 26.35 H new ATOM 4513 N LYS F 53 18.296 17.562 12.417 1.00 27.86 N ATOM 4514 CA LYS F 53 17.951 18.973 12.316 1.00 29.48 C ATOM 4515 C LYS F 53 18.773 19.821 13.290 1.00 30.40 C ATOM 4516 O LYS F 53 19.271 20.883 12.928 1.00 30.71 O ATOM 4517 CB LYS F 53 16.462 19.145 12.615 0.50 28.50 C ATOM 4518 CG LYS F 53 15.946 20.566 12.559 0.50 30.05 C ATOM 4519 CD LYS F 53 14.463 20.584 12.900 0.50 29.96 C ATOM 4520 CE LYS F 53 13.878 21.980 12.836 0.50 31.00 C ATOM 4521 NZ LYS F 53 12.434 21.976 13.212 0.50 29.93 N ATOM 0 H LYS F 53 17.629 17.049 12.592 1.00 27.86 H new ATOM 0 HA LYS F 53 18.151 19.275 11.416 1.00 29.48 H new ATOM 0 HB2 LYS F 53 15.957 18.609 11.983 0.50 28.50 H new ATOM 0 HB3 LYS F 53 16.282 18.787 13.498 0.50 28.50 H new ATOM 0 HG2 LYS F 53 16.437 21.123 13.183 0.50 30.05 H new ATOM 0 HG3 LYS F 53 16.088 20.937 11.674 0.50 30.05 H new ATOM 0 HD2 LYS F 53 13.984 20.006 12.285 0.50 29.96 H new ATOM 0 HD3 LYS F 53 14.333 20.221 13.790 0.50 29.96 H new ATOM 0 HE2 LYS F 53 14.369 22.567 13.432 0.50 31.00 H new ATOM 0 HE3 LYS F 53 13.981 22.336 11.940 0.50 31.00 H new ATOM 0 HZ1 LYS F 53 12.113 22.805 13.167 0.50 29.93 H new ATOM 0 HZ2 LYS F 53 11.982 21.453 12.651 0.50 29.93 H new ATOM 0 HZ3 LYS F 53 12.344 21.668 14.042 0.50 29.93 H new ATOM 4522 N ASN F 54 18.939 19.334 14.515 1.00 29.72 N ATOM 4523 CA ASN F 54 19.662 20.090 15.530 1.00 32.38 C ATOM 4524 C ASN F 54 21.052 19.608 15.959 1.00 32.05 C ATOM 4525 O ASN F 54 21.529 19.999 17.023 1.00 30.40 O ATOM 4526 CB ASN F 54 18.773 20.216 16.765 1.00 35.51 C ATOM 4527 CG ASN F 54 17.439 20.861 16.448 1.00 38.04 C ATOM 4528 OD1 ASN F 54 16.392 20.395 16.900 1.00 39.25 O ATOM 4529 ND2 ASN F 54 17.469 21.943 15.666 1.00 37.29 N ATOM 0 H ASN F 54 18.642 18.571 14.778 1.00 29.72 H new ATOM 0 HA ASN F 54 19.854 20.933 15.090 1.00 32.38 H new ATOM 0 HB2 ASN F 54 18.623 19.336 17.144 1.00 35.51 H new ATOM 0 HB3 ASN F 54 19.232 20.741 17.439 1.00 35.51 H new ATOM 0 HD21 ASN F 54 16.737 22.344 15.459 1.00 37.29 H new ATOM 0 HD22 ASN F 54 18.220 22.239 15.370 1.00 37.29 H new ATOM 4530 N LYS F 55 21.703 18.775 15.149 1.00 30.61 N ATOM 4531 CA LYS F 55 23.037 18.292 15.502 1.00 31.05 C ATOM 4532 C LYS F 55 23.960 19.500 15.687 1.00 32.28 C ATOM 4533 O LYS F 55 24.837 19.494 16.544 1.00 29.62 O ATOM 4534 CB LYS F 55 23.576 17.361 14.412 1.00 28.14 C ATOM 4535 CG LYS F 55 25.015 16.897 14.630 1.00 27.83 C ATOM 4536 CD LYS F 55 25.198 16.064 15.898 1.00 25.14 C ATOM 4537 CE LYS F 55 26.679 15.754 16.120 1.00 27.84 C ATOM 4538 NZ LYS F 55 26.937 14.851 17.286 1.00 26.32 N ATOM 0 H LYS F 55 21.396 18.481 14.401 1.00 30.61 H new ATOM 0 HA LYS F 55 22.995 17.785 16.328 1.00 31.05 H new ATOM 0 HB2 LYS F 55 23.002 16.581 14.356 1.00 28.14 H new ATOM 0 HB3 LYS F 55 23.521 17.816 13.557 1.00 28.14 H new ATOM 0 HG2 LYS F 55 25.299 16.374 13.864 1.00 27.83 H new ATOM 0 HG3 LYS F 55 25.595 17.673 14.674 1.00 27.83 H new ATOM 0 HD2 LYS F 55 24.844 16.545 16.662 1.00 25.14 H new ATOM 0 HD3 LYS F 55 24.696 15.238 15.825 1.00 25.14 H new ATOM 0 HE2 LYS F 55 27.039 15.344 15.318 1.00 27.84 H new ATOM 0 HE3 LYS F 55 27.159 16.586 16.253 1.00 27.84 H new ATOM 0 HZ1 LYS F 55 27.795 14.902 17.517 1.00 26.32 H new ATOM 0 HZ2 LYS F 55 26.429 15.101 17.973 1.00 26.32 H new ATOM 0 HZ3 LYS F 55 26.740 14.013 17.062 1.00 26.32 H new ATOM 4539 N GLY F 56 23.751 20.527 14.865 1.00 34.35 N ATOM 4540 CA GLY F 56 24.521 21.758 14.967 1.00 34.08 C ATOM 4541 C GLY F 56 25.967 21.789 14.507 1.00 34.77 C ATOM 4542 O GLY F 56 26.711 22.691 14.885 1.00 36.05 O ATOM 0 H GLY F 56 23.163 20.527 14.238 1.00 34.35 H new ATOM 0 HA2 GLY F 56 24.044 22.439 14.466 1.00 34.08 H new ATOM 0 HA3 GLY F 56 24.509 22.030 15.898 1.00 34.08 H new ATOM 4543 N ILE F 57 26.387 20.824 13.702 1.00 32.96 N ATOM 4544 CA ILE F 57 27.762 20.828 13.234 1.00 32.80 C ATOM 4545 C ILE F 57 27.797 21.185 11.755 1.00 32.82 C ATOM 4546 O ILE F 57 26.763 21.207 11.085 1.00 30.68 O ATOM 4547 CB ILE F 57 28.440 19.457 13.486 1.00 32.74 C ATOM 4548 CG1 ILE F 57 27.773 18.356 12.657 1.00 32.16 C ATOM 4549 CG2 ILE F 57 28.338 19.106 14.960 1.00 31.56 C ATOM 4550 CD1 ILE F 57 28.315 18.226 11.250 1.00 32.01 C ATOM 0 H ILE F 57 25.903 20.171 13.420 1.00 32.96 H new ATOM 0 HA ILE F 57 28.259 21.495 13.732 1.00 32.80 H new ATOM 0 HB ILE F 57 29.371 19.522 13.222 1.00 32.74 H new ATOM 0 HG12 ILE F 57 27.883 17.508 13.115 1.00 32.16 H new ATOM 0 HG13 ILE F 57 26.820 18.532 12.611 1.00 32.16 H new ATOM 0 HG21 ILE F 57 28.762 18.248 15.119 1.00 31.56 H new ATOM 0 HG22 ILE F 57 28.783 19.788 15.487 1.00 31.56 H new ATOM 0 HG23 ILE F 57 27.404 19.057 15.217 1.00 31.56 H new ATOM 0 HD11 ILE F 57 27.848 17.513 10.788 1.00 32.01 H new ATOM 0 HD12 ILE F 57 28.183 19.061 10.774 1.00 32.01 H new ATOM 0 HD13 ILE F 57 29.262 18.021 11.286 1.00 32.01 H new ATOM 4551 N THR F 58 28.987 21.476 11.250 1.00 33.00 N ATOM 4552 CA THR F 58 29.139 21.836 9.850 1.00 33.73 C ATOM 4553 C THR F 58 29.786 20.706 9.071 1.00 32.35 C ATOM 4554 O THR F 58 30.827 20.185 9.462 1.00 33.89 O ATOM 4555 CB THR F 58 29.993 23.113 9.700 1.00 34.76 C ATOM 4556 OG1 THR F 58 29.335 24.198 10.361 1.00 35.53 O ATOM 4557 CG2 THR F 58 30.182 23.466 8.234 1.00 34.97 C ATOM 0 H THR F 58 29.719 21.471 11.701 1.00 33.00 H new ATOM 0 HA THR F 58 28.253 22.003 9.493 1.00 33.73 H new ATOM 0 HB THR F 58 30.863 22.953 10.097 1.00 34.76 H new ATOM 0 HG1 THR F 58 29.797 24.895 10.283 1.00 35.53 H new ATOM 0 HG21 THR F 58 30.720 24.270 8.161 1.00 34.97 H new ATOM 0 HG22 THR F 58 30.630 22.735 7.780 1.00 34.97 H new ATOM 0 HG23 THR F 58 29.316 23.619 7.824 1.00 34.97 H new ATOM 4558 N TRP F 59 29.157 20.329 7.966 1.00 31.85 N ATOM 4559 CA TRP F 59 29.672 19.261 7.129 1.00 32.01 C ATOM 4560 C TRP F 59 30.957 19.637 6.407 1.00 33.68 C ATOM 4561 O TRP F 59 31.027 20.649 5.711 1.00 34.09 O ATOM 4562 CB TRP F 59 28.610 18.833 6.114 1.00 30.91 C ATOM 4563 CG TRP F 59 27.448 18.111 6.747 1.00 30.47 C ATOM 4564 CD1 TRP F 59 26.120 18.363 6.551 1.00 29.36 C ATOM 4565 CD2 TRP F 59 27.516 16.987 7.639 1.00 28.06 C ATOM 4566 NE1 TRP F 59 25.356 17.462 7.258 1.00 30.82 N ATOM 4567 CE2 TRP F 59 26.187 16.606 7.934 1.00 29.00 C ATOM 4568 CE3 TRP F 59 28.572 16.263 8.213 1.00 28.97 C ATOM 4569 CZ2 TRP F 59 25.881 15.533 8.778 1.00 27.00 C ATOM 4570 CZ3 TRP F 59 28.270 15.191 9.058 1.00 26.66 C ATOM 4571 CH2 TRP F 59 26.932 14.838 9.330 1.00 27.94 C ATOM 0 H TRP F 59 28.426 20.683 7.683 1.00 31.85 H new ATOM 0 HA TRP F 59 29.887 18.522 7.719 1.00 32.01 H new ATOM 0 HB2 TRP F 59 28.282 19.617 5.647 1.00 30.91 H new ATOM 0 HB3 TRP F 59 29.019 18.257 5.449 1.00 30.91 H new ATOM 0 HD1 TRP F 59 25.781 19.045 6.017 1.00 29.36 H new ATOM 0 HE1 TRP F 59 24.496 17.440 7.273 1.00 30.82 H new ATOM 0 HE3 TRP F 59 29.456 16.492 8.035 1.00 28.97 H new ATOM 0 HZ2 TRP F 59 25.000 15.298 8.959 1.00 27.00 H new ATOM 0 HZ3 TRP F 59 28.961 14.704 9.446 1.00 26.66 H new ATOM 0 HH2 TRP F 59 26.756 14.120 9.895 1.00 27.94 H new ATOM 4572 N LYS F 60 31.969 18.799 6.584 1.00 34.70 N ATOM 4573 CA LYS F 60 33.274 18.988 5.963 1.00 37.82 C ATOM 4574 C LYS F 60 33.983 17.637 6.031 1.00 37.64 C ATOM 4575 O LYS F 60 33.423 16.674 6.559 1.00 37.51 O ATOM 4576 CB LYS F 60 34.074 20.056 6.721 1.00 40.05 C ATOM 4577 CG LYS F 60 34.251 19.751 8.203 1.00 43.59 C ATOM 4578 CD LYS F 60 34.974 20.869 8.945 1.00 47.08 C ATOM 4579 CE LYS F 60 34.981 20.588 10.449 1.00 49.09 C ATOM 4580 NZ LYS F 60 35.628 21.674 11.242 1.00 50.91 N ATOM 0 H LYS F 60 31.918 18.095 7.075 1.00 34.70 H new ATOM 0 HA LYS F 60 33.188 19.291 5.045 1.00 37.82 H new ATOM 0 HB2 LYS F 60 34.948 20.146 6.311 1.00 40.05 H new ATOM 0 HB3 LYS F 60 33.627 20.912 6.626 1.00 40.05 H new ATOM 0 HG2 LYS F 60 33.381 19.608 8.607 1.00 43.59 H new ATOM 0 HG3 LYS F 60 34.749 18.925 8.303 1.00 43.59 H new ATOM 0 HD2 LYS F 60 35.885 20.946 8.620 1.00 47.08 H new ATOM 0 HD3 LYS F 60 34.537 21.717 8.770 1.00 47.08 H new ATOM 0 HE2 LYS F 60 34.068 20.471 10.755 1.00 49.09 H new ATOM 0 HE3 LYS F 60 35.445 19.753 10.615 1.00 49.09 H new ATOM 0 HZ1 LYS F 60 35.607 21.464 12.107 1.00 50.91 H new ATOM 0 HZ2 LYS F 60 36.474 21.769 10.981 1.00 50.91 H new ATOM 0 HZ3 LYS F 60 35.190 22.438 11.112 1.00 50.91 H new ATOM 4581 N GLU F 61 35.203 17.567 5.504 1.00 37.05 N ATOM 4582 CA GLU F 61 35.973 16.324 5.516 1.00 36.09 C ATOM 4583 C GLU F 61 35.910 15.577 6.854 1.00 34.59 C ATOM 4584 O GLU F 61 35.457 14.438 6.917 1.00 31.87 O ATOM 4585 CB GLU F 61 37.446 16.597 5.187 1.00 37.96 C ATOM 4586 CG GLU F 61 37.751 16.900 3.729 1.00 42.05 C ATOM 4587 CD GLU F 61 37.067 18.154 3.233 1.00 44.63 C ATOM 4588 OE1 GLU F 61 37.125 19.189 3.931 1.00 45.55 O ATOM 4589 OE2 GLU F 61 36.473 18.105 2.138 1.00 49.91 O ATOM 0 H GLU F 61 35.605 18.231 5.133 1.00 37.05 H new ATOM 0 HA GLU F 61 35.564 15.761 4.840 1.00 36.09 H new ATOM 0 HB2 GLU F 61 37.747 17.345 5.726 1.00 37.96 H new ATOM 0 HB3 GLU F 61 37.969 15.825 5.456 1.00 37.96 H new ATOM 0 HG2 GLU F 61 38.710 16.994 3.617 1.00 42.05 H new ATOM 0 HG3 GLU F 61 37.474 16.148 3.182 1.00 42.05 H new ATOM 4590 N GLU F 62 36.368 16.224 7.920 1.00 34.86 N ATOM 4591 CA GLU F 62 36.400 15.595 9.238 1.00 35.19 C ATOM 4592 C GLU F 62 35.054 15.183 9.817 1.00 32.58 C ATOM 4593 O GLU F 62 34.913 14.070 10.311 1.00 31.66 O ATOM 4594 CB GLU F 62 37.132 16.492 10.243 1.00 36.84 C ATOM 4595 CG GLU F 62 37.099 17.968 9.927 1.00 42.98 C ATOM 4596 CD GLU F 62 37.982 18.332 8.742 1.00 47.09 C ATOM 4597 OE1 GLU F 62 39.190 17.998 8.778 1.00 49.97 O ATOM 4598 OE2 GLU F 62 37.470 18.952 7.782 1.00 44.93 O ATOM 0 H GLU F 62 36.666 17.031 7.902 1.00 34.86 H new ATOM 0 HA GLU F 62 36.878 14.764 9.089 1.00 35.19 H new ATOM 0 HB2 GLU F 62 36.743 16.355 11.121 1.00 36.84 H new ATOM 0 HB3 GLU F 62 38.058 16.207 10.295 1.00 36.84 H new ATOM 0 HG2 GLU F 62 36.185 18.235 9.739 1.00 42.98 H new ATOM 0 HG3 GLU F 62 37.387 18.469 10.706 1.00 42.98 H new ATOM 4599 N THR F 63 34.073 16.077 9.777 1.00 31.12 N ATOM 4600 CA THR F 63 32.756 15.761 10.318 1.00 28.82 C ATOM 4601 C THR F 63 32.112 14.613 9.548 1.00 28.25 C ATOM 4602 O THR F 63 31.491 13.733 10.150 1.00 25.00 O ATOM 4603 CB THR F 63 31.839 16.976 10.265 1.00 30.53 C ATOM 4604 OG1 THR F 63 31.868 17.524 8.944 1.00 33.53 O ATOM 4605 CG2 THR F 63 32.298 18.037 11.266 1.00 31.84 C ATOM 0 H THR F 63 34.147 16.866 9.444 1.00 31.12 H new ATOM 0 HA THR F 63 32.879 15.495 11.243 1.00 28.82 H new ATOM 0 HB THR F 63 30.937 16.703 10.494 1.00 30.53 H new ATOM 0 HG1 THR F 63 31.673 18.340 8.975 1.00 33.53 H new ATOM 0 HG21 THR F 63 31.705 18.803 11.220 1.00 31.84 H new ATOM 0 HG22 THR F 63 32.279 17.667 12.162 1.00 31.84 H new ATOM 0 HG23 THR F 63 33.202 18.315 11.051 1.00 31.84 H new ATOM 4606 N LEU F 64 32.263 14.626 8.223 1.00 25.60 N ATOM 4607 CA LEU F 64 31.711 13.574 7.366 1.00 24.93 C ATOM 4608 C LEU F 64 32.435 12.241 7.579 1.00 24.94 C ATOM 4609 O LEU F 64 31.817 11.177 7.529 1.00 23.54 O ATOM 4610 CB LEU F 64 31.801 13.980 5.888 1.00 23.07 C ATOM 4611 CG LEU F 64 30.812 15.065 5.445 1.00 23.56 C ATOM 4612 CD1 LEU F 64 31.061 15.463 3.995 1.00 23.03 C ATOM 4613 CD2 LEU F 64 29.393 14.533 5.613 1.00 21.84 C ATOM 0 H LEU F 64 32.686 15.242 7.797 1.00 25.60 H new ATOM 0 HA LEU F 64 30.779 13.459 7.611 1.00 24.93 H new ATOM 0 HB2 LEU F 64 32.702 14.291 5.708 1.00 23.07 H new ATOM 0 HB3 LEU F 64 31.659 13.191 5.342 1.00 23.07 H new ATOM 0 HG LEU F 64 30.934 15.855 5.994 1.00 23.56 H new ATOM 0 HD11 LEU F 64 30.427 16.149 3.734 1.00 23.03 H new ATOM 0 HD12 LEU F 64 31.964 15.806 3.904 1.00 23.03 H new ATOM 0 HD13 LEU F 64 30.951 14.687 3.423 1.00 23.03 H new ATOM 0 HD21 LEU F 64 28.758 15.212 5.336 1.00 21.84 H new ATOM 0 HD22 LEU F 64 29.278 13.740 5.066 1.00 21.84 H new ATOM 0 HD23 LEU F 64 29.239 14.309 6.544 1.00 21.84 H new ATOM 4614 N MET F 65 33.745 12.300 7.812 1.00 23.36 N ATOM 4615 CA MET F 65 34.530 11.092 8.054 1.00 25.96 C ATOM 4616 C MET F 65 34.013 10.342 9.280 1.00 24.62 C ATOM 4617 O MET F 65 33.959 9.113 9.286 1.00 25.02 O ATOM 4618 CB MET F 65 36.009 11.435 8.284 1.00 29.31 C ATOM 4619 CG MET F 65 36.812 11.699 7.021 1.00 32.13 C ATOM 4620 SD MET F 65 37.039 10.228 6.022 1.00 35.14 S ATOM 4621 CE MET F 65 38.408 9.446 6.879 1.00 36.37 C ATOM 0 H MET F 65 34.198 13.031 7.834 1.00 23.36 H new ATOM 0 HA MET F 65 34.443 10.532 7.267 1.00 25.96 H new ATOM 0 HB2 MET F 65 36.060 12.219 8.853 1.00 29.31 H new ATOM 0 HB3 MET F 65 36.425 10.705 8.768 1.00 29.31 H new ATOM 0 HG2 MET F 65 36.363 12.377 6.493 1.00 32.13 H new ATOM 0 HG3 MET F 65 37.680 12.057 7.264 1.00 32.13 H new ATOM 0 HE1 MET F 65 38.872 8.849 6.271 1.00 36.37 H new ATOM 0 HE2 MET F 65 39.023 10.126 7.195 1.00 36.37 H new ATOM 0 HE3 MET F 65 38.070 8.940 7.634 1.00 36.37 H new ATOM 4622 N GLU F 66 33.641 11.086 10.318 1.00 23.16 N ATOM 4623 CA GLU F 66 33.153 10.477 11.551 1.00 25.15 C ATOM 4624 C GLU F 66 31.708 10.018 11.413 1.00 24.52 C ATOM 4625 O GLU F 66 31.334 8.955 11.902 1.00 24.24 O ATOM 4626 CB GLU F 66 33.267 11.469 12.710 1.00 26.66 C ATOM 4627 CG GLU F 66 33.181 10.811 14.071 1.00 30.13 C ATOM 4628 CD GLU F 66 33.264 11.814 15.209 1.00 34.20 C ATOM 4629 OE1 GLU F 66 33.965 12.839 15.044 1.00 36.36 O ATOM 4630 OE2 GLU F 66 32.641 11.571 16.268 1.00 32.23 O ATOM 0 H GLU F 66 33.664 11.946 10.328 1.00 23.16 H new ATOM 0 HA GLU F 66 33.703 9.699 11.732 1.00 25.15 H new ATOM 0 HB2 GLU F 66 34.110 11.944 12.640 1.00 26.66 H new ATOM 0 HB3 GLU F 66 32.562 12.130 12.632 1.00 26.66 H new ATOM 0 HG2 GLU F 66 32.347 10.320 14.137 1.00 30.13 H new ATOM 0 HG3 GLU F 66 33.899 10.165 14.160 1.00 30.13 H new ATOM 4631 N TYR F 67 30.897 10.830 10.750 1.00 24.18 N ATOM 4632 CA TYR F 67 29.496 10.500 10.544 1.00 24.75 C ATOM 4633 C TYR F 67 29.358 9.237 9.699 1.00 23.76 C ATOM 4634 O TYR F 67 28.663 8.302 10.086 1.00 25.69 O ATOM 4635 CB TYR F 67 28.783 11.663 9.851 1.00 22.68 C ATOM 4636 CG TYR F 67 27.382 11.345 9.373 1.00 22.14 C ATOM 4637 CD1 TYR F 67 26.319 11.240 10.274 1.00 18.26 C ATOM 4638 CD2 TYR F 67 27.113 11.182 8.013 1.00 23.58 C ATOM 4639 CE1 TYR F 67 25.019 10.989 9.834 1.00 21.51 C ATOM 4640 CE2 TYR F 67 25.813 10.924 7.557 1.00 25.16 C ATOM 4641 CZ TYR F 67 24.773 10.833 8.470 1.00 24.69 C ATOM 4642 OH TYR F 67 23.488 10.602 8.018 1.00 26.50 O ATOM 0 H TYR F 67 31.140 11.581 10.410 1.00 24.18 H new ATOM 0 HA TYR F 67 29.089 10.341 11.410 1.00 24.75 H new ATOM 0 HB2 TYR F 67 28.741 12.413 10.464 1.00 22.68 H new ATOM 0 HB3 TYR F 67 29.315 11.947 9.091 1.00 22.68 H new ATOM 0 HD1 TYR F 67 26.481 11.339 11.184 1.00 18.26 H new ATOM 0 HD2 TYR F 67 27.808 11.246 7.399 1.00 23.58 H new ATOM 0 HE1 TYR F 67 24.321 10.926 10.446 1.00 21.51 H new ATOM 0 HE2 TYR F 67 25.649 10.815 6.648 1.00 25.16 H new ATOM 0 HH TYR F 67 23.348 11.059 7.327 1.00 26.50 H new ATOM 4643 N LEU F 68 30.027 9.210 8.555 1.00 23.18 N ATOM 4644 CA LEU F 68 29.946 8.062 7.661 1.00 23.41 C ATOM 4645 C LEU F 68 30.484 6.774 8.277 1.00 22.52 C ATOM 4646 O LEU F 68 30.133 5.676 7.847 1.00 20.78 O ATOM 4647 CB LEU F 68 30.666 8.369 6.345 1.00 26.23 C ATOM 4648 CG LEU F 68 30.015 9.483 5.511 1.00 26.73 C ATOM 4649 CD1 LEU F 68 30.813 9.712 4.249 1.00 27.23 C ATOM 4650 CD2 LEU F 68 28.590 9.105 5.162 1.00 27.46 C ATOM 0 H LEU F 68 30.534 9.846 8.277 1.00 23.18 H new ATOM 0 HA LEU F 68 29.003 7.907 7.492 1.00 23.41 H new ATOM 0 HB2 LEU F 68 31.582 8.620 6.541 1.00 26.23 H new ATOM 0 HB3 LEU F 68 30.702 7.559 5.812 1.00 26.23 H new ATOM 0 HG LEU F 68 30.004 10.302 6.031 1.00 26.73 H new ATOM 0 HD11 LEU F 68 30.398 10.416 3.727 1.00 27.23 H new ATOM 0 HD12 LEU F 68 31.718 9.973 4.481 1.00 27.23 H new ATOM 0 HD13 LEU F 68 30.836 8.894 3.728 1.00 27.23 H new ATOM 0 HD21 LEU F 68 28.187 9.813 4.636 1.00 27.46 H new ATOM 0 HD22 LEU F 68 28.590 8.282 4.649 1.00 27.46 H new ATOM 0 HD23 LEU F 68 28.080 8.978 5.977 1.00 27.46 H new ATOM 4651 N GLU F 69 31.328 6.891 9.295 1.00 21.77 N ATOM 4652 CA GLU F 69 31.842 5.683 9.917 1.00 24.24 C ATOM 4653 C GLU F 69 30.714 4.982 10.676 1.00 23.26 C ATOM 4654 O GLU F 69 30.638 3.758 10.702 1.00 21.35 O ATOM 4655 CB GLU F 69 32.986 6.003 10.876 1.00 27.25 C ATOM 4656 CG GLU F 69 33.684 4.754 11.370 1.00 35.68 C ATOM 4657 CD GLU F 69 34.840 5.048 12.302 1.00 37.45 C ATOM 4658 OE1 GLU F 69 35.662 4.134 12.504 1.00 40.86 O ATOM 4659 OE2 GLU F 69 34.926 6.177 12.835 1.00 38.40 O ATOM 0 H GLU F 69 31.607 7.633 9.630 1.00 21.77 H new ATOM 0 HA GLU F 69 32.184 5.100 9.221 1.00 24.24 H new ATOM 0 HB2 GLU F 69 33.629 6.576 10.430 1.00 27.25 H new ATOM 0 HB3 GLU F 69 32.641 6.500 11.634 1.00 27.25 H new ATOM 0 HG2 GLU F 69 33.041 4.191 11.829 1.00 35.68 H new ATOM 0 HG3 GLU F 69 34.010 4.250 10.608 1.00 35.68 H new ATOM 4660 N ASN F 70 29.832 5.772 11.275 1.00 23.16 N ATOM 4661 CA ASN F 70 28.709 5.247 12.042 1.00 24.17 C ATOM 4662 C ASN F 70 27.724 6.400 12.235 1.00 24.12 C ATOM 4663 O ASN F 70 27.835 7.181 13.189 1.00 24.51 O ATOM 4664 CB ASN F 70 29.201 4.740 13.402 1.00 24.76 C ATOM 4665 CG ASN F 70 28.125 3.994 14.175 1.00 27.10 C ATOM 4666 OD1 ASN F 70 26.937 4.136 13.900 1.00 27.64 O ATOM 4667 ND2 ASN F 70 28.545 3.200 15.159 1.00 26.59 N ATOM 0 H ASN F 70 29.868 6.631 11.248 1.00 23.16 H new ATOM 0 HA ASN F 70 28.286 4.506 11.581 1.00 24.17 H new ATOM 0 HB2 ASN F 70 29.963 4.154 13.268 1.00 24.76 H new ATOM 0 HB3 ASN F 70 29.511 5.492 13.930 1.00 24.76 H new ATOM 0 HD21 ASN F 70 27.975 2.762 15.631 1.00 26.59 H new ATOM 0 HD22 ASN F 70 29.386 3.126 15.322 1.00 26.59 H new ATOM 4668 N PRO F 71 26.754 6.530 11.316 1.00 23.23 N ATOM 4669 CA PRO F 71 25.723 7.574 11.325 1.00 23.98 C ATOM 4670 C PRO F 71 24.963 7.752 12.638 1.00 24.91 C ATOM 4671 O PRO F 71 24.881 8.861 13.176 1.00 24.55 O ATOM 4672 CB PRO F 71 24.792 7.149 10.185 1.00 25.73 C ATOM 4673 CG PRO F 71 25.730 6.507 9.222 1.00 25.43 C ATOM 4674 CD PRO F 71 26.617 5.671 10.125 1.00 23.51 C ATOM 0 HA PRO F 71 26.127 8.449 11.215 1.00 23.98 H new ATOM 0 HB2 PRO F 71 24.108 6.532 10.489 1.00 25.73 H new ATOM 0 HB3 PRO F 71 24.334 7.908 9.791 1.00 25.73 H new ATOM 0 HG2 PRO F 71 25.261 5.961 8.572 1.00 25.43 H new ATOM 0 HG3 PRO F 71 26.241 7.164 8.724 1.00 25.43 H new ATOM 0 HD2 PRO F 71 26.211 4.817 10.340 1.00 23.51 H new ATOM 0 HD3 PRO F 71 27.475 5.482 9.715 1.00 23.51 H new ATOM 4675 N LYS F 72 24.402 6.660 13.146 1.00 22.76 N ATOM 4676 CA LYS F 72 23.630 6.717 14.374 1.00 23.53 C ATOM 4677 C LYS F 72 24.437 7.021 15.641 1.00 24.18 C ATOM 4678 O LYS F 72 23.881 7.480 16.642 1.00 24.23 O ATOM 4679 CB LYS F 72 22.815 5.429 14.518 0.50 22.13 C ATOM 4680 CG LYS F 72 21.784 5.303 13.401 0.50 22.24 C ATOM 4681 CD LYS F 72 20.808 4.160 13.588 0.50 23.42 C ATOM 4682 CE LYS F 72 19.725 4.235 12.523 0.50 19.67 C ATOM 4683 NZ LYS F 72 18.681 3.198 12.684 0.50 23.29 N ATOM 0 H LYS F 72 24.458 5.878 12.793 1.00 22.76 H new ATOM 0 HA LYS F 72 23.040 7.482 14.290 1.00 23.53 H new ATOM 0 HB2 LYS F 72 23.410 4.663 14.501 0.50 22.13 H new ATOM 0 HB3 LYS F 72 22.367 5.421 15.378 0.50 22.13 H new ATOM 0 HG2 LYS F 72 21.287 6.133 13.338 0.50 22.24 H new ATOM 0 HG3 LYS F 72 22.248 5.185 12.557 0.50 22.24 H new ATOM 0 HD2 LYS F 72 21.274 3.311 13.529 0.50 23.42 H new ATOM 0 HD3 LYS F 72 20.410 4.204 14.471 0.50 23.42 H new ATOM 0 HE2 LYS F 72 19.310 5.111 12.552 0.50 19.67 H new ATOM 0 HE3 LYS F 72 20.133 4.143 11.648 0.50 19.67 H new ATOM 0 HZ1 LYS F 72 18.044 3.321 12.075 0.50 23.29 H new ATOM 0 HZ2 LYS F 72 19.043 2.392 12.576 0.50 23.29 H new ATOM 0 HZ3 LYS F 72 18.327 3.257 13.498 0.50 23.29 H new ATOM 4684 N LYS F 73 25.745 6.790 15.599 1.00 22.88 N ATOM 4685 CA LYS F 73 26.576 7.091 16.758 1.00 22.87 C ATOM 4686 C LYS F 73 26.845 8.587 16.766 1.00 23.45 C ATOM 4687 O LYS F 73 26.820 9.226 17.823 1.00 23.49 O ATOM 4688 CB LYS F 73 27.911 6.338 16.691 0.50 21.02 C ATOM 4689 CG LYS F 73 28.852 6.679 17.838 0.50 17.69 C ATOM 4690 CD LYS F 73 30.205 5.996 17.703 0.50 18.42 C ATOM 4691 CE LYS F 73 31.106 6.348 18.886 0.50 19.59 C ATOM 4692 NZ LYS F 73 32.409 5.622 18.845 0.50 19.99 N ATOM 0 H LYS F 73 26.165 6.465 14.922 1.00 22.88 H new ATOM 0 HA LYS F 73 26.114 6.813 17.565 1.00 22.87 H new ATOM 0 HB2 LYS F 73 27.738 5.384 16.696 0.50 21.02 H new ATOM 0 HB3 LYS F 73 28.349 6.542 15.850 0.50 21.02 H new ATOM 0 HG2 LYS F 73 28.980 7.640 17.873 0.50 17.69 H new ATOM 0 HG3 LYS F 73 28.443 6.417 18.677 0.50 17.69 H new ATOM 0 HD2 LYS F 73 30.084 5.035 17.657 0.50 18.42 H new ATOM 0 HD3 LYS F 73 30.629 6.269 16.874 0.50 18.42 H new ATOM 0 HE2 LYS F 73 31.271 7.304 18.890 0.50 19.59 H new ATOM 0 HE3 LYS F 73 30.646 6.136 19.714 0.50 19.59 H new ATOM 0 HZ1 LYS F 73 32.901 5.855 19.549 0.50 19.99 H new ATOM 0 HZ2 LYS F 73 32.261 4.745 18.864 0.50 19.99 H new ATOM 0 HZ3 LYS F 73 32.843 5.833 18.097 0.50 19.99 H new ATOM 4693 N TYR F 74 27.094 9.144 15.579 1.00 23.47 N ATOM 4694 CA TYR F 74 27.384 10.571 15.446 1.00 23.16 C ATOM 4695 C TYR F 74 26.153 11.410 15.735 1.00 23.13 C ATOM 4696 O TYR F 74 26.239 12.456 16.384 1.00 25.20 O ATOM 4697 CB TYR F 74 27.879 10.898 14.037 1.00 24.21 C ATOM 4698 CG TYR F 74 28.481 12.281 13.912 1.00 26.95 C ATOM 4699 CD1 TYR F 74 29.669 12.601 14.571 1.00 27.35 C ATOM 4700 CD2 TYR F 74 27.890 13.256 13.105 1.00 27.22 C ATOM 4701 CE1 TYR F 74 30.259 13.851 14.431 1.00 26.72 C ATOM 4702 CE2 TYR F 74 28.475 14.513 12.951 1.00 26.46 C ATOM 4703 CZ TYR F 74 29.664 14.799 13.619 1.00 28.04 C ATOM 4704 OH TYR F 74 30.271 16.018 13.463 1.00 25.29 O ATOM 0 H TYR F 74 27.099 8.710 14.837 1.00 23.47 H new ATOM 0 HA TYR F 74 28.076 10.782 16.092 1.00 23.16 H new ATOM 0 HB2 TYR F 74 28.542 10.240 13.774 1.00 24.21 H new ATOM 0 HB3 TYR F 74 27.138 10.818 13.416 1.00 24.21 H new ATOM 0 HD1 TYR F 74 30.074 11.965 15.115 1.00 27.35 H new ATOM 0 HD2 TYR F 74 27.094 13.064 12.664 1.00 27.22 H new ATOM 0 HE1 TYR F 74 31.049 14.049 14.880 1.00 26.72 H new ATOM 0 HE2 TYR F 74 28.075 15.154 12.408 1.00 26.46 H new ATOM 0 HH TYR F 74 29.935 16.416 12.804 1.00 25.29 H new ATOM 4705 N ILE F 75 25.009 10.940 15.257 1.00 20.99 N ATOM 4706 CA ILE F 75 23.753 11.648 15.443 1.00 21.07 C ATOM 4707 C ILE F 75 22.694 10.695 15.973 1.00 21.70 C ATOM 4708 O ILE F 75 21.848 10.200 15.219 1.00 20.09 O ATOM 4709 CB ILE F 75 23.248 12.258 14.109 1.00 21.78 C ATOM 4710 CG1 ILE F 75 24.370 13.053 13.445 1.00 20.81 C ATOM 4711 CG2 ILE F 75 22.039 13.160 14.371 1.00 20.38 C ATOM 4712 CD1 ILE F 75 23.914 13.878 12.230 1.00 25.45 C ATOM 0 H ILE F 75 24.939 10.204 14.817 1.00 20.99 H new ATOM 0 HA ILE F 75 23.910 12.364 16.078 1.00 21.07 H new ATOM 0 HB ILE F 75 22.978 11.542 13.513 1.00 21.78 H new ATOM 0 HG12 ILE F 75 24.764 13.650 14.101 1.00 20.81 H new ATOM 0 HG13 ILE F 75 25.067 12.440 13.165 1.00 20.81 H new ATOM 0 HG21 ILE F 75 21.729 13.538 13.533 1.00 20.38 H new ATOM 0 HG22 ILE F 75 21.327 12.638 14.773 1.00 20.38 H new ATOM 0 HG23 ILE F 75 22.294 13.876 14.973 1.00 20.38 H new ATOM 0 HD11 ILE F 75 24.673 14.355 11.859 1.00 25.45 H new ATOM 0 HD12 ILE F 75 23.545 13.286 11.557 1.00 25.45 H new ATOM 0 HD13 ILE F 75 23.236 14.514 12.507 1.00 25.45 H new ATOM 4713 N PRO F 76 22.736 10.404 17.285 1.00 21.54 N ATOM 4714 CA PRO F 76 21.750 9.499 17.874 1.00 21.81 C ATOM 4715 C PRO F 76 20.341 9.947 17.497 1.00 22.89 C ATOM 4716 O PRO F 76 20.042 11.141 17.510 1.00 23.05 O ATOM 4717 CB PRO F 76 22.022 9.629 19.369 1.00 21.07 C ATOM 4718 CG PRO F 76 23.501 9.843 19.410 1.00 23.22 C ATOM 4719 CD PRO F 76 23.729 10.833 18.284 1.00 21.52 C ATOM 0 HA PRO F 76 21.815 8.580 17.570 1.00 21.81 H new ATOM 0 HB2 PRO F 76 21.538 10.373 19.761 1.00 21.07 H new ATOM 0 HB3 PRO F 76 21.759 8.832 19.855 1.00 21.07 H new ATOM 0 HG2 PRO F 76 23.790 10.198 20.265 1.00 23.22 H new ATOM 0 HG3 PRO F 76 23.988 9.017 19.267 1.00 23.22 H new ATOM 0 HD2 PRO F 76 23.582 11.748 18.571 1.00 21.52 H new ATOM 0 HD3 PRO F 76 24.634 10.786 17.938 1.00 21.52 H new ATOM 4720 N GLY F 77 19.488 8.992 17.143 1.00 22.13 N ATOM 4721 CA GLY F 77 18.127 9.326 16.774 1.00 23.72 C ATOM 4722 C GLY F 77 17.874 9.568 15.291 1.00 24.61 C ATOM 4723 O GLY F 77 16.721 9.691 14.872 1.00 23.80 O ATOM 0 H GLY F 77 19.678 8.154 17.111 1.00 22.13 H new ATOM 0 HA2 GLY F 77 17.546 8.608 17.070 1.00 23.72 H new ATOM 0 HA3 GLY F 77 17.865 10.122 17.262 1.00 23.72 H new ATOM 4724 N THR F 78 18.928 9.660 14.489 1.00 24.02 N ATOM 4725 CA THR F 78 18.726 9.880 13.060 1.00 25.35 C ATOM 4726 C THR F 78 18.067 8.621 12.471 1.00 26.85 C ATOM 4727 O THR F 78 18.335 7.509 12.931 1.00 26.92 O ATOM 4728 CB THR F 78 20.071 10.174 12.343 1.00 25.55 C ATOM 4729 OG1 THR F 78 19.839 10.387 10.943 1.00 26.98 O ATOM 4730 CG2 THR F 78 21.041 9.019 12.520 1.00 25.38 C ATOM 0 H THR F 78 19.748 9.600 14.741 1.00 24.02 H new ATOM 0 HA THR F 78 18.155 10.653 12.927 1.00 25.35 H new ATOM 0 HB THR F 78 20.458 10.971 12.738 1.00 25.55 H new ATOM 0 HG1 THR F 78 19.435 11.115 10.833 1.00 26.98 H new ATOM 0 HG21 THR F 78 21.873 9.223 12.065 1.00 25.38 H new ATOM 0 HG22 THR F 78 21.214 8.883 13.465 1.00 25.38 H new ATOM 0 HG23 THR F 78 20.656 8.212 12.143 1.00 25.38 H new ATOM 4731 N LYS F 79 17.200 8.797 11.473 1.00 24.78 N ATOM 4732 CA LYS F 79 16.509 7.672 10.847 1.00 26.06 C ATOM 4733 C LYS F 79 16.784 7.607 9.347 1.00 25.10 C ATOM 4734 O LYS F 79 16.679 8.613 8.649 1.00 25.82 O ATOM 4735 CB LYS F 79 14.995 7.782 11.070 1.00 26.62 C ATOM 4736 CG LYS F 79 14.570 7.806 12.526 1.00 28.87 C ATOM 4737 CD LYS F 79 14.945 6.516 13.242 1.00 30.76 C ATOM 4738 CE LYS F 79 14.562 6.585 14.720 1.00 31.55 C ATOM 4739 NZ LYS F 79 14.879 5.320 15.459 1.00 36.50 N ATOM 0 H LYS F 79 16.998 9.565 11.143 1.00 24.78 H new ATOM 0 HA LYS F 79 16.847 6.863 11.261 1.00 26.06 H new ATOM 0 HB2 LYS F 79 14.675 8.590 10.639 1.00 26.62 H new ATOM 0 HB3 LYS F 79 14.560 7.034 10.631 1.00 26.62 H new ATOM 0 HG2 LYS F 79 14.988 8.558 12.973 1.00 28.87 H new ATOM 0 HG3 LYS F 79 13.611 7.940 12.581 1.00 28.87 H new ATOM 0 HD2 LYS F 79 14.496 5.766 12.822 1.00 30.76 H new ATOM 0 HD3 LYS F 79 15.899 6.360 13.158 1.00 30.76 H new ATOM 0 HE2 LYS F 79 15.030 7.325 15.137 1.00 31.55 H new ATOM 0 HE3 LYS F 79 13.613 6.771 14.796 1.00 31.55 H new ATOM 0 HZ1 LYS F 79 14.640 5.406 16.312 1.00 36.50 H new ATOM 0 HZ2 LYS F 79 14.433 4.642 15.093 1.00 36.50 H new ATOM 0 HZ3 LYS F 79 15.753 5.159 15.411 1.00 36.50 H new ATOM 4740 N MET F 80 17.114 6.417 8.860 1.00 25.63 N ATOM 4741 CA MET F 80 17.411 6.208 7.448 1.00 28.60 C ATOM 4742 C MET F 80 16.178 5.883 6.612 1.00 29.30 C ATOM 4743 O MET F 80 16.148 6.170 5.419 1.00 29.75 O ATOM 4744 CB MET F 80 18.424 5.077 7.283 1.00 30.55 C ATOM 4745 CG MET F 80 19.709 5.489 6.593 1.00 37.02 C ATOM 4746 SD MET F 80 20.907 6.231 7.707 1.00 39.34 S ATOM 4747 CE MET F 80 20.105 7.788 8.120 1.00 39.90 C ATOM 0 H MET F 80 17.172 5.706 9.340 1.00 25.63 H new ATOM 0 HA MET F 80 17.773 7.048 7.124 1.00 28.60 H new ATOM 0 HB2 MET F 80 18.639 4.719 8.158 1.00 30.55 H new ATOM 0 HB3 MET F 80 18.013 4.359 6.776 1.00 30.55 H new ATOM 0 HG2 MET F 80 20.107 4.711 6.172 1.00 37.02 H new ATOM 0 HG3 MET F 80 19.501 6.119 5.885 1.00 37.02 H new ATOM 0 HE1 MET F 80 20.776 8.439 8.379 1.00 39.90 H new ATOM 0 HE2 MET F 80 19.618 8.116 7.348 1.00 39.90 H new ATOM 0 HE3 MET F 80 19.488 7.649 8.856 1.00 39.90 H new ATOM 4748 N ILE F 81 15.170 5.270 7.226 1.00 28.27 N ATOM 4749 CA ILE F 81 13.948 4.915 6.503 1.00 27.84 C ATOM 4750 C ILE F 81 12.708 5.538 7.138 1.00 27.35 C ATOM 4751 O ILE F 81 12.757 6.040 8.259 1.00 25.92 O ATOM 4752 CB ILE F 81 13.749 3.386 6.445 1.00 31.62 C ATOM 4753 CG1 ILE F 81 13.743 2.816 7.865 1.00 28.75 C ATOM 4754 CG2 ILE F 81 14.840 2.742 5.573 1.00 29.09 C ATOM 4755 CD1 ILE F 81 13.451 1.334 7.926 1.00 36.85 C ATOM 0 H ILE F 81 15.172 5.051 8.058 1.00 28.27 H new ATOM 0 HA ILE F 81 14.058 5.265 5.605 1.00 27.84 H new ATOM 0 HB ILE F 81 12.893 3.181 6.036 1.00 31.62 H new ATOM 0 HG12 ILE F 81 14.605 2.984 8.276 1.00 28.75 H new ATOM 0 HG13 ILE F 81 13.080 3.290 8.392 1.00 28.75 H new ATOM 0 HG21 ILE F 81 14.706 1.782 5.543 1.00 29.09 H new ATOM 0 HG22 ILE F 81 14.791 3.103 4.674 1.00 29.09 H new ATOM 0 HG23 ILE F 81 15.712 2.935 5.951 1.00 29.09 H new ATOM 0 HD11 ILE F 81 13.462 1.040 8.850 1.00 36.85 H new ATOM 0 HD12 ILE F 81 12.577 1.160 7.542 1.00 36.85 H new ATOM 0 HD13 ILE F 81 14.126 0.850 7.425 1.00 36.85 H new ATOM 4756 N PHE F 82 11.596 5.497 6.415 1.00 25.86 N ATOM 4757 CA PHE F 82 10.351 6.079 6.897 1.00 24.97 C ATOM 4758 C PHE F 82 10.087 5.885 8.392 1.00 25.57 C ATOM 4759 O PHE F 82 9.978 4.755 8.879 1.00 23.54 O ATOM 4760 CB PHE F 82 9.164 5.526 6.118 1.00 26.63 C ATOM 4761 CG PHE F 82 7.871 6.188 6.479 1.00 29.90 C ATOM 4762 CD1 PHE F 82 7.733 7.572 6.359 1.00 28.30 C ATOM 4763 CD2 PHE F 82 6.807 5.448 6.978 1.00 28.74 C ATOM 4764 CE1 PHE F 82 6.553 8.210 6.734 1.00 27.64 C ATOM 4765 CE2 PHE F 82 5.625 6.079 7.355 1.00 28.06 C ATOM 4766 CZ PHE F 82 5.503 7.463 7.231 1.00 27.15 C ATOM 0 H PHE F 82 11.541 5.134 5.637 1.00 25.86 H new ATOM 0 HA PHE F 82 10.455 7.033 6.753 1.00 24.97 H new ATOM 0 HB2 PHE F 82 9.326 5.639 5.168 1.00 26.63 H new ATOM 0 HB3 PHE F 82 9.091 4.573 6.282 1.00 26.63 H new ATOM 0 HD1 PHE F 82 8.439 8.075 6.024 1.00 28.30 H new ATOM 0 HD2 PHE F 82 6.885 4.525 7.061 1.00 28.74 H new ATOM 0 HE1 PHE F 82 6.473 9.133 6.650 1.00 27.64 H new ATOM 0 HE2 PHE F 82 4.917 5.578 7.690 1.00 28.06 H new ATOM 0 HZ PHE F 82 4.713 7.884 7.484 1.00 27.15 H new ATOM 4767 N ALA F 83 9.972 6.999 9.109 1.00 25.07 N ATOM 4768 CA ALA F 83 9.718 6.965 10.546 1.00 26.88 C ATOM 4769 C ALA F 83 8.504 7.806 10.913 1.00 26.25 C ATOM 4770 O ALA F 83 8.236 8.029 12.087 1.00 26.94 O ATOM 4771 CB ALA F 83 10.941 7.457 11.306 1.00 26.05 C ATOM 0 H ALA F 83 10.038 7.790 8.779 1.00 25.07 H new ATOM 0 HA ALA F 83 9.534 6.046 10.795 1.00 26.88 H new ATOM 0 HB1 ALA F 83 10.762 7.431 12.259 1.00 26.05 H new ATOM 0 HB2 ALA F 83 11.699 6.887 11.104 1.00 26.05 H new ATOM 0 HB3 ALA F 83 11.142 8.368 11.040 1.00 26.05 H new ATOM 4772 N GLY F 84 7.776 8.276 9.904 1.00 27.27 N ATOM 4773 CA GLY F 84 6.590 9.077 10.163 1.00 29.22 C ATOM 4774 C GLY F 84 6.582 10.433 9.478 1.00 30.70 C ATOM 4775 O GLY F 84 7.596 10.873 8.943 1.00 30.98 O ATOM 0 H GLY F 84 7.951 8.143 9.072 1.00 27.27 H new ATOM 0 HA2 GLY F 84 5.808 8.579 9.877 1.00 29.22 H new ATOM 0 HA3 GLY F 84 6.507 9.211 11.120 1.00 29.22 H new ATOM 4776 N ILE F 85 5.428 11.093 9.494 1.00 31.58 N ATOM 4777 CA ILE F 85 5.274 12.415 8.888 1.00 31.94 C ATOM 4778 C ILE F 85 4.811 13.386 9.968 1.00 32.29 C ATOM 4779 O ILE F 85 3.716 13.260 10.506 1.00 32.04 O ATOM 4780 CB ILE F 85 4.252 12.383 7.725 1.00 30.27 C ATOM 4781 CG1 ILE F 85 4.804 11.515 6.592 1.00 31.73 C ATOM 4782 CG2 ILE F 85 3.970 13.799 7.226 1.00 29.17 C ATOM 4783 CD1 ILE F 85 3.848 11.302 5.431 1.00 32.93 C ATOM 0 H ILE F 85 4.710 10.788 9.857 1.00 31.58 H new ATOM 0 HA ILE F 85 6.125 12.700 8.519 1.00 31.94 H new ATOM 0 HB ILE F 85 3.417 12.003 8.041 1.00 30.27 H new ATOM 0 HG12 ILE F 85 5.617 11.923 6.255 1.00 31.73 H new ATOM 0 HG13 ILE F 85 5.051 10.650 6.955 1.00 31.73 H new ATOM 0 HG21 ILE F 85 3.329 13.764 6.499 1.00 29.17 H new ATOM 0 HG22 ILE F 85 3.607 14.332 7.951 1.00 29.17 H new ATOM 0 HG23 ILE F 85 4.794 14.202 6.911 1.00 29.17 H new ATOM 0 HD11 ILE F 85 4.272 10.745 4.760 1.00 32.93 H new ATOM 0 HD12 ILE F 85 3.043 10.866 5.751 1.00 32.93 H new ATOM 0 HD13 ILE F 85 3.618 12.159 5.040 1.00 32.93 H new ATOM 4784 N LYS F 86 5.667 14.348 10.287 1.00 34.16 N ATOM 4785 CA LYS F 86 5.383 15.335 11.323 1.00 35.22 C ATOM 4786 C LYS F 86 4.185 16.240 11.023 1.00 35.72 C ATOM 4787 O LYS F 86 3.216 16.274 11.784 1.00 36.92 O ATOM 4788 CB LYS F 86 6.630 16.194 11.558 0.50 35.03 C ATOM 4789 CG LYS F 86 6.473 17.290 12.602 0.50 35.95 C ATOM 4790 CD LYS F 86 7.740 18.130 12.696 0.50 35.26 C ATOM 4791 CE LYS F 86 7.592 19.265 13.697 0.50 35.72 C ATOM 4792 NZ LYS F 86 7.346 18.764 15.075 0.50 34.29 N ATOM 0 H LYS F 86 6.432 14.448 9.908 1.00 34.16 H new ATOM 0 HA LYS F 86 5.144 14.833 12.118 1.00 35.22 H new ATOM 0 HB2 LYS F 86 7.359 15.614 11.826 0.50 35.03 H new ATOM 0 HB3 LYS F 86 6.887 16.603 10.717 0.50 35.03 H new ATOM 0 HG2 LYS F 86 5.720 17.857 12.372 0.50 35.95 H new ATOM 0 HG3 LYS F 86 6.277 16.895 13.466 0.50 35.95 H new ATOM 0 HD2 LYS F 86 8.484 17.565 12.956 0.50 35.26 H new ATOM 0 HD3 LYS F 86 7.952 18.495 11.822 0.50 35.26 H new ATOM 0 HE2 LYS F 86 8.396 19.808 13.690 0.50 35.72 H new ATOM 0 HE3 LYS F 86 6.859 19.840 13.427 0.50 35.72 H new ATOM 0 HZ1 LYS F 86 7.423 19.436 15.654 0.50 34.29 H new ATOM 0 HZ2 LYS F 86 6.526 18.423 15.125 0.50 34.29 H new ATOM 0 HZ3 LYS F 86 7.942 18.133 15.272 0.50 34.29 H new ATOM 4793 N LYS F 87 4.256 16.965 9.912 1.00 36.01 N ATOM 4794 CA LYS F 87 3.199 17.900 9.526 1.00 36.25 C ATOM 4795 C LYS F 87 1.795 17.306 9.435 1.00 34.58 C ATOM 4796 O LYS F 87 1.537 16.383 8.658 1.00 35.97 O ATOM 4797 CB LYS F 87 3.552 18.571 8.195 0.50 36.04 C ATOM 4798 CG LYS F 87 2.545 19.622 7.752 0.50 36.36 C ATOM 4799 CD LYS F 87 2.498 20.793 8.717 0.50 36.89 C ATOM 4800 CE LYS F 87 3.727 21.670 8.582 0.50 36.59 C ATOM 4801 NZ LYS F 87 3.807 22.246 7.214 0.50 35.13 N ATOM 0 H LYS F 87 4.915 16.931 9.361 1.00 36.01 H new ATOM 0 HA LYS F 87 3.162 18.543 10.251 1.00 36.25 H new ATOM 0 HB2 LYS F 87 4.426 18.985 8.273 0.50 36.04 H new ATOM 0 HB3 LYS F 87 3.620 17.890 7.507 0.50 36.04 H new ATOM 0 HG2 LYS F 87 2.778 19.941 6.866 0.50 36.36 H new ATOM 0 HG3 LYS F 87 1.665 19.220 7.687 0.50 36.36 H new ATOM 0 HD2 LYS F 87 1.702 21.321 8.549 0.50 36.89 H new ATOM 0 HD3 LYS F 87 2.433 20.462 9.627 0.50 36.89 H new ATOM 0 HE2 LYS F 87 3.695 22.384 9.238 0.50 36.59 H new ATOM 0 HE3 LYS F 87 4.524 21.150 8.767 0.50 36.59 H new ATOM 0 HZ1 LYS F 87 4.337 22.961 7.223 0.50 35.13 H new ATOM 0 HZ2 LYS F 87 4.139 21.638 6.655 0.50 35.13 H new ATOM 0 HZ3 LYS F 87 2.993 22.484 6.944 0.50 35.13 H new ATOM 4802 N LYS F 88 0.885 17.863 10.224 1.00 33.28 N ATOM 4803 CA LYS F 88 -0.501 17.411 10.248 1.00 33.57 C ATOM 4804 C LYS F 88 -1.176 17.559 8.878 1.00 31.33 C ATOM 4805 O LYS F 88 -1.907 16.671 8.439 1.00 29.17 O ATOM 4806 CB LYS F 88 -1.274 18.202 11.304 1.00 37.28 C ATOM 4807 CG LYS F 88 -2.699 17.731 11.540 1.00 40.72 C ATOM 4808 CD LYS F 88 -3.376 18.583 12.610 1.00 42.57 C ATOM 4809 CE LYS F 88 -4.821 18.160 12.846 1.00 43.63 C ATOM 4810 NZ LYS F 88 -4.919 16.805 13.453 1.00 45.25 N ATOM 0 H LYS F 88 1.053 18.514 10.761 1.00 33.28 H new ATOM 0 HA LYS F 88 -0.506 16.467 10.472 1.00 33.57 H new ATOM 0 HB2 LYS F 88 -0.789 18.156 12.143 1.00 37.28 H new ATOM 0 HB3 LYS F 88 -1.295 19.135 11.039 1.00 37.28 H new ATOM 0 HG2 LYS F 88 -3.203 17.781 10.713 1.00 40.72 H new ATOM 0 HG3 LYS F 88 -2.696 16.801 11.814 1.00 40.72 H new ATOM 0 HD2 LYS F 88 -2.879 18.513 13.440 1.00 42.57 H new ATOM 0 HD3 LYS F 88 -3.352 19.515 12.343 1.00 42.57 H new ATOM 0 HE2 LYS F 88 -5.254 18.805 13.427 1.00 43.63 H new ATOM 0 HE3 LYS F 88 -5.301 18.170 12.003 1.00 43.63 H new ATOM 0 HZ1 LYS F 88 -5.772 16.619 13.628 1.00 45.25 H new ATOM 0 HZ2 LYS F 88 -4.594 16.201 12.886 1.00 45.25 H new ATOM 0 HZ3 LYS F 88 -4.450 16.783 14.209 1.00 45.25 H new ATOM 4811 N THR F 89 -0.920 18.673 8.199 1.00 29.85 N ATOM 4812 CA THR F 89 -1.521 18.916 6.891 1.00 32.04 C ATOM 4813 C THR F 89 -1.028 17.929 5.835 1.00 32.14 C ATOM 4814 O THR F 89 -1.796 17.492 4.979 1.00 33.87 O ATOM 4815 CB THR F 89 -1.251 20.360 6.414 1.00 32.75 C ATOM 4816 OG1 THR F 89 -1.843 21.280 7.343 1.00 32.98 O ATOM 4817 CG2 THR F 89 -1.850 20.593 5.027 1.00 29.59 C ATOM 0 H THR F 89 -0.402 19.300 8.477 1.00 29.85 H new ATOM 0 HA THR F 89 -2.476 18.788 7.001 1.00 32.04 H new ATOM 0 HB THR F 89 -0.292 20.499 6.366 1.00 32.75 H new ATOM 0 HG1 THR F 89 -1.242 21.627 7.815 1.00 32.98 H new ATOM 0 HG21 THR F 89 -1.670 21.504 4.746 1.00 29.59 H new ATOM 0 HG22 THR F 89 -1.452 19.975 4.394 1.00 29.59 H new ATOM 0 HG23 THR F 89 -2.809 20.448 5.060 1.00 29.59 H new ATOM 4818 N GLU F 90 0.250 17.576 5.896 1.00 32.15 N ATOM 4819 CA GLU F 90 0.802 16.625 4.949 1.00 32.74 C ATOM 4820 C GLU F 90 0.115 15.274 5.125 1.00 32.55 C ATOM 4821 O GLU F 90 -0.243 14.621 4.149 1.00 30.84 O ATOM 4822 CB GLU F 90 2.306 16.498 5.157 1.00 35.11 C ATOM 4823 CG GLU F 90 3.020 17.812 4.931 1.00 40.82 C ATOM 4824 CD GLU F 90 4.517 17.704 5.086 1.00 43.55 C ATOM 4825 OE1 GLU F 90 5.188 18.755 5.012 1.00 45.53 O ATOM 4826 OE2 GLU F 90 5.020 16.574 5.277 1.00 43.73 O ATOM 0 H GLU F 90 0.810 17.875 6.476 1.00 32.15 H new ATOM 0 HA GLU F 90 0.645 16.938 4.044 1.00 32.74 H new ATOM 0 HB2 GLU F 90 2.482 16.186 6.058 1.00 35.11 H new ATOM 0 HB3 GLU F 90 2.661 15.829 4.550 1.00 35.11 H new ATOM 0 HG2 GLU F 90 2.815 18.137 4.040 1.00 40.82 H new ATOM 0 HG3 GLU F 90 2.682 18.470 5.558 1.00 40.82 H new ATOM 4827 N ARG F 91 -0.081 14.861 6.375 1.00 32.16 N ATOM 4828 CA ARG F 91 -0.750 13.595 6.646 1.00 32.06 C ATOM 4829 C ARG F 91 -2.185 13.657 6.123 1.00 32.34 C ATOM 4830 O ARG F 91 -2.737 12.658 5.662 1.00 32.31 O ATOM 4831 CB ARG F 91 -0.738 13.298 8.152 1.00 32.46 C ATOM 4832 CG ARG F 91 0.599 12.742 8.651 1.00 32.08 C ATOM 4833 CD ARG F 91 0.586 12.484 10.140 1.00 32.25 C ATOM 4834 NE ARG F 91 0.922 13.685 10.894 1.00 34.83 N ATOM 4835 CZ ARG F 91 0.196 14.174 11.890 1.00 32.87 C ATOM 4836 NH1 ARG F 91 -0.920 13.567 12.260 1.00 31.57 N ATOM 4837 NH2 ARG F 91 0.591 15.275 12.513 1.00 36.19 N ATOM 0 H ARG F 91 0.164 15.297 7.075 1.00 32.16 H new ATOM 0 HA ARG F 91 -0.278 12.879 6.193 1.00 32.06 H new ATOM 0 HB2 ARG F 91 -0.943 14.112 8.637 1.00 32.46 H new ATOM 0 HB3 ARG F 91 -1.441 12.662 8.355 1.00 32.46 H new ATOM 0 HG2 ARG F 91 0.800 11.917 8.183 1.00 32.08 H new ATOM 0 HG3 ARG F 91 1.308 13.369 8.439 1.00 32.08 H new ATOM 0 HD2 ARG F 91 -0.291 12.168 10.407 1.00 32.25 H new ATOM 0 HD3 ARG F 91 1.218 11.780 10.353 1.00 32.25 H new ATOM 0 HE ARG F 91 1.640 14.105 10.678 1.00 34.83 H new ATOM 0 HH11 ARG F 91 -1.176 12.853 11.854 1.00 31.57 H new ATOM 0 HH12 ARG F 91 -1.389 13.886 12.906 1.00 31.57 H new ATOM 0 HH21 ARG F 91 1.316 15.670 12.271 1.00 36.19 H new ATOM 0 HH22 ARG F 91 0.123 15.595 13.159 1.00 36.19 H new ATOM 4838 N GLU F 92 -2.786 14.838 6.193 1.00 32.04 N ATOM 4839 CA GLU F 92 -4.152 15.012 5.711 1.00 33.42 C ATOM 4840 C GLU F 92 -4.205 14.877 4.194 1.00 31.96 C ATOM 4841 O GLU F 92 -5.078 14.205 3.654 1.00 31.75 O ATOM 4842 CB GLU F 92 -4.695 16.383 6.130 1.00 33.43 C ATOM 4843 CG GLU F 92 -5.014 16.484 7.616 1.00 34.85 C ATOM 4844 CD GLU F 92 -5.332 17.901 8.050 1.00 38.05 C ATOM 4845 OE1 GLU F 92 -5.769 18.086 9.210 1.00 39.66 O ATOM 4846 OE2 GLU F 92 -5.137 18.832 7.235 1.00 39.35 O ATOM 0 H GLU F 92 -2.424 15.549 6.514 1.00 32.04 H new ATOM 0 HA GLU F 92 -4.704 14.319 6.106 1.00 33.42 H new ATOM 0 HB2 GLU F 92 -4.044 17.064 5.899 1.00 33.43 H new ATOM 0 HB3 GLU F 92 -5.498 16.574 5.621 1.00 33.43 H new ATOM 0 HG2 GLU F 92 -5.768 15.910 7.821 1.00 34.85 H new ATOM 0 HG3 GLU F 92 -4.259 16.154 8.128 1.00 34.85 H new ATOM 4847 N ASP F 93 -3.269 15.512 3.504 1.00 32.11 N ATOM 4848 CA ASP F 93 -3.253 15.429 2.054 1.00 33.60 C ATOM 4849 C ASP F 93 -2.995 13.995 1.613 1.00 34.14 C ATOM 4850 O ASP F 93 -3.706 13.462 0.760 1.00 34.54 O ATOM 4851 CB ASP F 93 -2.195 16.373 1.491 1.00 34.07 C ATOM 4852 CG ASP F 93 -2.589 17.830 1.641 1.00 34.07 C ATOM 4853 OD1 ASP F 93 -1.740 18.713 1.398 1.00 33.53 O ATOM 4854 OD2 ASP F 93 -3.758 18.089 1.999 1.00 34.54 O ATOM 0 H ASP F 93 -2.643 15.989 3.850 1.00 32.11 H new ATOM 0 HA ASP F 93 -4.118 15.699 1.709 1.00 33.60 H new ATOM 0 HB2 ASP F 93 -1.352 16.219 1.945 1.00 34.07 H new ATOM 0 HB3 ASP F 93 -2.052 16.173 0.553 1.00 34.07 H new ATOM 4855 N LEU F 94 -1.991 13.368 2.218 1.00 32.94 N ATOM 4856 CA LEU F 94 -1.644 11.995 1.886 1.00 32.22 C ATOM 4857 C LEU F 94 -2.851 11.077 2.080 1.00 31.00 C ATOM 4858 O LEU F 94 -3.160 10.252 1.215 1.00 30.25 O ATOM 4859 CB LEU F 94 -0.468 11.522 2.759 1.00 31.26 C ATOM 4860 CG LEU F 94 -0.018 10.067 2.573 1.00 31.40 C ATOM 4861 CD1 LEU F 94 0.402 9.819 1.122 1.00 32.13 C ATOM 4862 CD2 LEU F 94 1.129 9.761 3.530 1.00 30.78 C ATOM 0 H LEU F 94 -1.498 13.724 2.826 1.00 32.94 H new ATOM 0 HA LEU F 94 -1.377 11.958 0.954 1.00 32.22 H new ATOM 0 HB2 LEU F 94 0.292 12.099 2.584 1.00 31.26 H new ATOM 0 HB3 LEU F 94 -0.711 11.648 3.690 1.00 31.26 H new ATOM 0 HG LEU F 94 -0.759 9.475 2.774 1.00 31.40 H new ATOM 0 HD11 LEU F 94 0.684 8.896 1.020 1.00 32.13 H new ATOM 0 HD12 LEU F 94 -0.348 9.995 0.533 1.00 32.13 H new ATOM 0 HD13 LEU F 94 1.137 10.408 0.893 1.00 32.13 H new ATOM 0 HD21 LEU F 94 1.413 8.841 3.412 1.00 30.78 H new ATOM 0 HD22 LEU F 94 1.873 10.355 3.344 1.00 30.78 H new ATOM 0 HD23 LEU F 94 0.832 9.892 4.444 1.00 30.78 H new ATOM 4863 N ILE F 95 -3.537 11.229 3.210 1.00 30.59 N ATOM 4864 CA ILE F 95 -4.701 10.403 3.504 1.00 30.27 C ATOM 4865 C ILE F 95 -5.835 10.643 2.507 1.00 31.04 C ATOM 4866 O ILE F 95 -6.532 9.711 2.120 1.00 29.67 O ATOM 4867 CB ILE F 95 -5.199 10.643 4.948 1.00 31.31 C ATOM 4868 CG1 ILE F 95 -4.234 9.970 5.934 1.00 33.09 C ATOM 4869 CG2 ILE F 95 -6.610 10.097 5.120 1.00 28.08 C ATOM 4870 CD1 ILE F 95 -4.483 10.311 7.389 1.00 31.82 C ATOM 0 H ILE F 95 -3.344 11.805 3.819 1.00 30.59 H new ATOM 0 HA ILE F 95 -4.422 9.478 3.420 1.00 30.27 H new ATOM 0 HB ILE F 95 -5.223 11.596 5.127 1.00 31.31 H new ATOM 0 HG12 ILE F 95 -4.296 9.008 5.824 1.00 33.09 H new ATOM 0 HG13 ILE F 95 -3.326 10.224 5.705 1.00 33.09 H new ATOM 0 HG21 ILE F 95 -6.909 10.254 6.029 1.00 28.08 H new ATOM 0 HG22 ILE F 95 -7.208 10.545 4.501 1.00 28.08 H new ATOM 0 HG23 ILE F 95 -6.613 9.144 4.939 1.00 28.08 H new ATOM 0 HD11 ILE F 95 -3.836 9.849 7.945 1.00 31.82 H new ATOM 0 HD12 ILE F 95 -4.394 11.268 7.517 1.00 31.82 H new ATOM 0 HD13 ILE F 95 -5.379 10.034 7.638 1.00 31.82 H new ATOM 4871 N ALA F 96 -6.021 11.889 2.085 1.00 32.32 N ATOM 4872 CA ALA F 96 -7.066 12.182 1.110 1.00 32.47 C ATOM 4873 C ALA F 96 -6.724 11.445 -0.183 1.00 31.34 C ATOM 4874 O ALA F 96 -7.603 10.907 -0.847 1.00 31.08 O ATOM 4875 CB ALA F 96 -7.158 13.675 0.863 1.00 34.53 C ATOM 0 H ALA F 96 -5.562 12.568 2.345 1.00 32.32 H new ATOM 0 HA ALA F 96 -7.927 11.887 1.444 1.00 32.47 H new ATOM 0 HB1 ALA F 96 -7.856 13.853 0.214 1.00 34.53 H new ATOM 0 HB2 ALA F 96 -7.367 14.128 1.695 1.00 34.53 H new ATOM 0 HB3 ALA F 96 -6.310 14.000 0.523 1.00 34.53 H new ATOM 4876 N TYR F 97 -5.441 11.404 -0.532 1.00 30.00 N ATOM 4877 CA TYR F 97 -5.027 10.699 -1.741 1.00 29.65 C ATOM 4878 C TYR F 97 -5.306 9.199 -1.627 1.00 29.84 C ATOM 4879 O TYR F 97 -5.854 8.587 -2.542 1.00 27.81 O ATOM 4880 CB TYR F 97 -3.540 10.894 -2.013 1.00 28.26 C ATOM 4881 CG TYR F 97 -3.026 9.941 -3.077 1.00 29.88 C ATOM 4882 CD1 TYR F 97 -3.482 10.021 -4.393 1.00 31.31 C ATOM 4883 CD2 TYR F 97 -2.116 8.934 -2.760 1.00 28.73 C ATOM 4884 CE1 TYR F 97 -3.042 9.120 -5.363 1.00 31.90 C ATOM 4885 CE2 TYR F 97 -1.672 8.032 -3.720 1.00 29.37 C ATOM 4886 CZ TYR F 97 -2.138 8.132 -5.018 1.00 28.20 C ATOM 4887 OH TYR F 97 -1.690 7.254 -5.971 1.00 30.19 O ATOM 0 H TYR F 97 -4.802 11.773 -0.089 1.00 30.00 H new ATOM 0 HA TYR F 97 -5.542 11.072 -2.473 1.00 29.65 H new ATOM 0 HB2 TYR F 97 -3.381 11.808 -2.295 1.00 28.26 H new ATOM 0 HB3 TYR F 97 -3.042 10.760 -1.192 1.00 28.26 H new ATOM 0 HD1 TYR F 97 -4.089 10.686 -4.627 1.00 31.31 H new ATOM 0 HD2 TYR F 97 -1.799 8.864 -1.888 1.00 28.73 H new ATOM 0 HE1 TYR F 97 -3.355 9.183 -6.237 1.00 31.90 H new ATOM 0 HE2 TYR F 97 -1.065 7.365 -3.491 1.00 29.37 H new ATOM 0 HH TYR F 97 -1.149 6.714 -5.623 1.00 30.19 H new ATOM 4888 N LEU F 98 -4.900 8.614 -0.503 1.00 30.88 N ATOM 4889 CA LEU F 98 -5.109 7.193 -0.251 1.00 31.27 C ATOM 4890 C LEU F 98 -6.602 6.887 -0.259 1.00 31.03 C ATOM 4891 O LEU F 98 -7.030 5.848 -0.761 1.00 31.44 O ATOM 4892 CB LEU F 98 -4.514 6.803 1.109 1.00 28.72 C ATOM 4893 CG LEU F 98 -2.986 6.831 1.212 1.00 31.71 C ATOM 4894 CD1 LEU F 98 -2.542 6.570 2.656 1.00 30.57 C ATOM 4895 CD2 LEU F 98 -2.409 5.784 0.277 1.00 30.32 C ATOM 0 H LEU F 98 -4.497 9.029 0.133 1.00 30.88 H new ATOM 0 HA LEU F 98 -4.668 6.682 -0.947 1.00 31.27 H new ATOM 0 HB2 LEU F 98 -4.876 7.400 1.783 1.00 28.72 H new ATOM 0 HB3 LEU F 98 -4.818 5.909 1.330 1.00 28.72 H new ATOM 0 HG LEU F 98 -2.659 7.707 0.954 1.00 31.71 H new ATOM 0 HD11 LEU F 98 -1.573 6.591 2.706 1.00 30.57 H new ATOM 0 HD12 LEU F 98 -2.910 7.254 3.237 1.00 30.57 H new ATOM 0 HD13 LEU F 98 -2.861 5.699 2.941 1.00 30.57 H new ATOM 0 HD21 LEU F 98 -1.441 5.795 0.336 1.00 30.32 H new ATOM 0 HD22 LEU F 98 -2.738 4.907 0.530 1.00 30.32 H new ATOM 0 HD23 LEU F 98 -2.679 5.979 -0.634 1.00 30.32 H new ATOM 4896 N LYS F 99 -7.388 7.798 0.304 1.00 31.66 N ATOM 4897 CA LYS F 99 -8.832 7.623 0.360 1.00 35.67 C ATOM 4898 C LYS F 99 -9.346 7.464 -1.069 1.00 35.96 C ATOM 4899 O LYS F 99 -10.214 6.639 -1.344 1.00 37.60 O ATOM 4900 CB LYS F 99 -9.475 8.839 1.014 1.00 36.81 C ATOM 4901 CG LYS F 99 -10.778 8.557 1.743 1.00 39.52 C ATOM 4902 CD LYS F 99 -11.404 9.868 2.205 1.00 41.74 C ATOM 4903 CE LYS F 99 -12.490 9.654 3.239 1.00 42.55 C ATOM 4904 NZ LYS F 99 -11.925 9.176 4.521 1.00 44.39 N ATOM 0 H LYS F 99 -7.103 8.527 0.660 1.00 31.66 H new ATOM 0 HA LYS F 99 -9.057 6.839 0.885 1.00 35.67 H new ATOM 0 HB2 LYS F 99 -8.844 9.224 1.643 1.00 36.81 H new ATOM 0 HB3 LYS F 99 -9.639 9.508 0.331 1.00 36.81 H new ATOM 0 HG2 LYS F 99 -11.391 8.085 1.157 1.00 39.52 H new ATOM 0 HG3 LYS F 99 -10.614 7.981 2.506 1.00 39.52 H new ATOM 0 HD2 LYS F 99 -10.714 10.440 2.577 1.00 41.74 H new ATOM 0 HD3 LYS F 99 -11.776 10.334 1.440 1.00 41.74 H new ATOM 0 HE2 LYS F 99 -12.970 10.485 3.384 1.00 42.55 H new ATOM 0 HE3 LYS F 99 -13.134 9.009 2.906 1.00 42.55 H new ATOM 0 HZ1 LYS F 99 -12.419 8.503 4.831 1.00 44.39 H new ATOM 0 HZ2 LYS F 99 -11.090 8.896 4.392 1.00 44.39 H new ATOM 0 HZ3 LYS F 99 -11.926 9.841 5.112 1.00 44.39 H new ATOM 4905 N LYS F 100 -8.780 8.252 -1.976 1.00 35.18 N ATOM 4906 CA LYS F 100 -9.160 8.215 -3.383 1.00 34.82 C ATOM 4907 C LYS F 100 -8.622 6.977 -4.094 1.00 34.24 C ATOM 4908 O LYS F 100 -9.386 6.185 -4.635 1.00 34.82 O ATOM 4909 CB LYS F 100 -8.644 9.479 -4.083 1.00 36.10 C ATOM 4910 CG LYS F 100 -8.945 9.595 -5.576 1.00 35.65 C ATOM 4911 CD LYS F 100 -10.439 9.613 -5.869 1.00 35.91 C ATOM 4912 CE LYS F 100 -10.729 10.422 -7.128 1.00 38.04 C ATOM 4913 NZ LYS F 100 -9.790 10.078 -8.238 1.00 36.64 N ATOM 0 H LYS F 100 -8.164 8.824 -1.793 1.00 35.18 H new ATOM 0 HA LYS F 100 -10.128 8.176 -3.427 1.00 34.82 H new ATOM 0 HB2 LYS F 100 -9.023 10.252 -3.635 1.00 36.10 H new ATOM 0 HB3 LYS F 100 -7.683 9.524 -3.962 1.00 36.10 H new ATOM 0 HG2 LYS F 100 -8.541 10.406 -5.923 1.00 35.65 H new ATOM 0 HG3 LYS F 100 -8.535 8.851 -6.044 1.00 35.65 H new ATOM 0 HD2 LYS F 100 -10.763 8.705 -5.980 1.00 35.91 H new ATOM 0 HD3 LYS F 100 -10.917 9.995 -5.116 1.00 35.91 H new ATOM 0 HE2 LYS F 100 -11.641 10.259 -7.414 1.00 38.04 H new ATOM 0 HE3 LYS F 100 -10.660 11.368 -6.927 1.00 38.04 H new ATOM 0 HZ1 LYS F 100 -10.162 10.289 -9.018 1.00 36.64 H new ATOM 0 HZ2 LYS F 100 -9.032 10.534 -8.138 1.00 36.64 H new ATOM 0 HZ3 LYS F 100 -9.615 9.206 -8.220 1.00 36.64 H new ATOM 4914 N ALA F 101 -7.305 6.795 -4.063 1.00 34.42 N ATOM 4915 CA ALA F 101 -6.669 5.678 -4.758 1.00 33.59 C ATOM 4916 C ALA F 101 -6.912 4.262 -4.243 1.00 32.76 C ATOM 4917 O ALA F 101 -6.933 3.318 -5.032 1.00 30.94 O ATOM 4918 CB ALA F 101 -5.169 5.929 -4.859 1.00 33.55 C ATOM 0 H ALA F 101 -6.759 7.310 -3.643 1.00 34.42 H new ATOM 0 HA ALA F 101 -7.118 5.676 -5.618 1.00 33.59 H new ATOM 0 HB1 ALA F 101 -4.747 5.187 -5.320 1.00 33.55 H new ATOM 0 HB2 ALA F 101 -5.010 6.749 -5.353 1.00 33.55 H new ATOM 0 HB3 ALA F 101 -4.794 6.011 -3.968 1.00 33.55 H new ATOM 4919 N THR F 102 -7.094 4.086 -2.940 1.00 31.56 N ATOM 4920 CA THR F 102 -7.301 2.732 -2.456 1.00 31.58 C ATOM 4921 C THR F 102 -8.743 2.272 -2.587 1.00 33.08 C ATOM 4922 O THR F 102 -9.024 1.078 -2.497 1.00 33.22 O ATOM 4923 CB THR F 102 -6.816 2.563 -1.000 1.00 29.63 C ATOM 4924 OG1 THR F 102 -7.574 3.406 -0.127 1.00 29.26 O ATOM 4925 CG2 THR F 102 -5.335 2.926 -0.905 1.00 29.59 C ATOM 0 H THR F 102 -7.101 4.706 -2.345 1.00 31.56 H new ATOM 0 HA THR F 102 -6.762 2.164 -3.029 1.00 31.58 H new ATOM 0 HB THR F 102 -6.940 1.639 -0.733 1.00 29.63 H new ATOM 0 HG1 THR F 102 -7.299 4.197 -0.193 1.00 29.26 H new ATOM 0 HG21 THR F 102 -5.033 2.819 0.011 1.00 29.59 H new ATOM 0 HG22 THR F 102 -4.821 2.343 -1.485 1.00 29.59 H new ATOM 0 HG23 THR F 102 -5.209 3.847 -1.181 1.00 29.59 H new ATOM 4926 N ASN F 103 -9.654 3.212 -2.823 1.00 35.48 N ATOM 4927 CA ASN F 103 -11.064 2.869 -2.988 1.00 38.65 C ATOM 4928 C ASN F 103 -11.483 2.826 -4.460 1.00 41.64 C ATOM 4929 O ASN F 103 -12.575 2.370 -4.781 1.00 39.76 O ATOM 4930 CB ASN F 103 -11.955 3.851 -2.219 1.00 38.94 C ATOM 4931 CG ASN F 103 -11.945 3.597 -0.722 1.00 39.51 C ATOM 4932 OD1 ASN F 103 -12.127 2.463 -0.280 1.00 41.12 O ATOM 4933 ND2 ASN F 103 -11.741 4.649 0.064 1.00 40.22 N ATOM 0 H ASN F 103 -9.478 4.051 -2.891 1.00 35.48 H new ATOM 0 HA ASN F 103 -11.180 1.978 -2.623 1.00 38.65 H new ATOM 0 HB2 ASN F 103 -11.656 4.757 -2.392 1.00 38.94 H new ATOM 0 HB3 ASN F 103 -12.865 3.784 -2.549 1.00 38.94 H new ATOM 0 HD21 ASN F 103 -11.733 4.552 0.918 1.00 40.22 H new ATOM 0 HD22 ASN F 103 -11.617 5.427 -0.282 1.00 40.22 H new ATOM 4934 N GLU F 104 -10.614 3.303 -5.348 1.00 44.99 N ATOM 4935 CA GLU F 104 -10.908 3.293 -6.780 1.00 50.12 C ATOM 4936 C GLU F 104 -10.947 1.854 -7.266 1.00 51.28 C ATOM 4937 O GLU F 104 -9.879 1.347 -7.671 1.00 52.69 O ATOM 4938 CB GLU F 104 -9.846 4.069 -7.567 1.00 52.29 C ATOM 4939 CG GLU F 104 -9.910 5.582 -7.393 1.00 56.71 C ATOM 4940 CD GLU F 104 -8.707 6.296 -7.991 1.00 59.48 C ATOM 4941 OE1 GLU F 104 -8.467 6.150 -9.209 1.00 59.26 O ATOM 4942 OE2 GLU F 104 -7.999 7.005 -7.241 1.00 61.47 O ATOM 4943 OXT GLU F 104 -12.036 1.248 -7.210 1.00 53.45 O ATOM 0 H GLU F 104 -9.849 3.637 -5.143 1.00 44.99 H new ATOM 0 HA GLU F 104 -11.766 3.722 -6.924 1.00 50.12 H new ATOM 0 HB2 GLU F 104 -8.968 3.760 -7.294 1.00 52.29 H new ATOM 0 HB3 GLU F 104 -9.940 3.859 -8.509 1.00 52.29 H new ATOM 0 HG2 GLU F 104 -10.720 5.917 -7.809 1.00 56.71 H new ATOM 0 HG3 GLU F 104 -9.969 5.792 -6.448 1.00 56.71 H new TER 4944 GLU F 104 HETATM 4945 CHA HEM A 105 23.050 -10.719 4.510 1.00 25.00 C HETATM 4946 CHB HEM A 105 19.724 -13.618 2.682 1.00 22.51 C HETATM 4947 CHC HEM A 105 16.822 -9.874 2.052 1.00 23.62 C HETATM 4948 CHD HEM A 105 20.432 -6.972 3.233 1.00 21.91 C HETATM 4949 C1A HEM A 105 22.371 -11.881 4.126 1.00 24.20 C HETATM 4950 C2A HEM A 105 22.887 -13.162 4.280 1.00 22.95 C HETATM 4951 C3A HEM A 105 21.927 -13.980 3.742 1.00 23.42 C HETATM 4952 C4A HEM A 105 20.894 -13.155 3.313 1.00 24.44 C HETATM 4953 CMA HEM A 105 22.017 -15.492 3.625 1.00 21.07 C HETATM 4954 CAA HEM A 105 24.227 -13.637 4.838 1.00 24.99 C HETATM 4955 CBA HEM A 105 25.335 -13.596 3.775 1.00 26.01 C HETATM 4956 CGA HEM A 105 26.697 -14.048 4.291 1.00 27.49 C HETATM 4957 O1A HEM A 105 27.640 -14.120 3.478 1.00 29.14 O HETATM 4958 O2A HEM A 105 26.836 -14.322 5.502 1.00 29.27 O HETATM 4959 C1B HEM A 105 18.626 -12.848 2.288 1.00 23.71 C HETATM 4960 C2B HEM A 105 17.495 -13.360 1.642 1.00 24.12 C HETATM 4961 C3B HEM A 105 16.606 -12.307 1.584 1.00 23.72 C HETATM 4962 C4B HEM A 105 17.306 -11.190 2.050 1.00 24.83 C HETATM 4963 CMB HEM A 105 17.318 -14.792 1.126 1.00 24.80 C HETATM 4964 CAB HEM A 105 15.271 -12.354 1.194 1.00 25.48 C HETATM 4965 CBB HEM A 105 14.381 -13.299 1.867 1.00 25.21 C HETATM 4966 C1C HEM A 105 17.559 -8.722 2.359 1.00 22.31 C HETATM 4967 C2C HEM A 105 17.068 -7.427 2.195 1.00 22.79 C HETATM 4968 C3C HEM A 105 18.153 -6.604 2.391 1.00 21.63 C HETATM 4969 C4C HEM A 105 19.185 -7.430 2.824 1.00 23.22 C HETATM 4970 CMC HEM A 105 15.631 -7.018 1.853 1.00 23.95 C HETATM 4971 CAC HEM A 105 18.207 -5.217 2.228 1.00 22.26 C HETATM 4972 CBC HEM A 105 17.169 -4.345 2.737 1.00 20.91 C HETATM 4973 C1D HEM A 105 21.453 -7.771 3.727 1.00 24.02 C HETATM 4974 C2D HEM A 105 22.636 -7.245 4.241 1.00 24.46 C HETATM 4975 C3D HEM A 105 23.322 -8.320 4.778 1.00 23.75 C HETATM 4976 C4D HEM A 105 22.598 -9.423 4.348 1.00 21.09 C HETATM 4977 CMD HEM A 105 23.078 -5.783 4.227 1.00 25.00 C HETATM 4978 CAD HEM A 105 24.554 -8.277 5.682 1.00 23.25 C HETATM 4979 CBD HEM A 105 24.245 -7.650 7.046 1.00 24.50 C HETATM 4980 CGD HEM A 105 25.409 -7.686 8.027 1.00 24.42 C HETATM 4981 O1D HEM A 105 26.571 -7.481 7.611 1.00 22.01 O HETATM 4982 O2D HEM A 105 25.150 -7.906 9.235 1.00 25.79 O HETATM 4983 NA HEM A 105 21.146 -11.854 3.570 1.00 24.69 N HETATM 4984 NB HEM A 105 18.541 -11.519 2.499 1.00 24.89 N HETATM 4985 NC HEM A 105 18.829 -8.736 2.820 1.00 25.11 N HETATM 4986 ND HEM A 105 21.415 -9.114 3.777 1.00 23.73 N HETATM 4987 FE HEM A 105 19.965 -10.319 3.125 1.00 24.11 FE HETATM 0 HMA1 HEM A 105 22.947 -15.756 3.549 1.00 21.07 H new HETATM 0 HMA2 HEM A 105 21.533 -15.785 2.837 1.00 21.07 H new HETATM 0 HMA3 HEM A 105 21.628 -15.901 4.414 1.00 21.07 H new HETATM 0 HMB1 HEM A 105 18.181 -15.153 0.871 1.00 24.80 H new HETATM 0 HMB2 HEM A 105 16.729 -14.788 0.355 1.00 24.80 H new HETATM 0 HMB3 HEM A 105 16.931 -15.342 1.825 1.00 24.80 H new HETATM 0 HMC1 HEM A 105 15.215 -7.712 1.318 1.00 23.95 H new HETATM 0 HMC2 HEM A 105 15.641 -6.187 1.352 1.00 23.95 H new HETATM 0 HMC3 HEM A 105 15.126 -6.895 2.672 1.00 23.95 H new HETATM 0 HMD1 HEM A 105 22.706 -5.340 3.448 1.00 25.00 H new HETATM 0 HMD2 HEM A 105 24.046 -5.738 4.192 1.00 25.00 H new HETATM 0 HMD3 HEM A 105 22.763 -5.342 5.031 1.00 25.00 H new HETATM 0 HBB1 HEM A 105 13.446 -13.350 1.613 1.00 25.21 H new HETATM 0 HBB2 HEM A 105 14.725 -13.875 2.568 1.00 25.21 H new HETATM 0 HBC1 HEM A 105 17.235 -3.386 2.608 1.00 20.91 H new HETATM 0 HBC2 HEM A 105 16.408 -4.720 3.207 1.00 20.91 H new HETATM 0 HBA1 HEM A 105 25.411 -12.691 3.434 1.00 26.01 H new HETATM 0 HBA2 HEM A 105 25.077 -14.160 3.029 1.00 26.01 H new HETATM 0 HAA1 HEM A 105 24.135 -14.542 5.174 1.00 24.99 H new HETATM 0 HAA2 HEM A 105 24.480 -13.079 5.590 1.00 24.99 H new HETATM 0 HBD1 HEM A 105 23.489 -8.113 7.440 1.00 24.50 H new HETATM 0 HBD2 HEM A 105 23.975 -6.728 6.913 1.00 24.50 H new HETATM 0 HAD1 HEM A 105 25.257 -7.770 5.246 1.00 23.25 H new HETATM 0 HAD2 HEM A 105 24.892 -9.177 5.810 1.00 23.25 H new HETATM 0 HHA HEM A 105 23.882 -10.829 4.911 1.00 25.00 H new HETATM 0 HHB HEM A 105 19.677 -14.531 2.509 1.00 22.51 H new HETATM 0 HHC HEM A 105 15.927 -9.754 1.828 1.00 23.62 H new HETATM 0 HHD HEM A 105 20.595 -6.058 3.171 1.00 21.91 H new HETATM 0 HAB HEM A 105 14.938 -11.773 0.492 1.00 25.48 H new HETATM 0 HAC HEM A 105 18.962 -4.827 1.760 1.00 22.26 H new HETATM 4988 O1 PG4 A1001 25.543 -20.644 16.558 1.00 48.20 O HETATM 4989 C1 PG4 A1001 24.444 -20.935 15.697 1.00 47.19 C HETATM 4990 C2 PG4 A1001 23.170 -20.962 16.516 1.00 47.81 C HETATM 4991 O2 PG4 A1001 22.760 -19.626 16.793 1.00 46.31 O HETATM 4992 C3 PG4 A1001 21.564 -19.597 17.569 1.00 44.74 C HETATM 4993 C4 PG4 A1001 21.174 -18.156 17.833 1.00 42.54 C HETATM 4994 O3 PG4 A1001 22.283 -17.480 18.406 1.00 41.49 O HETATM 4995 C5 PG4 A1001 21.991 -16.117 18.673 1.00 39.70 C HETATM 4996 C6 PG4 A1001 23.218 -15.465 19.277 1.00 36.98 C HETATM 4997 O4 PG4 A1001 24.311 -15.673 18.404 1.00 36.14 O HETATM 4998 C7 PG4 A1001 25.505 -15.096 18.895 1.00 37.61 C HETATM 4999 C8 PG4 A1001 26.621 -15.374 17.907 1.00 39.66 C HETATM 5000 O5 PG4 A1001 26.653 -16.779 17.627 1.00 42.86 O HETATM 0 HO5 PG4 A1001 27.268 -16.942 17.079 1.00 42.86 H new HETATM 0 HO1 PG4 A1001 26.254 -20.629 16.110 1.00 48.20 H new HETATM 0 H82 PG4 A1001 26.478 -14.872 17.089 1.00 39.66 H new HETATM 0 H81 PG4 A1001 27.472 -15.085 18.272 1.00 39.66 H new HETATM 0 H72 PG4 A1001 25.392 -14.140 19.015 1.00 37.61 H new HETATM 0 H71 PG4 A1001 25.725 -15.467 19.764 1.00 37.61 H new HETATM 0 H62 PG4 A1001 23.066 -14.516 19.407 1.00 36.98 H new HETATM 0 H61 PG4 A1001 23.406 -15.844 20.150 1.00 36.98 H new HETATM 0 H52 PG4 A1001 21.737 -15.661 17.855 1.00 39.70 H new HETATM 0 H51 PG4 A1001 21.239 -16.047 19.282 1.00 39.70 H new HETATM 0 H42 PG4 A1001 20.907 -17.723 17.007 1.00 42.54 H new HETATM 0 H41 PG4 A1001 20.412 -18.119 18.432 1.00 42.54 H new HETATM 0 H32 PG4 A1001 20.850 -20.056 17.099 1.00 44.74 H new HETATM 0 H31 PG4 A1001 21.699 -20.066 18.408 1.00 44.74 H new HETATM 0 H22 PG4 A1001 22.472 -21.432 16.033 1.00 47.81 H new HETATM 0 H21 PG4 A1001 23.316 -21.445 17.344 1.00 47.81 H new HETATM 0 H12 PG4 A1001 24.379 -20.265 14.998 1.00 47.19 H new HETATM 0 H11 PG4 A1001 24.579 -21.790 15.259 1.00 47.19 H new HETATM 5001 C1 PEG A1007 28.796 -2.630 8.501 1.00 44.27 C HETATM 5002 O1 PEG A1007 28.497 -1.257 8.701 1.00 45.92 O HETATM 5003 C2 PEG A1007 28.229 -3.098 7.174 1.00 43.84 C HETATM 5004 O2 PEG A1007 26.825 -2.852 7.133 1.00 47.66 O HETATM 5005 C3 PEG A1007 26.258 -3.282 5.902 1.00 44.36 C HETATM 5006 C4 PEG A1007 24.770 -2.993 5.889 1.00 42.31 C HETATM 5007 O4 PEG A1007 24.449 -2.334 4.661 1.00 41.35 O HETATM 0 HO4 PEG A1007 24.873 -1.611 4.612 1.00 41.35 H new HETATM 0 HO1 PEG A1007 27.757 -1.077 8.347 1.00 45.92 H new HETATM 0 H42 PEG A1007 24.265 -3.817 5.972 1.00 42.31 H new HETATM 0 H41 PEG A1007 24.528 -2.435 6.645 1.00 42.31 H new HETATM 0 H32 PEG A1007 26.690 -2.828 5.162 1.00 44.36 H new HETATM 0 H31 PEG A1007 26.412 -4.232 5.780 1.00 44.36 H new HETATM 0 H22 PEG A1007 28.668 -2.634 6.444 1.00 43.84 H new HETATM 0 H21 PEG A1007 28.403 -4.045 7.054 1.00 43.84 H new HETATM 0 H12 PEG A1007 29.756 -2.765 8.516 1.00 44.27 H new HETATM 0 H11 PEG A1007 28.424 -3.158 9.224 1.00 44.27 H new HETATM 5008 CHA HEM B 105 5.090 -6.516 33.942 1.00 21.02 C HETATM 5009 CHB HEM B 105 6.231 -10.830 35.655 1.00 22.30 C HETATM 5010 CHC HEM B 105 10.700 -9.339 36.321 1.00 23.84 C HETATM 5011 CHD HEM B 105 9.295 -4.875 35.502 1.00 20.09 C HETATM 5012 C1A HEM B 105 5.020 -7.872 34.261 1.00 23.48 C HETATM 5013 C2A HEM B 105 3.862 -8.635 34.114 1.00 23.76 C HETATM 5014 C3A HEM B 105 4.192 -9.881 34.606 1.00 22.89 C HETATM 5015 C4A HEM B 105 5.522 -9.787 35.026 1.00 24.55 C HETATM 5016 CMA HEM B 105 3.250 -11.088 34.677 1.00 20.61 C HETATM 5017 CAA HEM B 105 2.483 -8.209 33.594 1.00 24.78 C HETATM 5018 CBA HEM B 105 1.724 -7.400 34.637 1.00 24.08 C HETATM 5019 CGA HEM B 105 0.305 -7.040 34.232 1.00 23.39 C HETATM 5020 O1A HEM B 105 -0.441 -6.593 35.123 1.00 22.31 O HETATM 5021 O2A HEM B 105 -0.064 -7.185 33.045 1.00 23.78 O HETATM 5022 C1B HEM B 105 7.568 -10.810 36.047 1.00 22.23 C HETATM 5023 C2B HEM B 105 8.226 -11.879 36.631 1.00 23.82 C HETATM 5024 C3B HEM B 105 9.560 -11.497 36.687 1.00 22.66 C HETATM 5025 C4B HEM B 105 9.566 -10.165 36.293 1.00 23.63 C HETATM 5026 CMB HEM B 105 7.586 -13.185 37.102 1.00 21.29 C HETATM 5027 CAB HEM B 105 10.691 -12.261 37.019 1.00 20.64 C HETATM 5028 CBB HEM B 105 10.997 -13.471 36.312 1.00 19.49 C HETATM 5029 C1C HEM B 105 10.710 -7.959 36.155 1.00 23.18 C HETATM 5030 C2C HEM B 105 11.835 -7.169 36.378 1.00 24.13 C HETATM 5031 C3C HEM B 105 11.394 -5.872 36.285 1.00 22.72 C HETATM 5032 C4C HEM B 105 10.072 -5.967 35.852 1.00 22.61 C HETATM 5033 CMC HEM B 105 13.259 -7.645 36.683 1.00 27.44 C HETATM 5034 CAC HEM B 105 12.115 -4.699 36.537 1.00 22.07 C HETATM 5035 CBC HEM B 105 13.495 -4.523 36.164 1.00 23.73 C HETATM 5036 C1D HEM B 105 7.996 -4.936 34.980 1.00 23.00 C HETATM 5037 C2D HEM B 105 7.305 -3.816 34.529 1.00 21.69 C HETATM 5038 C3D HEM B 105 6.165 -4.304 33.923 1.00 22.77 C HETATM 5039 C4D HEM B 105 6.162 -5.664 34.234 1.00 22.51 C HETATM 5040 CMD HEM B 105 7.720 -2.342 34.662 1.00 19.34 C HETATM 5041 CAD HEM B 105 5.156 -3.520 33.082 1.00 22.74 C HETATM 5042 CBD HEM B 105 5.801 -2.886 31.855 1.00 27.48 C HETATM 5043 CGD HEM B 105 4.809 -2.230 30.900 1.00 25.74 C HETATM 5044 O1D HEM B 105 3.963 -1.436 31.354 1.00 27.01 O HETATM 5045 O2D HEM B 105 4.898 -2.498 29.684 1.00 26.83 O HETATM 5046 NA HEM B 105 6.056 -8.580 34.764 1.00 23.05 N HETATM 5047 NB HEM B 105 8.357 -9.745 35.892 1.00 23.97 N HETATM 5048 NC HEM B 105 9.626 -7.246 35.794 1.00 23.64 N HETATM 5049 ND HEM B 105 7.293 -6.074 34.846 1.00 22.15 N HETATM 5050 FE HEM B 105 7.815 -7.931 35.339 1.00 23.08 FE HETATM 0 HMA1 HEM B 105 2.335 -10.780 34.772 1.00 20.61 H new HETATM 0 HMA2 HEM B 105 3.486 -11.639 35.440 1.00 20.61 H new HETATM 0 HMA3 HEM B 105 3.331 -11.611 33.864 1.00 20.61 H new HETATM 0 HMB1 HEM B 105 8.229 -13.907 37.024 1.00 21.29 H new HETATM 0 HMB2 HEM B 105 6.811 -13.382 36.553 1.00 21.29 H new HETATM 0 HMB3 HEM B 105 7.312 -13.096 38.028 1.00 21.29 H new HETATM 0 HMC1 HEM B 105 13.223 -8.491 37.156 1.00 27.44 H new HETATM 0 HMC2 HEM B 105 13.710 -6.986 37.234 1.00 27.44 H new HETATM 0 HMC3 HEM B 105 13.747 -7.759 35.853 1.00 27.44 H new HETATM 0 HMD1 HEM B 105 8.249 -2.226 35.467 1.00 19.34 H new HETATM 0 HMD2 HEM B 105 6.927 -1.786 34.714 1.00 19.34 H new HETATM 0 HMD3 HEM B 105 8.246 -2.083 33.890 1.00 19.34 H new HETATM 0 HBB1 HEM B 105 11.782 -13.988 36.553 1.00 19.49 H new HETATM 0 HBB2 HEM B 105 10.419 -13.772 35.593 1.00 19.49 H new HETATM 0 HBC1 HEM B 105 13.948 -3.689 36.362 1.00 23.73 H new HETATM 0 HBC2 HEM B 105 13.971 -5.239 35.714 1.00 23.73 H new HETATM 0 HBA1 HEM B 105 2.215 -6.583 34.819 1.00 24.08 H new HETATM 0 HBA2 HEM B 105 1.695 -7.904 35.465 1.00 24.08 H new HETATM 0 HAA1 HEM B 105 1.968 -8.995 33.354 1.00 24.78 H new HETATM 0 HAA2 HEM B 105 2.588 -7.682 32.787 1.00 24.78 H new HETATM 0 HBD1 HEM B 105 6.297 -3.567 31.374 1.00 27.48 H new HETATM 0 HBD2 HEM B 105 6.443 -2.220 32.147 1.00 27.48 H new HETATM 0 HAD1 HEM B 105 4.751 -2.827 33.627 1.00 22.74 H new HETATM 0 HAD2 HEM B 105 4.442 -4.113 32.800 1.00 22.74 H new HETATM 0 HHA HEM B 105 4.362 -6.146 33.497 1.00 21.02 H new HETATM 0 HHB HEM B 105 5.758 -11.612 35.826 1.00 22.30 H new HETATM 0 HHC HEM B 105 11.520 -9.753 36.464 1.00 23.84 H new HETATM 0 HHD HEM B 105 9.666 -4.031 35.624 1.00 20.09 H new HETATM 0 HAB HEM B 105 11.273 -11.966 37.737 1.00 20.64 H new HETATM 0 HAC HEM B 105 11.662 -3.968 36.986 1.00 22.07 H new HETATM 5051 O1 PG4 B1004 -2.165 -11.936 21.481 1.00 46.24 O HETATM 5052 C1 PG4 B1004 -1.814 -13.091 22.241 1.00 45.39 C HETATM 5053 C2 PG4 B1004 -0.747 -13.874 21.501 1.00 43.64 C HETATM 5054 O2 PG4 B1004 0.361 -13.022 21.244 1.00 41.70 O HETATM 5055 C3 PG4 B1004 1.399 -13.700 20.544 1.00 39.52 C HETATM 5056 C4 PG4 B1004 2.544 -12.734 20.293 1.00 38.86 C HETATM 5057 O3 PG4 B1004 2.022 -11.512 19.771 1.00 38.71 O HETATM 5058 C5 PG4 B1004 3.051 -10.567 19.517 1.00 37.71 C HETATM 5059 C6 PG4 B1004 2.433 -9.298 18.974 1.00 36.54 C HETATM 5060 O4 PG4 B1004 1.518 -8.794 19.936 1.00 37.73 O HETATM 5061 C7 PG4 B1004 0.896 -7.598 19.499 1.00 38.67 C HETATM 5062 C8 PG4 B1004 -0.071 -7.131 20.568 1.00 38.54 C HETATM 5063 O5 PG4 B1004 -1.097 -8.113 20.719 1.00 39.38 O HETATM 0 HO5 PG4 B1004 -1.638 -7.864 21.311 1.00 39.38 H new HETATM 0 HO1 PG4 B1004 -2.757 -11.501 21.889 1.00 46.24 H new HETATM 0 H82 PG4 B1004 0.395 -7.000 21.409 1.00 38.54 H new HETATM 0 H81 PG4 B1004 -0.458 -6.276 20.321 1.00 38.54 H new HETATM 0 H72 PG4 B1004 1.564 -6.915 19.329 1.00 38.67 H new HETATM 0 H71 PG4 B1004 0.426 -7.750 18.664 1.00 38.67 H new HETATM 0 H62 PG4 B1004 3.122 -8.641 18.787 1.00 36.54 H new HETATM 0 H61 PG4 B1004 1.977 -9.477 18.137 1.00 36.54 H new HETATM 0 H52 PG4 B1004 3.541 -10.378 20.333 1.00 37.71 H new HETATM 0 H51 PG4 B1004 3.688 -10.928 18.881 1.00 37.71 H new HETATM 0 H42 PG4 B1004 3.026 -12.566 21.118 1.00 38.86 H new HETATM 0 H41 PG4 B1004 3.177 -13.121 19.668 1.00 38.86 H new HETATM 0 H32 PG4 B1004 1.710 -14.460 21.061 1.00 39.52 H new HETATM 0 H31 PG4 B1004 1.064 -14.047 19.703 1.00 39.52 H new HETATM 0 H22 PG4 B1004 -0.466 -14.638 22.029 1.00 43.64 H new HETATM 0 H21 PG4 B1004 -1.103 -14.220 20.668 1.00 43.64 H new HETATM 0 H12 PG4 B1004 -1.488 -12.828 23.116 1.00 45.39 H new HETATM 0 H11 PG4 B1004 -2.596 -13.646 22.384 1.00 45.39 H new HETATM 5064 C1 PEG B1008 7.570 0.775 32.823 1.00 55.26 C HETATM 5065 O1 PEG B1008 8.543 1.046 33.830 1.00 54.67 O HETATM 5066 C2 PEG B1008 6.383 1.701 33.019 1.00 55.42 C HETATM 5067 O2 PEG B1008 6.087 2.348 31.785 1.00 54.74 O HETATM 5068 C3 PEG B1008 4.983 3.241 31.912 1.00 53.83 C HETATM 5069 C4 PEG B1008 4.711 3.907 30.572 1.00 54.05 C HETATM 5070 O4 PEG B1008 5.854 4.656 30.166 1.00 53.39 O HETATM 0 HO4 PEG B1008 6.045 5.219 30.759 1.00 53.39 H new HETATM 0 HO1 PEG B1008 9.202 0.535 33.728 1.00 54.67 H new HETATM 0 H42 PEG B1008 4.500 3.236 29.904 1.00 54.05 H new HETATM 0 H41 PEG B1008 3.939 4.491 30.642 1.00 54.05 H new HETATM 0 H32 PEG B1008 4.196 2.758 32.209 1.00 53.83 H new HETATM 0 H31 PEG B1008 5.174 3.913 32.585 1.00 53.83 H new HETATM 0 H22 PEG B1008 5.613 1.197 33.326 1.00 55.42 H new HETATM 0 H21 PEG B1008 6.582 2.360 33.703 1.00 55.42 H new HETATM 0 H12 PEG B1008 7.955 0.905 31.942 1.00 55.26 H new HETATM 0 H11 PEG B1008 7.285 -0.151 32.874 1.00 55.26 H new HETATM 5071 CHA HEM C 105 27.748 -10.077 32.147 1.00 18.98 C HETATM 5072 CHB HEM C 105 31.064 -7.343 34.137 1.00 22.72 C HETATM 5073 CHC HEM C 105 27.731 -4.191 35.436 1.00 24.14 C HETATM 5074 CHD HEM C 105 24.453 -7.365 34.295 1.00 20.44 C HETATM 5075 C1A HEM C 105 28.991 -9.542 32.450 1.00 20.55 C HETATM 5076 C2A HEM C 105 30.204 -10.146 32.109 1.00 19.59 C HETATM 5077 C3A HEM C 105 31.170 -9.317 32.684 1.00 17.48 C HETATM 5078 C4A HEM C 105 30.468 -8.323 33.347 1.00 19.87 C HETATM 5079 CMA HEM C 105 32.708 -9.465 32.596 1.00 18.76 C HETATM 5080 CAA HEM C 105 30.443 -11.452 31.343 1.00 19.82 C HETATM 5081 CBA HEM C 105 30.231 -12.676 32.243 1.00 20.32 C HETATM 5082 CGA HEM C 105 30.566 -13.997 31.577 1.00 24.92 C HETATM 5083 O1A HEM C 105 30.605 -15.014 32.305 1.00 24.78 O HETATM 5084 O2A HEM C 105 30.783 -14.029 30.341 1.00 22.01 O HETATM 5085 C1B HEM C 105 30.427 -6.220 34.691 1.00 23.60 C HETATM 5086 C2B HEM C 105 31.123 -5.168 35.302 1.00 24.46 C HETATM 5087 C3B HEM C 105 30.181 -4.209 35.592 1.00 23.74 C HETATM 5088 C4B HEM C 105 28.962 -4.795 35.227 1.00 24.18 C HETATM 5089 CMB HEM C 105 32.622 -5.102 35.577 1.00 25.52 C HETATM 5090 CAB HEM C 105 30.386 -2.906 36.103 1.00 26.66 C HETATM 5091 CBB HEM C 105 31.310 -1.942 35.473 1.00 22.61 C HETATM 5092 C1C HEM C 105 26.505 -4.785 35.235 1.00 21.13 C HETATM 5093 C2C HEM C 105 25.322 -4.194 35.648 1.00 23.40 C HETATM 5094 C3C HEM C 105 24.369 -5.158 35.407 1.00 23.07 C HETATM 5095 C4C HEM C 105 25.051 -6.209 34.771 1.00 21.10 C HETATM 5096 CMC HEM C 105 25.148 -2.796 36.277 1.00 23.18 C HETATM 5097 CAC HEM C 105 22.997 -5.113 35.715 1.00 25.39 C HETATM 5098 CBC HEM C 105 22.122 -3.939 35.472 1.00 23.22 C HETATM 5099 C1D HEM C 105 25.068 -8.377 33.565 1.00 19.24 C HETATM 5100 C2D HEM C 105 24.374 -9.458 33.031 1.00 19.07 C HETATM 5101 C3D HEM C 105 25.291 -10.162 32.276 1.00 17.68 C HETATM 5102 C4D HEM C 105 26.522 -9.566 32.564 1.00 19.36 C HETATM 5103 CMD HEM C 105 22.876 -9.800 33.218 1.00 20.83 C HETATM 5104 CAD HEM C 105 24.975 -11.277 31.282 1.00 21.23 C HETATM 5105 CBD HEM C 105 24.310 -10.723 30.023 1.00 21.28 C HETATM 5106 CGD HEM C 105 24.079 -11.758 28.946 1.00 24.29 C HETATM 5107 O1D HEM C 105 23.898 -12.943 29.292 1.00 20.91 O HETATM 5108 O2D HEM C 105 24.055 -11.377 27.747 1.00 21.55 O HETATM 5109 NA HEM C 105 29.136 -8.374 33.134 1.00 21.47 N HETATM 5110 NB HEM C 105 29.093 -6.012 34.667 1.00 22.55 N HETATM 5111 NC HEM C 105 26.361 -5.981 34.657 1.00 22.26 N HETATM 5112 ND HEM C 105 26.386 -8.420 33.289 1.00 20.02 N HETATM 5113 FE HEM C 105 27.741 -7.198 33.929 1.00 24.24 FE HETATM 0 HMA1 HEM C 105 32.939 -10.404 32.517 1.00 18.76 H new HETATM 0 HMA2 HEM C 105 33.115 -9.098 33.397 1.00 18.76 H new HETATM 0 HMA3 HEM C 105 33.035 -8.986 31.819 1.00 18.76 H new HETATM 0 HMB1 HEM C 105 32.916 -4.178 35.551 1.00 25.52 H new HETATM 0 HMB2 HEM C 105 33.098 -5.611 34.902 1.00 25.52 H new HETATM 0 HMB3 HEM C 105 32.807 -5.475 36.453 1.00 25.52 H new HETATM 0 HMC1 HEM C 105 24.275 -2.442 36.044 1.00 23.18 H new HETATM 0 HMC2 HEM C 105 25.837 -2.202 35.941 1.00 23.18 H new HETATM 0 HMC3 HEM C 105 25.222 -2.864 37.242 1.00 23.18 H new HETATM 0 HMD1 HEM C 105 22.576 -9.479 34.083 1.00 20.83 H new HETATM 0 HMD2 HEM C 105 22.755 -10.761 33.171 1.00 20.83 H new HETATM 0 HMD3 HEM C 105 22.357 -9.374 32.518 1.00 20.83 H new HETATM 0 HBB1 HEM C 105 31.422 -1.057 35.855 1.00 22.61 H new HETATM 0 HBB2 HEM C 105 31.805 -2.193 34.677 1.00 22.61 H new HETATM 0 HBC1 HEM C 105 21.182 -3.977 35.709 1.00 23.22 H new HETATM 0 HBC2 HEM C 105 22.490 -3.134 35.076 1.00 23.22 H new HETATM 0 HBA1 HEM C 105 29.306 -12.696 32.533 1.00 20.32 H new HETATM 0 HBA2 HEM C 105 30.776 -12.579 33.039 1.00 20.32 H new HETATM 0 HAA1 HEM C 105 31.346 -11.461 30.990 1.00 19.82 H new HETATM 0 HAA2 HEM C 105 29.841 -11.498 30.584 1.00 19.82 H new HETATM 0 HBD1 HEM C 105 24.862 -10.012 29.663 1.00 21.28 H new HETATM 0 HBD2 HEM C 105 23.459 -10.326 30.266 1.00 21.28 H new HETATM 0 HAD1 HEM C 105 24.391 -11.929 31.699 1.00 21.23 H new HETATM 0 HAD2 HEM C 105 25.792 -11.741 31.042 1.00 21.23 H new HETATM 0 HHA HEM C 105 27.732 -10.843 31.620 1.00 18.98 H new HETATM 0 HHB HEM C 105 31.971 -7.442 34.315 1.00 22.72 H new HETATM 0 HHC HEM C 105 27.734 -3.311 35.737 1.00 24.14 H new HETATM 0 HHD HEM C 105 23.549 -7.475 34.483 1.00 20.44 H new HETATM 0 HAB HEM C 105 29.901 -2.635 36.898 1.00 26.66 H new HETATM 0 HAC HEM C 105 22.596 -5.902 36.113 1.00 25.39 H new HETATM 5114 O1 PG4 C1005 35.283 -11.666 18.742 1.00 47.62 O HETATM 5115 C1 PG4 C1005 36.088 -10.774 19.513 1.00 48.54 C HETATM 5116 C2 PG4 C1005 36.136 -9.425 18.823 1.00 47.10 C HETATM 5117 O2 PG4 C1005 34.828 -8.862 18.809 1.00 47.51 O HETATM 5118 C3 PG4 C1005 34.803 -7.585 18.165 1.00 46.46 C HETATM 5119 C4 PG4 C1005 33.383 -7.049 18.183 1.00 42.22 C HETATM 5120 O3 PG4 C1005 32.516 -8.044 17.650 1.00 41.92 O HETATM 5121 C5 PG4 C1005 31.163 -7.625 17.642 1.00 39.37 C HETATM 5122 C6 PG4 C1005 30.317 -8.741 17.071 1.00 37.58 C HETATM 5123 O4 PG4 C1005 30.535 -9.916 17.833 1.00 37.48 O HETATM 5124 C7 PG4 C1005 29.769 -11.001 17.340 1.00 41.82 C HETATM 5125 C8 PG4 C1005 30.047 -12.229 18.186 1.00 43.57 C HETATM 5126 O5 PG4 C1005 31.280 -12.805 17.762 1.00 46.21 O HETATM 0 HO5 PG4 C1005 31.445 -13.486 18.225 1.00 46.21 H new HETATM 0 HO1 PG4 C1005 35.254 -12.416 19.120 1.00 47.62 H new HETATM 0 H82 PG4 C1005 30.093 -11.988 19.124 1.00 43.57 H new HETATM 0 H81 PG4 C1005 29.326 -12.871 18.094 1.00 43.57 H new HETATM 0 H72 PG4 C1005 28.824 -10.783 17.367 1.00 41.82 H new HETATM 0 H71 PG4 C1005 29.994 -11.175 16.413 1.00 41.82 H new HETATM 0 H62 PG4 C1005 29.379 -8.496 17.093 1.00 37.58 H new HETATM 0 H61 PG4 C1005 30.548 -8.896 16.142 1.00 37.58 H new HETATM 0 H52 PG4 C1005 30.872 -7.408 18.542 1.00 39.37 H new HETATM 0 H51 PG4 C1005 31.063 -6.820 17.110 1.00 39.37 H new HETATM 0 H42 PG4 C1005 33.120 -6.823 19.089 1.00 42.22 H new HETATM 0 H41 PG4 C1005 33.324 -6.235 17.659 1.00 42.22 H new HETATM 0 H32 PG4 C1005 35.399 -6.969 18.619 1.00 46.46 H new HETATM 0 H31 PG4 C1005 35.119 -7.664 17.252 1.00 46.46 H new HETATM 0 H22 PG4 C1005 36.750 -8.834 19.286 1.00 47.10 H new HETATM 0 H21 PG4 C1005 36.467 -9.524 17.917 1.00 47.10 H new HETATM 0 H12 PG4 C1005 35.721 -10.680 20.406 1.00 48.54 H new HETATM 0 H11 PG4 C1005 36.984 -11.132 19.610 1.00 48.54 H new HETATM 5127 C1 PEG C1009 19.421 -10.916 32.210 1.00 44.42 C HETATM 5128 O1 PEG C1009 19.268 -11.104 33.619 1.00 41.24 O HETATM 5129 C2 PEG C1009 19.917 -12.207 31.591 1.00 44.02 C HETATM 5130 O2 PEG C1009 19.147 -12.508 30.435 1.00 45.72 O HETATM 5131 C3 PEG C1009 19.575 -13.727 29.828 1.00 45.72 C HETATM 5132 C4 PEG C1009 18.729 -14.015 28.594 1.00 46.17 C HETATM 5133 O4 PEG C1009 17.392 -14.308 28.987 1.00 46.11 O HETATM 0 HO4 PEG C1009 17.176 -13.817 29.633 1.00 46.11 H new HETATM 0 HO1 PEG C1009 20.011 -11.004 33.998 1.00 41.24 H new HETATM 0 H42 PEG C1009 18.740 -13.250 27.998 1.00 46.17 H new HETATM 0 H41 PEG C1009 19.102 -14.763 28.102 1.00 46.17 H new HETATM 0 H32 PEG C1009 20.511 -13.664 29.581 1.00 45.72 H new HETATM 0 H31 PEG C1009 19.498 -14.458 30.461 1.00 45.72 H new HETATM 0 H22 PEG C1009 20.854 -12.124 31.354 1.00 44.02 H new HETATM 0 H21 PEG C1009 19.850 -12.931 32.233 1.00 44.02 H new HETATM 0 H12 PEG C1009 18.575 -10.657 31.813 1.00 44.42 H new HETATM 0 H11 PEG C1009 20.048 -10.197 32.034 1.00 44.42 H new HETATM 5134 CHA HEM D 105 19.609 11.058 33.873 1.00 21.28 C HETATM 5135 CHB HEM D 105 15.568 12.124 36.149 1.00 21.22 C HETATM 5136 CHC HEM D 105 14.552 7.496 36.588 1.00 23.64 C HETATM 5137 CHD HEM D 105 19.011 6.510 35.181 1.00 21.82 C HETATM 5138 C1A HEM D 105 18.525 11.759 34.358 1.00 22.93 C HETATM 5139 C2A HEM D 105 18.391 13.142 34.252 1.00 23.00 C HETATM 5140 C3A HEM D 105 17.212 13.438 34.913 1.00 22.26 C HETATM 5141 C4A HEM D 105 16.731 12.234 35.381 1.00 22.28 C HETATM 5142 CMA HEM D 105 16.614 14.831 35.118 1.00 21.56 C HETATM 5143 CAA HEM D 105 19.355 14.151 33.649 1.00 20.59 C HETATM 5144 CBA HEM D 105 20.532 14.404 34.577 1.00 21.31 C HETATM 5145 CGA HEM D 105 21.482 15.485 34.092 1.00 22.07 C HETATM 5146 O1A HEM D 105 22.349 15.883 34.887 1.00 23.65 O HETATM 5147 O2A HEM D 105 21.385 15.936 32.933 1.00 22.22 O HETATM 5148 C1B HEM D 105 14.931 10.938 36.503 1.00 23.34 C HETATM 5149 C2B HEM D 105 13.747 10.909 37.231 1.00 25.18 C HETATM 5150 C3B HEM D 105 13.389 9.566 37.265 1.00 25.08 C HETATM 5151 C4B HEM D 105 14.446 8.885 36.663 1.00 23.08 C HETATM 5152 CMB HEM D 105 13.015 12.101 37.848 1.00 23.20 C HETATM 5153 CAB HEM D 105 12.193 9.015 37.755 1.00 25.59 C HETATM 5154 CBB HEM D 105 10.883 9.536 37.355 1.00 26.15 C HETATM 5155 C1C HEM D 105 15.737 6.813 36.286 1.00 23.85 C HETATM 5156 C2C HEM D 105 15.886 5.449 36.460 1.00 23.37 C HETATM 5157 C3C HEM D 105 17.206 5.193 36.172 1.00 23.65 C HETATM 5158 C4C HEM D 105 17.733 6.384 35.711 1.00 23.06 C HETATM 5159 CMC HEM D 105 14.802 4.471 36.907 1.00 25.89 C HETATM 5160 CAC HEM D 105 17.892 3.969 36.277 1.00 25.85 C HETATM 5161 CBC HEM D 105 17.277 2.710 35.842 1.00 23.55 C HETATM 5162 C1D HEM D 105 19.582 7.691 34.691 1.00 23.18 C HETATM 5163 C2D HEM D 105 20.862 7.780 34.147 1.00 23.45 C HETATM 5164 C3D HEM D 105 20.927 9.036 33.586 1.00 23.07 C HETATM 5165 C4D HEM D 105 19.806 9.695 34.049 1.00 22.49 C HETATM 5166 CMD HEM D 105 22.004 6.742 34.118 1.00 26.17 C HETATM 5167 CAD HEM D 105 21.982 9.553 32.630 1.00 22.70 C HETATM 5168 CBD HEM D 105 21.875 8.901 31.250 1.00 22.83 C HETATM 5169 CGD HEM D 105 22.821 9.500 30.209 1.00 26.06 C HETATM 5170 O1D HEM D 105 23.953 9.910 30.572 1.00 22.05 O HETATM 5171 O2D HEM D 105 22.431 9.538 29.015 1.00 23.45 O HETATM 5172 NA HEM D 105 17.501 11.181 35.002 1.00 23.20 N HETATM 5173 NB HEM D 105 15.387 9.712 36.172 1.00 22.25 N HETATM 5174 NC HEM D 105 16.860 7.396 35.836 1.00 23.24 N HETATM 5175 ND HEM D 105 18.945 8.872 34.682 1.00 22.16 N HETATM 5176 FE HEM D 105 17.179 9.276 35.427 1.00 22.90 FE HETATM 0 HMA1 HEM D 105 17.325 15.491 35.120 1.00 21.56 H new HETATM 0 HMA2 HEM D 105 16.144 14.860 35.966 1.00 21.56 H new HETATM 0 HMA3 HEM D 105 15.994 15.026 34.398 1.00 21.56 H new HETATM 0 HMB1 HEM D 105 13.658 12.787 38.087 1.00 23.20 H new HETATM 0 HMB2 HEM D 105 12.540 11.813 38.643 1.00 23.20 H new HETATM 0 HMB3 HEM D 105 12.382 12.460 37.206 1.00 23.20 H new HETATM 0 HMC1 HEM D 105 14.171 4.929 37.485 1.00 25.89 H new HETATM 0 HMC2 HEM D 105 15.209 3.736 37.392 1.00 25.89 H new HETATM 0 HMC3 HEM D 105 14.336 4.126 36.129 1.00 25.89 H new HETATM 0 HMD1 HEM D 105 21.944 6.172 34.901 1.00 26.17 H new HETATM 0 HMD2 HEM D 105 22.859 7.201 34.118 1.00 26.17 H new HETATM 0 HMD3 HEM D 105 21.928 6.200 33.317 1.00 26.17 H new HETATM 0 HBB1 HEM D 105 10.073 9.136 37.709 1.00 26.15 H new HETATM 0 HBB2 HEM D 105 10.826 10.281 36.736 1.00 26.15 H new HETATM 0 HBC1 HEM D 105 17.768 1.877 35.923 1.00 23.55 H new HETATM 0 HBC2 HEM D 105 16.380 2.710 35.473 1.00 23.55 H new HETATM 0 HBA1 HEM D 105 21.027 13.577 34.688 1.00 21.31 H new HETATM 0 HBA2 HEM D 105 20.194 14.652 35.452 1.00 21.31 H new HETATM 0 HAA1 HEM D 105 18.890 14.985 33.477 1.00 20.59 H new HETATM 0 HAA2 HEM D 105 19.677 13.824 32.794 1.00 20.59 H new HETATM 0 HBD1 HEM D 105 20.963 8.985 30.932 1.00 22.83 H new HETATM 0 HBD2 HEM D 105 22.060 7.953 31.335 1.00 22.83 H new HETATM 0 HAD1 HEM D 105 22.863 9.384 32.999 1.00 22.70 H new HETATM 0 HAD2 HEM D 105 21.892 10.515 32.540 1.00 22.70 H new HETATM 0 HHA HEM D 105 20.252 11.531 33.395 1.00 21.28 H new HETATM 0 HHB HEM D 105 15.185 12.916 36.451 1.00 21.22 H new HETATM 0 HHC HEM D 105 13.787 6.992 36.749 1.00 23.64 H new HETATM 0 HHD HEM D 105 19.534 5.742 35.149 1.00 21.82 H new HETATM 0 HAB HEM D 105 12.236 8.270 38.375 1.00 25.59 H new HETATM 0 HAC HEM D 105 18.790 3.957 36.644 1.00 25.85 H new HETATM 5177 O1 PG4 D1006 17.018 20.653 21.598 1.00 42.99 O HETATM 5178 C1 PG4 D1006 16.088 20.915 22.658 1.00 40.01 C HETATM 5179 C2 PG4 D1006 14.710 20.411 22.268 1.00 38.32 C HETATM 5180 O2 PG4 D1006 14.804 19.039 21.912 1.00 39.21 O HETATM 5181 C3 PG4 D1006 13.543 18.490 21.528 1.00 36.42 C HETATM 5182 C4 PG4 D1006 13.732 17.031 21.162 1.00 32.89 C HETATM 5183 O3 PG4 D1006 14.976 16.875 20.474 1.00 34.58 O HETATM 5184 C5 PG4 D1006 15.204 15.521 20.113 1.00 35.05 C HETATM 5185 C6 PG4 D1006 16.535 15.412 19.391 1.00 36.58 C HETATM 5186 O4 PG4 D1006 17.564 15.913 20.233 1.00 37.41 O HETATM 5187 C7 PG4 D1006 18.830 15.841 19.606 1.00 39.52 C HETATM 5188 C8 PG4 D1006 19.877 16.404 20.547 1.00 39.96 C HETATM 5189 O5 PG4 D1006 19.730 17.823 20.610 1.00 43.34 O HETATM 0 HO5 PG4 D1006 20.306 18.142 21.131 1.00 43.34 H new HETATM 0 HO1 PG4 D1006 16.785 19.960 21.185 1.00 42.99 H new HETATM 0 H82 PG4 D1006 19.776 16.017 21.431 1.00 39.96 H new HETATM 0 H81 PG4 D1006 20.766 16.173 20.236 1.00 39.96 H new HETATM 0 H72 PG4 D1006 19.041 14.921 19.381 1.00 39.52 H new HETATM 0 H71 PG4 D1006 18.822 16.342 18.775 1.00 39.52 H new HETATM 0 H62 PG4 D1006 16.714 14.488 19.158 1.00 36.58 H new HETATM 0 H61 PG4 D1006 16.508 15.914 18.561 1.00 36.58 H new HETATM 0 H52 PG4 D1006 15.207 14.960 20.905 1.00 35.05 H new HETATM 0 H51 PG4 D1006 14.487 15.202 19.542 1.00 35.05 H new HETATM 0 H42 PG4 D1006 13.721 16.482 21.962 1.00 32.89 H new HETATM 0 H41 PG4 D1006 13.000 16.730 20.601 1.00 32.89 H new HETATM 0 H32 PG4 D1006 12.906 18.573 22.255 1.00 36.42 H new HETATM 0 H31 PG4 D1006 13.179 18.980 20.774 1.00 36.42 H new HETATM 0 H22 PG4 D1006 14.091 20.524 23.006 1.00 38.32 H new HETATM 0 H21 PG4 D1006 14.362 20.927 21.524 1.00 38.32 H new HETATM 0 H12 PG4 D1006 16.382 20.479 23.473 1.00 40.01 H new HETATM 0 H11 PG4 D1006 16.054 21.867 22.842 1.00 40.01 H new HETATM 5190 C1 PGE D1010 24.716 3.767 33.564 1.00 41.57 C HETATM 5191 O1 PGE D1010 25.412 4.361 34.648 1.00 42.84 O HETATM 5192 C2 PGE D1010 24.451 4.813 32.498 1.00 42.54 C HETATM 5193 O2 PGE D1010 25.683 5.370 32.072 1.00 44.80 O HETATM 5194 C3 PGE D1010 25.488 6.349 31.073 1.00 44.84 C HETATM 5195 C4 PGE D1010 26.835 6.904 30.666 1.00 46.47 C HETATM 5196 O4 PGE D1010 28.889 4.925 27.692 1.00 51.35 O HETATM 5197 C6 PGE D1010 29.609 5.296 28.861 1.00 50.54 C HETATM 5198 C5 PGE D1010 28.850 6.389 29.586 1.00 48.68 C HETATM 5199 O3 PGE D1010 27.575 5.899 29.983 1.00 48.12 O HETATM 0 HO4 PGE D1010 28.080 5.134 27.783 1.00 51.35 H new HETATM 0 HO1 PGE D1010 24.862 4.722 35.170 1.00 42.84 H new HETATM 0 H62 PGE D1010 29.724 4.527 29.441 1.00 50.54 H new HETATM 0 H6 PGE D1010 30.496 5.607 28.623 1.00 50.54 H new HETATM 0 H52 PGE D1010 29.351 6.683 30.363 1.00 48.68 H new HETATM 0 H5 PGE D1010 28.745 7.161 29.008 1.00 48.68 H new HETATM 0 H42 PGE D1010 26.717 7.678 30.093 1.00 46.47 H new HETATM 0 H4 PGE D1010 27.323 7.202 31.449 1.00 46.47 H new HETATM 0 H32 PGE D1010 25.039 5.961 30.306 1.00 44.84 H new HETATM 0 H3 PGE D1010 24.918 7.060 31.406 1.00 44.84 H new HETATM 0 H22 PGE D1010 23.988 4.413 31.746 1.00 42.54 H new HETATM 0 H2 PGE D1010 23.874 5.509 32.849 1.00 42.54 H new HETATM 0 H12 PGE D1010 25.237 3.038 33.193 1.00 41.57 H new HETATM 0 H1 PGE D1010 23.879 3.388 33.874 1.00 41.57 H new HETATM 5200 CHA HEM E 105 2.307 -1.296 6.549 1.00 22.68 C HETATM 5201 CHB HEM E 105 1.149 3.040 4.911 1.00 23.56 C HETATM 5202 CHC HEM E 105 5.725 3.831 3.781 1.00 23.43 C HETATM 5203 CHD HEM E 105 6.639 -0.785 4.534 1.00 24.22 C HETATM 5204 C1A HEM E 105 1.588 -0.134 6.287 1.00 22.49 C HETATM 5205 C2A HEM E 105 0.241 0.044 6.599 1.00 26.85 C HETATM 5206 C3A HEM E 105 -0.077 1.315 6.162 1.00 25.93 C HETATM 5207 C4A HEM E 105 1.076 1.805 5.556 1.00 23.62 C HETATM 5208 CMA HEM E 105 -1.434 1.989 6.346 1.00 26.99 C HETATM 5209 CAA HEM E 105 -0.761 -0.895 7.252 1.00 27.97 C HETATM 5210 CBA HEM E 105 -1.276 -1.955 6.288 1.00 27.91 C HETATM 5211 CGA HEM E 105 -2.393 -2.801 6.874 1.00 30.12 C HETATM 5212 O1A HEM E 105 -2.946 -3.647 6.136 1.00 28.67 O HETATM 5213 O2A HEM E 105 -2.717 -2.630 8.071 1.00 30.14 O HETATM 5214 C1B HEM E 105 2.316 3.652 4.399 1.00 24.65 C HETATM 5215 C2B HEM E 105 2.342 4.933 3.837 1.00 22.62 C HETATM 5216 C3B HEM E 105 3.672 5.209 3.651 1.00 22.80 C HETATM 5217 C4B HEM E 105 4.356 4.027 3.956 1.00 25.48 C HETATM 5218 CMB HEM E 105 1.135 5.817 3.493 1.00 20.59 C HETATM 5219 CAB HEM E 105 4.237 6.424 3.261 1.00 27.53 C HETATM 5220 CBB HEM E 105 3.863 7.665 3.921 1.00 26.34 C HETATM 5221 C1C HEM E 105 6.380 2.598 3.860 1.00 24.73 C HETATM 5222 C2C HEM E 105 7.689 2.421 3.425 1.00 25.24 C HETATM 5223 C3C HEM E 105 7.912 1.059 3.504 1.00 25.03 C HETATM 5224 C4C HEM E 105 6.773 0.543 4.133 1.00 24.92 C HETATM 5225 CMC HEM E 105 8.634 3.534 2.944 1.00 26.65 C HETATM 5226 CAC HEM E 105 9.031 0.324 3.074 1.00 24.84 C HETATM 5227 CBC HEM E 105 10.413 0.787 3.229 1.00 25.52 C HETATM 5228 C1D HEM E 105 5.539 -1.326 5.207 1.00 24.08 C HETATM 5229 C2D HEM E 105 5.508 -2.621 5.675 1.00 23.82 C HETATM 5230 C3D HEM E 105 4.309 -2.705 6.364 1.00 23.44 C HETATM 5231 C4D HEM E 105 3.628 -1.530 6.141 1.00 20.77 C HETATM 5232 CMD HEM E 105 6.559 -3.723 5.511 1.00 22.17 C HETATM 5233 CAD HEM E 105 3.870 -3.849 7.258 1.00 24.26 C HETATM 5234 CBD HEM E 105 4.636 -3.847 8.562 1.00 22.49 C HETATM 5235 CGD HEM E 105 4.231 -4.959 9.504 1.00 25.11 C HETATM 5236 O1D HEM E 105 3.842 -6.042 9.021 1.00 25.19 O HETATM 5237 O2D HEM E 105 4.329 -4.751 10.733 1.00 23.02 O HETATM 5238 NA HEM E 105 2.110 0.954 5.686 1.00 23.78 N HETATM 5239 NB HEM E 105 3.533 3.057 4.416 1.00 23.91 N HETATM 5240 NC HEM E 105 5.819 1.465 4.326 1.00 24.02 N HETATM 5241 ND HEM E 105 4.388 -0.645 5.482 1.00 23.74 N HETATM 5242 FE HEM E 105 3.942 1.212 4.960 1.00 24.08 FE HETATM 0 HMA1 HEM E 105 -2.132 1.315 6.351 1.00 26.99 H new HETATM 0 HMA2 HEM E 105 -1.589 2.609 5.616 1.00 26.99 H new HETATM 0 HMA3 HEM E 105 -1.444 2.472 7.187 1.00 26.99 H new HETATM 0 HMB1 HEM E 105 1.384 6.751 3.574 1.00 20.59 H new HETATM 0 HMB2 HEM E 105 0.407 5.623 4.104 1.00 20.59 H new HETATM 0 HMB3 HEM E 105 0.850 5.637 2.583 1.00 20.59 H new HETATM 0 HMC1 HEM E 105 8.115 4.248 2.542 1.00 26.65 H new HETATM 0 HMC2 HEM E 105 9.251 3.174 2.288 1.00 26.65 H new HETATM 0 HMC3 HEM E 105 9.133 3.884 3.699 1.00 26.65 H new HETATM 0 HMD1 HEM E 105 7.037 -3.593 4.677 1.00 22.17 H new HETATM 0 HMD2 HEM E 105 6.122 -4.589 5.501 1.00 22.17 H new HETATM 0 HMD3 HEM E 105 7.185 -3.686 6.251 1.00 22.17 H new HETATM 0 HBB1 HEM E 105 4.263 8.503 3.641 1.00 26.34 H new HETATM 0 HBB2 HEM E 105 3.214 7.655 4.642 1.00 26.34 H new HETATM 0 HBC1 HEM E 105 11.147 0.237 2.913 1.00 25.52 H new HETATM 0 HBC2 HEM E 105 10.594 1.643 3.648 1.00 25.52 H new HETATM 0 HBA1 HEM E 105 -0.541 -2.533 6.029 1.00 27.91 H new HETATM 0 HBA2 HEM E 105 -1.595 -1.522 5.480 1.00 27.91 H new HETATM 0 HAA1 HEM E 105 -1.509 -0.380 7.592 1.00 27.97 H new HETATM 0 HAA2 HEM E 105 -0.345 -1.329 8.014 1.00 27.97 H new HETATM 0 HBD1 HEM E 105 4.504 -2.994 9.005 1.00 22.49 H new HETATM 0 HBD2 HEM E 105 5.584 -3.924 8.372 1.00 22.49 H new HETATM 0 HAD1 HEM E 105 4.008 -4.693 6.800 1.00 24.26 H new HETATM 0 HAD2 HEM E 105 2.920 -3.776 7.438 1.00 24.26 H new HETATM 0 HHA HEM E 105 1.880 -1.967 7.030 1.00 22.68 H new HETATM 0 HHB HEM E 105 0.351 3.507 4.808 1.00 23.56 H new HETATM 0 HHC HEM E 105 6.244 4.580 3.597 1.00 23.43 H new HETATM 0 HHD HEM E 105 7.342 -1.361 4.337 1.00 24.22 H new HETATM 0 HAB HEM E 105 4.887 6.441 2.541 1.00 27.53 H new HETATM 0 HAC HEM E 105 8.880 -0.536 2.652 1.00 24.84 H new HETATM 5243 O1 PG4 E1002 -5.299 1.418 19.737 1.00 49.51 O HETATM 5244 C1 PG4 E1002 -5.161 2.687 19.108 1.00 48.81 C HETATM 5245 C2 PG4 E1002 -4.340 3.592 20.004 1.00 48.73 C HETATM 5246 O2 PG4 E1002 -2.986 3.149 20.008 1.00 46.38 O HETATM 5247 C3 PG4 E1002 -2.182 3.977 20.839 1.00 45.41 C HETATM 5248 C4 PG4 E1002 -0.746 3.483 20.819 1.00 43.61 C HETATM 5249 O3 PG4 E1002 -0.704 2.130 21.255 1.00 41.46 O HETATM 5250 C5 PG4 E1002 0.630 1.637 21.250 1.00 42.42 C HETATM 5251 C6 PG4 E1002 0.644 0.194 21.715 1.00 37.61 C HETATM 5252 O4 PG4 E1002 -0.297 -0.526 20.941 1.00 36.99 O HETATM 5253 C7 PG4 E1002 -0.355 -1.891 21.307 1.00 37.31 C HETATM 5254 C8 PG4 E1002 -1.396 -2.566 20.444 1.00 36.89 C HETATM 5255 O5 PG4 E1002 -2.646 -1.901 20.654 1.00 35.91 O HETATM 0 HO5 PG4 E1002 -3.239 -2.262 20.180 1.00 35.91 H new HETATM 0 HO1 PG4 E1002 -5.754 0.910 19.247 1.00 49.51 H new HETATM 0 H82 PG4 E1002 -1.142 -2.522 19.509 1.00 36.89 H new HETATM 0 H81 PG4 E1002 -1.469 -3.506 20.674 1.00 36.89 H new HETATM 0 H72 PG4 E1002 0.511 -2.311 21.185 1.00 37.31 H new HETATM 0 H71 PG4 E1002 -0.584 -1.980 22.245 1.00 37.31 H new HETATM 0 H62 PG4 E1002 1.530 -0.187 21.611 1.00 37.61 H new HETATM 0 H61 PG4 E1002 0.420 0.139 22.657 1.00 37.61 H new HETATM 0 H52 PG4 E1002 1.005 1.702 20.358 1.00 42.42 H new HETATM 0 H51 PG4 E1002 1.186 2.179 21.831 1.00 42.42 H new HETATM 0 H42 PG4 E1002 -0.381 3.556 19.923 1.00 43.61 H new HETATM 0 H41 PG4 E1002 -0.195 4.036 21.395 1.00 43.61 H new HETATM 0 H32 PG4 E1002 -2.221 4.896 20.530 1.00 45.41 H new HETATM 0 H31 PG4 E1002 -2.524 3.968 21.747 1.00 45.41 H new HETATM 0 H22 PG4 E1002 -4.390 4.508 19.689 1.00 48.73 H new HETATM 0 H21 PG4 E1002 -4.697 3.582 20.906 1.00 48.73 H new HETATM 0 H12 PG4 E1002 -4.730 2.588 18.245 1.00 48.81 H new HETATM 0 H11 PG4 E1002 -6.034 3.078 18.946 1.00 48.81 H new HETATM 5256 C1 PEG E1011 8.894 -6.485 5.883 1.00 51.19 C HETATM 5257 O1 PEG E1011 8.372 -7.160 4.741 1.00 50.91 O HETATM 5258 C2 PEG E1011 7.957 -6.684 7.060 1.00 49.49 C HETATM 5259 O2 PEG E1011 7.812 -8.076 7.306 1.00 51.75 O HETATM 5260 C3 PEG E1011 6.943 -8.331 8.402 1.00 52.14 C HETATM 5261 C4 PEG E1011 6.824 -9.833 8.614 1.00 53.18 C HETATM 5262 O4 PEG E1011 7.957 -10.301 9.337 1.00 53.03 O HETATM 0 HO4 PEG E1011 8.608 -9.788 9.201 1.00 53.03 H new HETATM 0 HO1 PEG E1011 8.000 -6.604 4.233 1.00 50.91 H new HETATM 0 H42 PEG E1011 6.010 -10.037 9.101 1.00 53.18 H new HETATM 0 H41 PEG E1011 6.764 -10.286 7.759 1.00 53.18 H new HETATM 0 H32 PEG E1011 7.285 -7.907 9.205 1.00 52.14 H new HETATM 0 H31 PEG E1011 6.068 -7.948 8.230 1.00 52.14 H new HETATM 0 H22 PEG E1011 8.309 -6.240 7.847 1.00 49.49 H new HETATM 0 H21 PEG E1011 7.093 -6.285 6.872 1.00 49.49 H new HETATM 0 H12 PEG E1011 9.776 -6.827 6.098 1.00 51.19 H new HETATM 0 H11 PEG E1011 8.995 -5.539 5.694 1.00 51.19 H new HETATM 5263 CHA HEM F 105 21.098 12.152 5.793 1.00 23.28 C HETATM 5264 CHB HEM F 105 24.978 10.972 3.436 1.00 19.29 C HETATM 5265 CHC HEM F 105 23.230 6.692 2.485 1.00 20.18 C HETATM 5266 CHD HEM F 105 19.001 8.184 4.139 1.00 18.30 C HETATM 5267 C1A HEM F 105 22.403 12.124 5.345 1.00 21.37 C HETATM 5268 C2A HEM F 105 23.293 13.155 5.564 1.00 21.88 C HETATM 5269 C3A HEM F 105 24.399 12.810 4.845 1.00 22.16 C HETATM 5270 C4A HEM F 105 24.106 11.599 4.284 1.00 22.57 C HETATM 5271 CMA HEM F 105 25.673 13.633 4.688 1.00 24.94 C HETATM 5272 CAA HEM F 105 23.105 14.449 6.340 1.00 20.44 C HETATM 5273 CBA HEM F 105 22.299 15.471 5.525 1.00 24.15 C HETATM 5274 CGA HEM F 105 22.187 16.835 6.174 1.00 26.53 C HETATM 5275 O1A HEM F 105 21.724 17.766 5.477 1.00 26.23 O HETATM 5276 O2A HEM F 105 22.545 16.981 7.370 1.00 27.20 O HETATM 5277 C1B HEM F 105 24.836 9.704 2.942 1.00 20.10 C HETATM 5278 C2B HEM F 105 25.833 9.091 2.210 1.00 19.56 C HETATM 5279 C3B HEM F 105 25.378 7.807 2.047 1.00 19.24 C HETATM 5280 C4B HEM F 105 24.093 7.781 2.569 1.00 20.03 C HETATM 5281 CMB HEM F 105 27.159 9.702 1.712 1.00 21.26 C HETATM 5282 CAB HEM F 105 26.080 6.739 1.497 1.00 21.85 C HETATM 5283 CBB HEM F 105 27.244 6.160 2.187 1.00 18.10 C HETATM 5284 C1C HEM F 105 21.882 6.725 2.843 1.00 20.99 C HETATM 5285 C2C HEM F 105 21.019 5.686 2.580 1.00 19.89 C HETATM 5286 C3C HEM F 105 19.796 6.159 2.944 1.00 22.14 C HETATM 5287 C4C HEM F 105 19.976 7.395 3.537 1.00 18.35 C HETATM 5288 CMC HEM F 105 21.324 4.307 1.988 1.00 21.33 C HETATM 5289 CAC HEM F 105 18.658 5.412 2.687 1.00 22.71 C HETATM 5290 CBC HEM F 105 17.359 5.843 2.963 1.00 28.24 C HETATM 5291 C1D HEM F 105 19.214 9.438 4.752 1.00 20.84 C HETATM 5292 C2D HEM F 105 18.228 10.153 5.420 1.00 18.74 C HETATM 5293 C3D HEM F 105 18.894 11.190 6.043 1.00 20.41 C HETATM 5294 C4D HEM F 105 20.171 11.163 5.531 1.00 20.62 C HETATM 5295 CMD HEM F 105 16.724 9.864 5.510 1.00 20.08 C HETATM 5296 CAD HEM F 105 18.355 12.118 7.116 1.00 18.88 C HETATM 5297 CBD HEM F 105 18.113 11.383 8.410 1.00 20.95 C HETATM 5298 CGD HEM F 105 17.574 12.255 9.529 1.00 24.22 C HETATM 5299 O1D HEM F 105 16.846 13.228 9.243 1.00 25.23 O HETATM 5300 O2D HEM F 105 17.862 11.946 10.707 1.00 24.21 O HETATM 5301 NA HEM F 105 22.908 11.112 4.646 1.00 22.82 N HETATM 5302 NB HEM F 105 23.752 8.940 3.149 1.00 20.51 N HETATM 5303 NC HEM F 105 21.272 7.758 3.459 1.00 20.93 N HETATM 5304 ND HEM F 105 20.408 10.079 4.781 1.00 20.59 N HETATM 5305 FE HEM F 105 22.077 9.454 4.025 1.00 21.92 FE HETATM 0 HMA1 HEM F 105 25.461 14.576 4.768 1.00 24.94 H new HETATM 0 HMA2 HEM F 105 26.063 13.463 3.816 1.00 24.94 H new HETATM 0 HMA3 HEM F 105 26.306 13.384 5.379 1.00 24.94 H new HETATM 0 HMB1 HEM F 105 27.039 10.651 1.553 1.00 21.26 H new HETATM 0 HMB2 HEM F 105 27.426 9.268 0.887 1.00 21.26 H new HETATM 0 HMB3 HEM F 105 27.848 9.572 2.383 1.00 21.26 H new HETATM 0 HMC1 HEM F 105 20.693 3.658 2.336 1.00 21.33 H new HETATM 0 HMC2 HEM F 105 22.225 4.043 2.230 1.00 21.33 H new HETATM 0 HMC3 HEM F 105 21.248 4.345 1.022 1.00 21.33 H new HETATM 0 HMD1 HEM F 105 16.432 9.412 4.703 1.00 20.08 H new HETATM 0 HMD2 HEM F 105 16.239 10.699 5.606 1.00 20.08 H new HETATM 0 HMD3 HEM F 105 16.548 9.299 6.278 1.00 20.08 H new HETATM 0 HBB1 HEM F 105 27.722 5.416 1.790 1.00 18.10 H new HETATM 0 HBB2 HEM F 105 27.533 6.523 3.039 1.00 18.10 H new HETATM 0 HBC1 HEM F 105 16.604 5.270 2.758 1.00 28.24 H new HETATM 0 HBC2 HEM F 105 17.212 6.716 3.360 1.00 28.24 H new HETATM 0 HBA1 HEM F 105 21.407 15.120 5.377 1.00 24.15 H new HETATM 0 HBA2 HEM F 105 22.712 15.572 4.653 1.00 24.15 H new HETATM 0 HAA1 HEM F 105 23.971 14.822 6.566 1.00 20.44 H new HETATM 0 HAA2 HEM F 105 22.648 14.265 7.176 1.00 20.44 H new HETATM 0 HBD1 HEM F 105 18.945 10.978 8.701 1.00 20.95 H new HETATM 0 HBD2 HEM F 105 17.488 10.660 8.247 1.00 20.95 H new HETATM 0 HAD1 HEM F 105 17.527 12.521 6.811 1.00 18.88 H new HETATM 0 HAD2 HEM F 105 18.984 12.841 7.266 1.00 18.88 H new HETATM 0 HHA HEM F 105 20.827 12.881 6.302 1.00 23.28 H new HETATM 0 HHB HEM F 105 25.732 11.449 3.173 1.00 19.29 H new HETATM 0 HHC HEM F 105 23.575 5.888 2.169 1.00 20.18 H new HETATM 0 HHD HEM F 105 18.131 7.856 4.138 1.00 18.30 H new HETATM 0 HAB HEM F 105 25.798 6.370 0.645 1.00 21.85 H new HETATM 0 HAC HEM F 105 18.771 4.534 2.290 1.00 22.71 H new HETATM 5306 O1 PG4 F1003 29.781 14.801 17.906 1.00 41.49 O HETATM 5307 C1 PG4 F1003 30.491 13.705 18.485 1.00 41.68 C HETATM 5308 C2 PG4 F1003 29.565 12.508 18.626 1.00 41.96 C HETATM 5309 O2 PG4 F1003 28.419 12.878 19.389 1.00 43.42 O HETATM 5310 C3 PG4 F1003 27.519 11.783 19.558 1.00 44.65 C HETATM 5311 C4 PG4 F1003 26.314 12.232 20.373 1.00 45.09 C HETATM 5312 O3 PG4 F1003 25.800 13.423 19.790 1.00 47.71 O HETATM 5313 C5 PG4 F1003 24.665 13.928 20.478 1.00 49.06 C HETATM 5314 C6 PG4 F1003 24.213 15.202 19.779 1.00 50.66 C HETATM 5315 O4 PG4 F1003 25.231 16.190 19.942 1.00 52.35 O HETATM 5316 C7 PG4 F1003 24.894 17.424 19.319 1.00 54.46 C HETATM 5317 C8 PG4 F1003 26.022 18.423 19.540 1.00 53.19 C HETATM 5318 O5 PG4 F1003 27.249 17.874 19.058 1.00 54.61 O HETATM 0 HO5 PG4 F1003 27.217 17.036 19.102 1.00 54.61 H new HETATM 0 HO1 PG4 F1003 30.296 15.460 17.831 1.00 41.49 H new HETATM 0 H82 PG4 F1003 25.826 19.254 19.079 1.00 53.19 H new HETATM 0 H81 PG4 F1003 26.100 18.634 20.484 1.00 53.19 H new HETATM 0 H72 PG4 F1003 24.748 17.290 18.369 1.00 54.46 H new HETATM 0 H71 PG4 F1003 24.066 17.769 19.687 1.00 54.46 H new HETATM 0 H62 PG4 F1003 24.055 15.032 18.837 1.00 50.66 H new HETATM 0 H61 PG4 F1003 23.376 15.515 20.155 1.00 50.66 H new HETATM 0 H52 PG4 F1003 23.951 13.272 20.480 1.00 49.06 H new HETATM 0 H51 PG4 F1003 24.885 14.111 21.405 1.00 49.06 H new HETATM 0 H42 PG4 F1003 25.635 11.540 20.382 1.00 45.09 H new HETATM 0 H41 PG4 F1003 26.570 12.390 21.295 1.00 45.09 H new HETATM 0 H32 PG4 F1003 27.231 11.453 18.693 1.00 44.65 H new HETATM 0 H31 PG4 F1003 27.969 11.049 20.006 1.00 44.65 H new HETATM 0 H22 PG4 F1003 29.294 12.192 17.750 1.00 41.96 H new HETATM 0 H21 PG4 F1003 30.031 11.776 19.059 1.00 41.96 H new HETATM 0 H12 PG4 F1003 31.252 13.472 17.930 1.00 41.68 H new HETATM 0 H11 PG4 F1003 30.841 13.958 19.354 1.00 41.68 H new HETATM 5319 C1 PGE F1012 13.318 9.007 6.553 1.00 43.33 C HETATM 5320 O1 PGE F1012 12.304 8.747 5.582 1.00 44.40 O HETATM 5321 C2 PGE F1012 13.266 10.469 6.925 1.00 43.26 C HETATM 5322 O2 PGE F1012 12.821 10.593 8.264 1.00 42.14 O HETATM 5323 C3 PGE F1012 12.741 11.954 8.663 1.00 41.34 C HETATM 5324 C4 PGE F1012 12.265 12.014 10.102 1.00 40.95 C HETATM 5325 O4 PGE F1012 8.395 11.997 12.751 1.00 45.98 O HETATM 5326 C6 PGE F1012 8.924 12.552 11.546 1.00 45.84 C HETATM 5327 C5 PGE F1012 10.418 12.305 11.505 1.00 44.71 C HETATM 5328 O3 PGE F1012 10.861 12.246 10.150 1.00 42.61 O HETATM 0 HO4 PGE F1012 7.566 12.132 12.782 1.00 45.98 H new HETATM 0 HO1 PGE F1012 11.626 9.213 5.752 1.00 44.40 H new HETATM 0 H62 PGE F1012 8.496 12.148 10.775 1.00 45.84 H new HETATM 0 H6 PGE F1012 8.740 13.504 11.506 1.00 45.84 H new HETATM 0 H52 PGE F1012 10.884 13.013 11.976 1.00 44.71 H new HETATM 0 H5 PGE F1012 10.630 11.475 11.960 1.00 44.71 H new HETATM 0 H42 PGE F1012 12.477 11.182 10.554 1.00 40.95 H new HETATM 0 H4 PGE F1012 12.732 12.721 10.574 1.00 40.95 H new HETATM 0 H32 PGE F1012 13.608 12.380 8.578 1.00 41.34 H new HETATM 0 H3 PGE F1012 12.129 12.438 8.086 1.00 41.34 H new HETATM 0 H22 PGE F1012 14.143 10.871 6.826 1.00 43.26 H new HETATM 0 H2 PGE F1012 12.667 10.945 6.328 1.00 43.26 H new HETATM 0 H12 PGE F1012 13.181 8.455 7.339 1.00 43.33 H new HETATM 0 H1 PGE F1012 14.191 8.781 6.196 1.00 43.33 H new HETATM 5329 O HOH A 201 19.280 -10.379 5.123 1.00 22.23 O HETATM 5330 O HOH A 215 27.709 -13.173 15.338 1.00 18.23 O HETATM 5331 O HOH A 228 28.616 -6.152 14.770 1.00 24.57 O HETATM 5332 O HOH A 230 18.876 -3.127 9.921 1.00 26.51 O HETATM 5333 O HOH A 236 30.075 -5.420 -6.525 1.00 33.03 O HETATM 5334 O HOH A 238 26.667 -0.086 5.998 1.00 27.14 O HETATM 5335 O HOH A 243 29.600 -15.702 3.200 1.00 32.28 O HETATM 5336 O HOH A 245 24.115 -8.451 -4.043 1.00 24.91 O HETATM 5337 O HOH A 246 30.820 -3.853 -1.150 1.00 31.32 O HETATM 5338 O HOH A 254 30.152 -3.782 12.808 1.00 23.29 O HETATM 5339 O HOH A 286 21.109 1.051 2.845 1.00 25.01 O HETATM 5340 O HOH A 299 18.877 -9.950 18.384 1.00 41.69 O HETATM 5341 O HOH A 305 29.123 -17.169 17.043 1.00 43.00 O HETATM 5342 O HOH A 311 40.293 1.581 8.154 1.00 42.57 O HETATM 5343 O HOH A 315 28.831 -14.567 -2.111 1.00 37.46 O HETATM 5344 O HOH A 323 15.764 -1.810 -6.293 1.00 50.14 O HETATM 5345 O HOH A 330 41.240 2.040 5.113 1.00 35.55 O HETATM 5346 O HOH A 331 18.957 -9.265 -7.708 1.00 37.02 O HETATM 5347 O HOH A 333 20.274 -23.841 12.528 1.00 42.39 O HETATM 5348 O HOH A 336 43.968 5.568 2.552 1.00 35.99 O HETATM 5349 O HOH A 337 33.938 -0.240 4.635 1.00 55.99 O HETATM 5350 O HOH A 338 22.520 -0.839 17.877 1.00 54.01 O HETATM 5351 O HOH A 341 9.325 -19.019 -11.146 1.00 37.67 O HETATM 5352 O HOH A 343 13.990 -17.982 14.828 1.00 36.94 O HETATM 5353 O HOH A 348 8.130 -12.139 -7.169 1.00 38.26 O HETATM 5354 O HOH A 350 12.069 -27.889 -7.727 1.00 33.83 O HETATM 5355 O HOH A 356 16.516 -6.733 -9.004 1.00 34.12 O HETATM 5356 O HOH A 379 37.173 16.107 -4.485 1.00 33.30 O HETATM 5357 O HOH A 383 24.474 -8.231 -10.278 1.00 48.12 O HETATM 5358 O HOH A 384 12.300 -7.601 -7.772 1.00 44.30 O HETATM 5359 O HOH A 391 29.169 20.857 -1.340 1.00 39.04 O HETATM 5360 O HOH A 394 18.069 -20.914 18.665 1.00 51.79 O HETATM 5361 O HOH A 402 42.339 2.615 9.864 1.00 38.96 O HETATM 5362 O HOH A 404 39.128 23.112 -0.451 1.00 51.80 O HETATM 5363 O HOH A 412 38.124 8.484 10.276 1.00 43.87 O HETATM 5364 O HOH A 413 7.550 -11.419 4.883 1.00 37.62 O HETATM 5365 O HOH A 416 42.398 7.009 -1.053 1.00 36.39 O HETATM 5366 O HOH A 417 20.531 -5.644 14.568 1.00 34.73 O HETATM 5367 O HOH A 424 41.560 11.425 6.399 1.00 42.79 O HETATM 5368 O HOH A 426 30.903 -9.844 -6.760 1.00 43.53 O HETATM 5369 O HOH A 429 15.938 -20.449 20.463 1.00 44.03 O HETATM 5370 O HOH A 431 29.838 -26.768 10.341 1.00 42.57 O HETATM 5371 O HOH A 437 27.047 -14.301 0.724 1.00 41.92 O HETATM 5372 O HOH A 455 20.179 -11.764 -9.068 1.00 30.42 O HETATM 5373 O HOH A 457 32.233 -1.142 -1.622 1.00 50.43 O HETATM 5374 O HOH A 476 26.275 -4.407 14.293 1.00 20.70 O HETATM 5375 O HOH A 483 20.373 -2.453 -2.708 1.00 25.55 O HETATM 5376 O HOH A 485 11.959 -7.478 1.914 1.00 29.24 O HETATM 5377 O HOH A 487 43.865 6.549 5.073 1.00 40.90 O HETATM 5378 O HOH A 488 16.472 -17.169 13.950 1.00 32.64 O HETATM 5379 O HOH A 489 17.702 -18.133 15.967 1.00 31.38 O HETATM 5380 O HOH A 496 28.336 -2.949 3.733 1.00 39.34 O HETATM 5381 O HOH A 499 23.011 -11.240 8.403 1.00 18.97 O HETATM 5382 O HOH A 500 9.278 -6.277 -3.980 1.00 37.37 O HETATM 5383 O HOH A 501 19.656 -14.106 19.703 1.00 27.34 O HETATM 5384 O HOH A 505 25.965 -11.752 16.868 1.00 24.81 O HETATM 5385 O HOH A 515 33.274 -2.091 1.365 1.00 40.88 O HETATM 5386 O HOH A 532 45.063 8.127 7.351 1.00 35.90 O HETATM 5387 O HOH A 534 32.482 20.889 -2.248 1.00 35.24 O HETATM 5388 O HOH A 539 41.540 4.145 -2.709 1.00 32.87 O HETATM 5389 O HOH B 202 8.514 -8.411 33.399 1.00 23.24 O HETATM 5390 O HOH B 210 7.248 -14.646 24.217 1.00 20.21 O HETATM 5391 O HOH B 214 16.208 -10.112 36.668 1.00 25.65 O HETATM 5392 O HOH B 239 6.374 -9.958 18.391 1.00 35.90 O HETATM 5393 O HOH B 240 -0.095 -4.975 23.032 1.00 30.04 O HETATM 5394 O HOH B 251 -1.106 3.909 29.104 1.00 41.96 O HETATM 5395 O HOH B 255 -0.997 18.060 39.547 1.00 41.49 O HETATM 5396 O HOH B 257 4.882 -6.532 30.050 1.00 26.12 O HETATM 5397 O HOH B 258 11.951 -8.987 26.668 1.00 29.41 O HETATM 5398 O HOH B 260 9.587 -3.882 22.052 1.00 43.42 O HETATM 5399 O HOH B 273 13.905 -2.862 23.374 1.00 53.33 O HETATM 5400 O HOH B 276 -10.044 -13.130 26.745 1.00 53.53 O HETATM 5401 O HOH B 277 -4.507 2.638 26.699 1.00 48.49 O HETATM 5402 O HOH B 278 17.138 22.331 41.917 1.00 30.93 O HETATM 5403 O HOH B 283 3.412 1.084 24.046 1.00 29.18 O HETATM 5404 O HOH B 291 12.988 -2.057 28.786 1.00 31.47 O HETATM 5405 O HOH B 292 8.707 -16.861 22.676 1.00 39.25 O HETATM 5406 O HOH B 317 2.015 22.002 33.352 1.00 38.12 O HETATM 5407 O HOH B 319 5.086 -4.156 49.737 1.00 36.07 O HETATM 5408 O HOH B 324 -2.435 -5.111 42.715 1.00 39.65 O HETATM 5409 O HOH B 328 -4.004 -20.864 34.824 1.00 30.54 O HETATM 5410 O HOH B 329 1.977 5.205 22.889 1.00 42.67 O HETATM 5411 O HOH B 332 9.117 23.922 45.024 1.00 45.80 O HETATM 5412 O HOH B 335 2.338 -21.310 26.324 1.00 31.54 O HETATM 5413 O HOH B 340 11.886 -16.034 18.807 1.00 45.35 O HETATM 5414 O HOH B 351 12.944 1.386 29.492 1.00 37.59 O HETATM 5415 O HOH B 360 1.264 -24.227 37.773 1.00 42.27 O HETATM 5416 O HOH B 365 5.098 -27.569 44.725 1.00 43.32 O HETATM 5417 O HOH B 366 -4.301 -22.265 28.352 1.00 41.46 O HETATM 5418 O HOH B 372 6.469 -17.239 17.300 1.00 39.74 O HETATM 5419 O HOH B 377 2.033 1.407 45.504 1.00 45.00 O HETATM 5420 O HOH B 381 3.264 4.021 26.328 1.00 27.76 O HETATM 5421 O HOH B 390 5.204 -4.594 42.570 1.00 29.74 O HETATM 5422 O HOH B 399 7.440 -26.377 47.248 1.00 45.23 O HETATM 5423 O HOH B 405 10.190 -2.213 24.360 1.00 47.49 O HETATM 5424 O HOH B 407 8.379 4.343 32.373 1.00 29.07 O HETATM 5425 O HOH B 409 -4.787 3.867 23.912 1.00 42.50 O HETATM 5426 O HOH B 415 0.108 9.973 41.987 1.00 42.51 O HETATM 5427 O HOH B 421 17.545 28.706 46.371 1.00 46.35 O HETATM 5428 O HOH B 423 3.178 3.405 37.510 1.00 32.08 O HETATM 5429 O HOH B 427 2.598 -16.848 19.630 1.00 39.89 O HETATM 5430 O HOH B 430 19.290 18.153 50.496 1.00 44.52 O HETATM 5431 O HOH B 432 -3.653 0.269 35.648 1.00 44.03 O HETATM 5432 O HOH B 435 8.065 26.923 42.748 1.00 51.45 O HETATM 5433 O HOH B 440 14.890 -10.291 46.800 1.00 43.53 O HETATM 5434 O HOH B 447 12.201 14.472 50.290 1.00 45.80 O HETATM 5435 O HOH B 453 6.383 -7.692 49.890 1.00 53.47 O HETATM 5436 O HOH B 470 5.552 -14.444 21.839 1.00 33.66 O HETATM 5437 O HOH B 478 19.993 -16.873 35.229 1.00 24.53 O HETATM 5438 O HOH B 480 -1.823 2.115 32.744 1.00 31.10 O HETATM 5439 O HOH B 490 11.750 -1.782 41.677 1.00 30.77 O HETATM 5440 O HOH B 494 -8.144 -7.498 34.949 1.00 39.55 O HETATM 5441 O HOH B 495 -3.029 -7.024 35.264 1.00 36.98 O HETATM 5442 O HOH B 497 0.195 12.365 39.947 1.00 33.10 O HETATM 5443 O HOH B 502 6.200 -9.472 47.590 1.00 33.19 O HETATM 5444 O HOH B 503 -5.166 -5.552 28.050 1.00 29.47 O HETATM 5445 O HOH B 514 2.241 -4.852 21.775 1.00 31.28 O HETATM 5446 O HOH B 521 11.469 2.546 21.380 1.00 50.18 O HETATM 5447 O HOH B 522 12.099 -16.022 21.957 1.00 38.25 O HETATM 5448 O HOH B 526 -3.569 -22.136 30.923 1.00 30.01 O HETATM 5449 O HOH B 538 2.083 -20.535 23.989 1.00 32.91 O HETATM 5450 O HOH B 541 17.294 -15.933 33.239 1.00 31.73 O HETATM 5451 O HOH C 203 27.738 -6.077 32.160 1.00 27.63 O HETATM 5452 O HOH C 209 19.609 -4.595 28.395 1.00 17.68 O HETATM 5453 O HOH C 211 21.128 -13.484 22.091 1.00 22.72 O HETATM 5454 O HOH C 221 33.282 -2.741 22.944 1.00 18.67 O HETATM 5455 O HOH C 227 32.272 -17.157 31.991 1.00 23.95 O HETATM 5456 O HOH C 231 20.595 -18.108 37.967 1.00 26.95 O HETATM 5457 O HOH C 235 27.622 -9.575 28.435 1.00 17.74 O HETATM 5458 O HOH C 242 29.291 -4.821 17.193 1.00 25.90 O HETATM 5459 O HOH C 264 -3.504 -15.443 41.189 1.00 31.02 O HETATM 5460 O HOH C 265 31.212 -15.008 35.254 1.00 29.97 O HETATM 5461 O HOH C 271 23.318 -20.084 29.745 1.00 31.92 O HETATM 5462 O HOH C 272 25.899 0.762 36.627 1.00 27.92 O HETATM 5463 O HOH C 274 38.585 -9.359 21.582 1.00 34.63 O HETATM 5464 O HOH C 280 26.717 -1.426 25.796 1.00 30.47 O HETATM 5465 O HOH C 287 15.785 -4.180 24.771 1.00 42.08 O HETATM 5466 O HOH C 296 28.115 -13.477 20.611 1.00 20.92 O HETATM 5467 O HOH C 301 26.347 -12.370 40.646 1.00 26.87 O HETATM 5468 O HOH C 308 -3.694 -18.089 41.486 1.00 35.93 O HETATM 5469 O HOH C 321 1.218 -17.199 49.588 1.00 44.89 O HETATM 5470 O HOH C 339 29.779 7.705 36.233 1.00 29.82 O HETATM 5471 O HOH C 345 24.951 -3.889 19.272 1.00 42.91 O HETATM 5472 O HOH C 352 42.704 -21.503 24.337 1.00 39.74 O HETATM 5473 O HOH C 353 37.479 -16.175 19.258 1.00 45.61 O HETATM 5474 O HOH C 359 31.351 -0.656 14.508 1.00 47.85 O HETATM 5475 O HOH C 361 38.710 -18.244 23.687 1.00 33.54 O HETATM 5476 O HOH C 367 23.186 -18.218 42.732 1.00 39.18 O HETATM 5477 O HOH C 368 1.005 -23.787 42.457 1.00 27.64 O HETATM 5478 O HOH C 370 39.828 -14.648 23.495 1.00 27.74 O HETATM 5479 O HOH C 378 18.983 -15.350 24.124 1.00 37.44 O HETATM 5480 O HOH C 401 25.665 -5.902 47.046 1.00 48.55 O HETATM 5481 O HOH C 419 16.606 -12.491 31.529 1.00 31.31 O HETATM 5482 O HOH C 425 20.281 -2.852 39.890 1.00 50.87 O HETATM 5483 O HOH C 433 19.505 -14.593 33.416 1.00 28.52 O HETATM 5484 O HOH C 442 46.992 -1.215 42.839 1.00 52.19 O HETATM 5485 O HOH C 446 17.100 -0.952 38.145 1.00 43.96 O HETATM 5486 O HOH C 449 -5.874 -14.769 42.175 1.00 37.45 O HETATM 5487 O HOH C 451 40.746 -20.299 26.819 1.00 28.78 O HETATM 5488 O HOH C 461 19.693 -11.445 23.115 1.00 24.77 O HETATM 5489 O HOH C 466 33.955 -3.843 20.382 1.00 20.12 O HETATM 5490 O HOH C 492 3.280 -24.282 36.139 1.00 47.07 O HETATM 5491 O HOH C 504 32.042 -23.634 31.724 1.00 33.36 O HETATM 5492 O HOH C 506 26.897 -11.228 19.374 1.00 29.13 O HETATM 5493 O HOH C 507 16.378 -19.686 32.337 1.00 42.34 O HETATM 5494 O HOH C 508 6.574 -16.249 49.280 1.00 43.83 O HETATM 5495 O HOH C 525 47.419 -6.589 27.480 1.00 45.27 O HETATM 5496 O HOH C 528 1.208 -25.461 40.379 1.00 30.36 O HETATM 5497 O HOH C 529 16.609 -7.373 35.790 1.00 32.48 O HETATM 5498 O HOH C 545 35.219 -13.806 17.342 1.00 51.42 O HETATM 5499 O HOH D 204 16.467 8.938 33.473 1.00 26.36 O HETATM 5500 O HOH D 212 19.121 11.486 30.056 1.00 23.52 O HETATM 5501 O HOH D 216 24.861 19.897 27.570 1.00 24.32 O HETATM 5502 O HOH D 220 28.400 8.126 25.010 1.00 25.70 O HETATM 5503 O HOH D 224 10.380 13.659 25.212 1.00 25.68 O HETATM 5504 O HOH D 232 25.685 9.313 22.996 1.00 27.54 O HETATM 5505 O HOH D 233 22.011 15.329 22.759 1.00 26.67 O HETATM 5506 O HOH D 234 27.605 3.225 31.469 1.00 32.94 O HETATM 5507 O HOH D 247 23.206 18.433 35.151 1.00 28.38 O HETATM 5508 O HOH D 252 11.653 3.073 37.158 1.00 33.13 O HETATM 5509 O HOH D 259 19.968 27.227 25.975 1.00 40.19 O HETATM 5510 O HOH D 261 24.906 17.160 45.539 1.00 26.60 O HETATM 5511 O HOH D 263 10.499 1.172 43.471 1.00 33.06 O HETATM 5512 O HOH D 267 45.175 -6.927 40.288 1.00 24.27 O HETATM 5513 O HOH D 268 22.239 9.366 42.233 1.00 22.97 O HETATM 5514 O HOH D 270 10.741 6.834 21.941 1.00 67.50 O HETATM 5515 O HOH D 281 14.949 8.382 20.280 1.00 34.01 O HETATM 5516 O HOH D 284 41.830 7.542 30.198 1.00 41.60 O HETATM 5517 O HOH D 285 40.028 -14.443 37.701 1.00 23.61 O HETATM 5518 O HOH D 294 23.416 9.232 48.677 1.00 40.08 O HETATM 5519 O HOH D 298 19.044 2.185 28.519 1.00 29.86 O HETATM 5520 O HOH D 302 27.479 14.519 44.128 1.00 40.96 O HETATM 5521 O HOH D 303 12.900 30.064 31.484 1.00 42.88 O HETATM 5522 O HOH D 309 28.789 9.203 44.126 1.00 35.82 O HETATM 5523 O HOH D 310 45.010 -5.877 35.958 1.00 34.13 O HETATM 5524 O HOH D 312 22.647 2.047 20.960 1.00 41.48 O HETATM 5525 O HOH D 314 7.357 21.563 28.196 1.00 35.40 O HETATM 5526 O HOH D 320 5.226 5.651 34.481 1.00 32.39 O HETATM 5527 O HOH D 325 28.452 15.142 21.112 1.00 34.29 O HETATM 5528 O HOH D 326 12.588 6.735 26.986 1.00 29.70 O HETATM 5529 O HOH D 334 0.791 12.045 51.392 1.00 45.88 O HETATM 5530 O HOH D 342 2.884 14.140 23.466 1.00 45.48 O HETATM 5531 O HOH D 346 8.428 1.320 45.641 1.00 43.91 O HETATM 5532 O HOH D 355 29.919 15.923 31.810 1.00 50.77 O HETATM 5533 O HOH D 375 17.630 7.181 46.430 1.00 39.83 O HETATM 5534 O HOH D 385 37.095 -11.896 46.438 1.00 42.64 O HETATM 5535 O HOH D 388 7.109 22.642 39.889 1.00 40.92 O HETATM 5536 O HOH D 389 18.701 -0.503 40.840 1.00 42.68 O HETATM 5537 O HOH D 403 40.061 5.161 37.875 1.00 50.59 O HETATM 5538 O HOH D 414 40.858 -18.431 42.802 1.00 46.19 O HETATM 5539 O HOH D 434 36.738 -7.453 47.083 1.00 47.35 O HETATM 5540 O HOH D 445 25.165 19.246 42.857 1.00 43.05 O HETATM 5541 O HOH D 465 24.561 6.647 23.555 1.00 31.38 O HETATM 5542 O HOH D 472 23.451 0.040 35.210 1.00 26.33 O HETATM 5543 O HOH D 474 10.701 14.970 23.082 1.00 30.34 O HETATM 5544 O HOH D 475 13.733 12.690 19.118 1.00 21.67 O HETATM 5545 O HOH D 479 29.391 9.223 21.430 1.00 51.15 O HETATM 5546 O HOH D 481 19.645 25.645 23.408 1.00 47.23 O HETATM 5547 O HOH D 486 17.757 6.239 21.375 1.00 40.70 O HETATM 5548 O HOH D 509 24.865 16.615 41.926 1.00 39.50 O HETATM 5549 O HOH D 510 21.041 13.113 21.423 1.00 31.06 O HETATM 5550 O HOH D 516 30.612 4.567 25.692 1.00 56.57 O HETATM 5551 O HOH D 517 28.214 6.095 34.154 1.00 35.98 O HETATM 5552 O HOH D 518 20.739 26.509 28.398 1.00 31.87 O HETATM 5553 O HOH D 519 12.478 -0.401 43.922 1.00 41.83 O HETATM 5554 O HOH D 523 44.293 -3.652 34.890 1.00 25.94 O HETATM 5555 O HOH D 530 7.139 13.062 24.198 1.00 32.20 O HETATM 5556 O HOH D 531 42.310 -13.302 38.298 1.00 35.04 O HETATM 5557 O HOH D 540 21.350 2.593 40.989 1.00 31.18 O HETATM 5558 O HOH E 205 4.521 1.945 6.856 1.00 22.57 O HETATM 5559 O HOH E 208 2.596 -1.146 10.478 1.00 23.98 O HETATM 5560 O HOH E 217 0.520 6.352 18.743 1.00 24.00 O HETATM 5561 O HOH E 222 1.880 -3.541 19.140 1.00 21.34 O HETATM 5562 O HOH E 225 11.876 -1.498 10.483 1.00 21.40 O HETATM 5563 O HOH E 226 17.493 -26.712 -5.222 1.00 32.05 O HETATM 5564 O HOH E 249 13.022 -5.211 3.061 1.00 25.22 O HETATM 5565 O HOH E 262 17.664 -2.839 15.817 1.00 42.80 O HETATM 5566 O HOH E 279 -5.043 -0.889 20.672 1.00 45.12 O HETATM 5567 O HOH E 282 1.042 -3.766 -9.135 1.00 47.47 O HETATM 5568 O HOH E 288 10.009 -9.749 6.719 1.00 31.33 O HETATM 5569 O HOH E 295 -14.781 0.863 13.186 1.00 45.42 O HETATM 5570 O HOH E 297 10.167 -4.502 18.261 1.00 38.31 O HETATM 5571 O HOH E 304 9.555 -2.046 15.475 1.00 32.63 O HETATM 5572 O HOH E 306 13.028 -27.973 6.795 1.00 35.32 O HETATM 5573 O HOH E 307 -10.781 1.433 15.130 1.00 34.66 O HETATM 5574 O HOH E 318 -5.743 -6.724 13.239 1.00 39.06 O HETATM 5575 O HOH E 322 11.788 8.824 -3.267 1.00 45.03 O HETATM 5576 O HOH E 344 5.035 1.298 -6.696 1.00 57.02 O HETATM 5577 O HOH E 347 -3.121 -14.044 3.706 1.00 33.97 O HETATM 5578 O HOH E 349 -5.735 11.011 14.878 1.00 31.72 O HETATM 5579 O HOH E 362 8.899 12.687 6.546 1.00 38.84 O HETATM 5580 O HOH E 369 15.896 -1.312 14.552 1.00 51.37 O HETATM 5581 O HOH E 376 2.649 -3.189 -2.241 1.00 41.67 O HETATM 5582 O HOH E 386 -8.412 17.461 -3.086 1.00 38.36 O HETATM 5583 O HOH E 387 7.934 4.737 13.279 1.00 30.18 O HETATM 5584 O HOH E 396 -2.965 -11.408 5.444 1.00 43.49 O HETATM 5585 O HOH E 397 13.313 1.492 19.566 1.00 44.28 O HETATM 5586 O HOH E 400 5.673 -11.106 13.896 1.00 30.73 O HETATM 5587 O HOH E 406 -10.193 -5.881 1.561 1.00 51.65 O HETATM 5588 O HOH E 418 2.032 -9.858 -4.401 1.00 43.27 O HETATM 5589 O HOH E 420 -11.501 -1.661 15.787 1.00 45.44 O HETATM 5590 O HOH E 436 10.156 6.601 2.720 1.00 32.20 O HETATM 5591 O HOH E 438 15.047 -26.192 0.675 1.00 51.72 O HETATM 5592 O HOH E 439 12.743 -1.781 18.315 1.00 58.43 O HETATM 5593 O HOH E 441 10.747 -3.870 -4.012 1.00 34.32 O HETATM 5594 O HOH E 443 12.904 -1.127 15.767 1.00 56.62 O HETATM 5595 O HOH E 444 22.582 -17.795 -11.052 1.00 37.30 O HETATM 5596 O HOH E 448 7.901 -8.609 1.227 1.00 44.10 O HETATM 5597 O HOH E 454 14.527 1.812 13.837 1.00 52.42 O HETATM 5598 O HOH E 460 -8.803 -10.427 11.952 1.00 44.88 O HETATM 5599 O HOH E 463 1.461 7.220 16.323 1.00 35.20 O HETATM 5600 O HOH E 467 5.395 -8.502 16.322 1.00 25.57 O HETATM 5601 O HOH E 468 7.933 -7.716 15.264 1.00 29.07 O HETATM 5602 O HOH E 469 5.563 -12.735 17.389 1.00 37.07 O HETATM 5603 O HOH E 471 -0.598 -4.736 17.630 1.00 27.57 O HETATM 5604 O HOH E 482 9.620 -2.385 19.780 1.00 49.15 O HETATM 5605 O HOH E 493 10.767 15.029 3.859 1.00 40.88 O HETATM 5606 O HOH E 498 17.556 -16.966 -11.244 1.00 31.64 O HETATM 5607 O HOH E 512 3.345 3.041 22.014 1.00 31.26 O HETATM 5608 O HOH E 513 6.312 -21.230 -0.930 1.00 37.10 O HETATM 5609 O HOH E 520 11.513 -1.228 21.249 1.00 65.17 O HETATM 5610 O HOH E 527 -0.052 -11.819 8.372 1.00 33.90 O HETATM 5611 O HOH E 536 9.458 -2.792 -1.974 1.00 32.93 O HETATM 5612 O HOH E 542 16.927 -27.138 -0.694 1.00 38.69 O HETATM 5613 O HOH F 206 22.397 8.374 5.808 1.00 23.89 O HETATM 5614 O HOH F 207 7.945 14.566 8.431 1.00 39.59 O HETATM 5615 O HOH F 213 16.538 3.834 10.432 1.00 19.74 O HETATM 5616 O HOH F 218 18.131 13.066 -2.610 1.00 29.75 O HETATM 5617 O HOH F 219 29.553 -0.569 4.362 1.00 28.89 O HETATM 5618 O HOH F 223 21.456 15.871 17.462 1.00 24.51 O HETATM 5619 O HOH F 229 32.868 6.524 14.619 1.00 30.40 O HETATM 5620 O HOH F 237 15.147 13.061 16.792 1.00 25.69 O HETATM 5621 O HOH F 241 -9.791 1.914 0.880 1.00 30.81 O HETATM 5622 O HOH F 244 -10.055 11.804 -1.147 1.00 30.44 O HETATM 5623 O HOH F 248 26.617 8.529 20.369 1.00 21.71 O HETATM 5624 O HOH F 250 -2.679 21.283 1.339 1.00 32.74 O HETATM 5625 O HOH F 253 10.235 9.725 8.128 1.00 20.30 O HETATM 5626 O HOH F 256 12.378 16.902 -4.161 1.00 28.02 O HETATM 5627 O HOH F 266 11.712 4.810 3.720 1.00 20.09 O HETATM 5628 O HOH F 269 0.846 19.032 2.255 1.00 41.02 O HETATM 5629 O HOH F 275 23.271 -0.868 -4.615 1.00 35.16 O HETATM 5630 O HOH F 289 22.017 17.879 2.473 1.00 28.21 O HETATM 5631 O HOH F 290 -0.059 21.120 10.118 1.00 36.05 O HETATM 5632 O HOH F 293 30.825 9.627 16.422 1.00 22.12 O HETATM 5633 O HOH F 300 25.921 27.191 5.755 1.00 42.27 O HETATM 5634 O HOH F 313 1.615 20.039 12.152 1.00 40.51 O HETATM 5635 O HOH F 316 9.702 15.559 13.338 1.00 49.37 O HETATM 5636 O HOH F 327 5.941 16.554 7.788 1.00 37.18 O HETATM 5637 O HOH F 354 25.171 2.497 12.968 1.00 51.93 O HETATM 5638 O HOH F 357 13.143 7.178 -7.633 1.00 54.77 O HETATM 5639 O HOH F 358 23.489 5.952 18.792 1.00 36.57 O HETATM 5640 O HOH F 363 35.964 1.877 11.101 1.00 34.71 O HETATM 5641 O HOH F 364 5.377 14.758 3.680 1.00 29.85 O HETATM 5642 O HOH F 371 16.135 4.964 -6.305 1.00 42.37 O HETATM 5643 O HOH F 373 13.551 19.689 9.073 1.00 41.20 O HETATM 5644 O HOH F 374 11.667 12.695 5.530 1.00 31.15 O HETATM 5645 O HOH F 380 -7.491 13.758 4.662 1.00 34.19 O HETATM 5646 O HOH F 382 39.110 14.804 7.175 1.00 52.11 O HETATM 5647 O HOH F 392 10.186 9.052 4.034 1.00 45.90 O HETATM 5648 O HOH F 393 18.863 0.307 13.434 1.00 54.61 O HETATM 5649 O HOH F 395 10.560 21.228 6.316 1.00 39.54 O HETATM 5650 O HOH F 398 1.926 23.058 12.117 1.00 49.64 O HETATM 5651 O HOH F 408 -5.345 18.074 16.072 1.00 52.74 O HETATM 5652 O HOH F 410 31.770 3.119 15.200 1.00 40.89 O HETATM 5653 O HOH F 411 16.658 18.898 19.118 1.00 44.86 O HETATM 5654 O HOH F 422 21.788 21.091 -11.386 1.00 47.82 O HETATM 5655 O HOH F 428 14.503 10.275 15.836 1.00 31.63 O HETATM 5656 O HOH F 450 31.749 21.548 12.689 1.00 39.50 O HETATM 5657 O HOH F 452 9.017 16.387 16.573 1.00 51.45 O HETATM 5658 O HOH F 456 19.200 20.901 -0.864 1.00 38.69 O HETATM 5659 O HOH F 458 11.705 14.496 18.494 1.00 36.07 O HETATM 5660 O HOH F 459 32.933 19.957 14.449 1.00 33.22 O HETATM 5661 O HOH F 462 13.401 4.536 10.383 1.00 45.46 O HETATM 5662 O HOH F 464 30.195 -3.187 1.492 1.00 39.92 O HETATM 5663 O HOH F 473 21.193 13.439 18.668 1.00 20.29 O HETATM 5664 O HOH F 477 30.503 8.198 14.165 1.00 27.89 O HETATM 5665 O HOH F 484 20.510 -0.614 -4.872 1.00 44.60 O HETATM 5666 O HOH F 491 22.607 1.137 12.288 1.00 34.57 O HETATM 5667 O HOH F 511 12.271 13.929 14.958 1.00 31.94 O HETATM 5668 O HOH F 524 25.797 1.882 16.318 1.00 47.75 O HETATM 5669 O HOH F 533 -10.649 13.465 1.407 1.00 34.63 O HETATM 5670 O HOH F 535 18.977 23.749 18.328 1.00 46.17 O HETATM 5671 O HOH F 537 13.336 4.092 1.774 1.00 36.07 O HETATM 5672 O HOH F 543 21.869 11.813 9.721 1.00 28.28 O HETATM 5673 O HOH F 544 23.525 1.165 1.301 1.00 28.74 O CONECT 109 4964 CONECT 129 4971 CONECT 139 4987 CONECT 933 5027 CONECT 953 5034 CONECT 963 5050 CONECT 1757 5090 CONECT 1777 5097 CONECT 1787 5113 CONECT 2581 5153 CONECT 2601 5160 CONECT 2611 5176 CONECT 3405 5219 CONECT 3425 5226 CONECT 3435 5242 CONECT 4229 5282 CONECT 4249 5289 CONECT 4259 5305 CONECT 4945 4949 4976 CONECT 4946 4952 4959 CONECT 4947 4962 4966 CONECT 4948 4969 4973 CONECT 4949 4945 4950 4983 CONECT 4950 4949 4951 4954 CONECT 4951 4950 4952 4953 CONECT 4952 4946 4951 4983 CONECT 4953 4951 CONECT 4954 4950 4955 CONECT 4955 4954 4956 CONECT 4956 4955 4957 4958 CONECT 4957 4956 CONECT 4958 4956 CONECT 4959 4946 4960 4984 CONECT 4960 4959 4961 4963 CONECT 4961 4960 4962 4964 CONECT 4962 4947 4961 4984 CONECT 4963 4960 CONECT 4964 109 4961 4965 CONECT 4965 4964 CONECT 4966 4947 4967 4985 CONECT 4967 4966 4968 4970 CONECT 4968 4967 4969 4971 CONECT 4969 4948 4968 4985 CONECT 4970 4967 CONECT 4971 129 4968 4972 CONECT 4972 4971 CONECT 4973 4948 4974 4986 CONECT 4974 4973 4975 4977 CONECT 4975 4974 4976 4978 CONECT 4976 4945 4975 4986 CONECT 4977 4974 CONECT 4978 4975 4979 CONECT 4979 4978 4980 CONECT 4980 4979 4981 4982 CONECT 4981 4980 CONECT 4982 4980 CONECT 4983 4949 4952 4987 CONECT 4984 4959 4962 4987 CONECT 4985 4966 4969 4987 CONECT 4986 4973 4976 4987 CONECT 4987 139 4983 4984 4985 CONECT 4987 4986 5329 CONECT 4988 4989 CONECT 4989 4988 4990 CONECT 4990 4989 4991 CONECT 4991 4990 4992 CONECT 4992 4991 4993 CONECT 4993 4992 4994 CONECT 4994 4993 4995 CONECT 4995 4994 4996 CONECT 4996 4995 4997 CONECT 4997 4996 4998 CONECT 4998 4997 4999 CONECT 4999 4998 5000 CONECT 5000 4999 CONECT 5001 5002 5003 CONECT 5002 5001 CONECT 5003 5001 5004 CONECT 5004 5003 5005 CONECT 5005 5004 5006 CONECT 5006 5005 5007 CONECT 5007 5006 CONECT 5008 5012 5039 CONECT 5009 5015 5022 CONECT 5010 5025 5029 CONECT 5011 5032 5036 CONECT 5012 5008 5013 5046 CONECT 5013 5012 5014 5017 CONECT 5014 5013 5015 5016 CONECT 5015 5009 5014 5046 CONECT 5016 5014 CONECT 5017 5013 5018 CONECT 5018 5017 5019 CONECT 5019 5018 5020 5021 CONECT 5020 5019 CONECT 5021 5019 CONECT 5022 5009 5023 5047 CONECT 5023 5022 5024 5026 CONECT 5024 5023 5025 5027 CONECT 5025 5010 5024 5047 CONECT 5026 5023 CONECT 5027 933 5024 5028 CONECT 5028 5027 CONECT 5029 5010 5030 5048 CONECT 5030 5029 5031 5033 CONECT 5031 5030 5032 5034 CONECT 5032 5011 5031 5048 CONECT 5033 5030 CONECT 5034 953 5031 5035 CONECT 5035 5034 CONECT 5036 5011 5037 5049 CONECT 5037 5036 5038 5040 CONECT 5038 5037 5039 5041 CONECT 5039 5008 5038 5049 CONECT 5040 5037 CONECT 5041 5038 5042 CONECT 5042 5041 5043 CONECT 5043 5042 5044 5045 CONECT 5044 5043 CONECT 5045 5043 CONECT 5046 5012 5015 5050 CONECT 5047 5022 5025 5050 CONECT 5048 5029 5032 5050 CONECT 5049 5036 5039 5050 CONECT 5050 963 5046 5047 5048 CONECT 5050 5049 5389 CONECT 5051 5052 CONECT 5052 5051 5053 CONECT 5053 5052 5054 CONECT 5054 5053 5055 CONECT 5055 5054 5056 CONECT 5056 5055 5057 CONECT 5057 5056 5058 CONECT 5058 5057 5059 CONECT 5059 5058 5060 CONECT 5060 5059 5061 CONECT 5061 5060 5062 CONECT 5062 5061 5063 CONECT 5063 5062 CONECT 5064 5065 5066 CONECT 5065 5064 CONECT 5066 5064 5067 CONECT 5067 5066 5068 CONECT 5068 5067 5069 CONECT 5069 5068 5070 CONECT 5070 5069 CONECT 5071 5075 5102 CONECT 5072 5078 5085 CONECT 5073 5088 5092 CONECT 5074 5095 5099 CONECT 5075 5071 5076 5109 CONECT 5076 5075 5077 5080 CONECT 5077 5076 5078 5079 CONECT 5078 5072 5077 5109 CONECT 5079 5077 CONECT 5080 5076 5081 CONECT 5081 5080 5082 CONECT 5082 5081 5083 5084 CONECT 5083 5082 CONECT 5084 5082 CONECT 5085 5072 5086 5110 CONECT 5086 5085 5087 5089 CONECT 5087 5086 5088 5090 CONECT 5088 5073 5087 5110 CONECT 5089 5086 CONECT 5090 1757 5087 5091 CONECT 5091 5090 CONECT 5092 5073 5093 5111 CONECT 5093 5092 5094 5096 CONECT 5094 5093 5095 5097 CONECT 5095 5074 5094 5111 CONECT 5096 5093 CONECT 5097 1777 5094 5098 CONECT 5098 5097 CONECT 5099 5074 5100 5112 CONECT 5100 5099 5101 5103 CONECT 5101 5100 5102 5104 CONECT 5102 5071 5101 5112 CONECT 5103 5100 CONECT 5104 5101 5105 CONECT 5105 5104 5106 CONECT 5106 5105 5107 5108 CONECT 5107 5106 CONECT 5108 5106 CONECT 5109 5075 5078 5113 CONECT 5110 5085 5088 5113 CONECT 5111 5092 5095 5113 CONECT 5112 5099 5102 5113 CONECT 5113 1787 5109 5110 5111 CONECT 5113 5112 5451 CONECT 5114 5115 CONECT 5115 5114 5116 CONECT 5116 5115 5117 CONECT 5117 5116 5118 CONECT 5118 5117 5119 CONECT 5119 5118 5120 CONECT 5120 5119 5121 CONECT 5121 5120 5122 CONECT 5122 5121 5123 CONECT 5123 5122 5124 CONECT 5124 5123 5125 CONECT 5125 5124 5126 CONECT 5126 5125 CONECT 5127 5128 5129 CONECT 5128 5127 CONECT 5129 5127 5130 CONECT 5130 5129 5131 CONECT 5131 5130 5132 CONECT 5132 5131 5133 CONECT 5133 5132 CONECT 5134 5138 5165 CONECT 5135 5141 5148 CONECT 5136 5151 5155 CONECT 5137 5158 5162 CONECT 5138 5134 5139 5172 CONECT 5139 5138 5140 5143 CONECT 5140 5139 5141 5142 CONECT 5141 5135 5140 5172 CONECT 5142 5140 CONECT 5143 5139 5144 CONECT 5144 5143 5145 CONECT 5145 5144 5146 5147 CONECT 5146 5145 CONECT 5147 5145 CONECT 5148 5135 5149 5173 CONECT 5149 5148 5150 5152 CONECT 5150 5149 5151 5153 CONECT 5151 5136 5150 5173 CONECT 5152 5149 CONECT 5153 2581 5150 5154 CONECT 5154 5153 CONECT 5155 5136 5156 5174 CONECT 5156 5155 5157 5159 CONECT 5157 5156 5158 5160 CONECT 5158 5137 5157 5174 CONECT 5159 5156 CONECT 5160 2601 5157 5161 CONECT 5161 5160 CONECT 5162 5137 5163 5175 CONECT 5163 5162 5164 5166 CONECT 5164 5163 5165 5167 CONECT 5165 5134 5164 5175 CONECT 5166 5163 CONECT 5167 5164 5168 CONECT 5168 5167 5169 CONECT 5169 5168 5170 5171 CONECT 5170 5169 CONECT 5171 5169 CONECT 5172 5138 5141 5176 CONECT 5173 5148 5151 5176 CONECT 5174 5155 5158 5176 CONECT 5175 5162 5165 5176 CONECT 5176 2611 5172 5173 5174 CONECT 5176 5175 5499 CONECT 5177 5178 CONECT 5178 5177 5179 CONECT 5179 5178 5180 CONECT 5180 5179 5181 CONECT 5181 5180 5182 CONECT 5182 5181 5183 CONECT 5183 5182 5184 CONECT 5184 5183 5185 CONECT 5185 5184 5186 CONECT 5186 5185 5187 CONECT 5187 5186 5188 CONECT 5188 5187 5189 CONECT 5189 5188 CONECT 5190 5191 5192 CONECT 5191 5190 CONECT 5192 5190 5193 CONECT 5193 5192 5194 CONECT 5194 5193 5195 CONECT 5195 5194 5199 CONECT 5196 5197 CONECT 5197 5196 5198 CONECT 5198 5197 5199 CONECT 5199 5195 5198 CONECT 5200 5204 5231 CONECT 5201 5207 5214 CONECT 5202 5217 5221 CONECT 5203 5224 5228 CONECT 5204 5200 5205 5238 CONECT 5205 5204 5206 5209 CONECT 5206 5205 5207 5208 CONECT 5207 5201 5206 5238 CONECT 5208 5206 CONECT 5209 5205 5210 CONECT 5210 5209 5211 CONECT 5211 5210 5212 5213 CONECT 5212 5211 CONECT 5213 5211 CONECT 5214 5201 5215 5239 CONECT 5215 5214 5216 5218 CONECT 5216 5215 5217 5219 CONECT 5217 5202 5216 5239 CONECT 5218 5215 CONECT 5219 3405 5216 5220 CONECT 5220 5219 CONECT 5221 5202 5222 5240 CONECT 5222 5221 5223 5225 CONECT 5223 5222 5224 5226 CONECT 5224 5203 5223 5240 CONECT 5225 5222 CONECT 5226 3425 5223 5227 CONECT 5227 5226 CONECT 5228 5203 5229 5241 CONECT 5229 5228 5230 5232 CONECT 5230 5229 5231 5233 CONECT 5231 5200 5230 5241 CONECT 5232 5229 CONECT 5233 5230 5234 CONECT 5234 5233 5235 CONECT 5235 5234 5236 5237 CONECT 5236 5235 CONECT 5237 5235 CONECT 5238 5204 5207 5242 CONECT 5239 5214 5217 5242 CONECT 5240 5221 5224 5242 CONECT 5241 5228 5231 5242 CONECT 5242 3435 5238 5239 5240 CONECT 5242 5241 5558 CONECT 5243 5244 CONECT 5244 5243 5245 CONECT 5245 5244 5246 CONECT 5246 5245 5247 CONECT 5247 5246 5248 CONECT 5248 5247 5249 CONECT 5249 5248 5250 CONECT 5250 5249 5251 CONECT 5251 5250 5252 CONECT 5252 5251 5253 CONECT 5253 5252 5254 CONECT 5254 5253 5255 CONECT 5255 5254 CONECT 5256 5257 5258 CONECT 5257 5256 CONECT 5258 5256 5259 CONECT 5259 5258 5260 CONECT 5260 5259 5261 CONECT 5261 5260 5262 CONECT 5262 5261 CONECT 5263 5267 5294 CONECT 5264 5270 5277 CONECT 5265 5280 5284 CONECT 5266 5287 5291 CONECT 5267 5263 5268 5301 CONECT 5268 5267 5269 5272 CONECT 5269 5268 5270 5271 CONECT 5270 5264 5269 5301 CONECT 5271 5269 CONECT 5272 5268 5273 CONECT 5273 5272 5274 CONECT 5274 5273 5275 5276 CONECT 5275 5274 CONECT 5276 5274 CONECT 5277 5264 5278 5302 CONECT 5278 5277 5279 5281 CONECT 5279 5278 5280 5282 CONECT 5280 5265 5279 5302 CONECT 5281 5278 CONECT 5282 4229 5279 5283 CONECT 5283 5282 CONECT 5284 5265 5285 5303 CONECT 5285 5284 5286 5288 CONECT 5286 5285 5287 5289 CONECT 5287 5266 5286 5303 CONECT 5288 5285 CONECT 5289 4249 5286 5290 CONECT 5290 5289 CONECT 5291 5266 5292 5304 CONECT 5292 5291 5293 5295 CONECT 5293 5292 5294 5296 CONECT 5294 5263 5293 5304 CONECT 5295 5292 CONECT 5296 5293 5297 CONECT 5297 5296 5298 CONECT 5298 5297 5299 5300 CONECT 5299 5298 CONECT 5300 5298 CONECT 5301 5267 5270 5305 CONECT 5302 5277 5280 5305 CONECT 5303 5284 5287 5305 CONECT 5304 5291 5294 5305 CONECT 5305 4259 5301 5302 5303 CONECT 5305 5304 5613 CONECT 5306 5307 CONECT 5307 5306 5308 CONECT 5308 5307 5309 CONECT 5309 5308 5310 CONECT 5310 5309 5311 CONECT 5311 5310 5312 CONECT 5312 5311 5313 CONECT 5313 5312 5314 CONECT 5314 5313 5315 CONECT 5315 5314 5316 CONECT 5316 5315 5317 CONECT 5317 5316 5318 CONECT 5318 5317 CONECT 5319 5320 5321 CONECT 5320 5319 CONECT 5321 5319 5322 CONECT 5322 5321 5323 CONECT 5323 5322 5324 CONECT 5324 5323 5328 CONECT 5325 5326 CONECT 5326 5325 5327 CONECT 5327 5326 5328 CONECT 5328 5324 5327 CONECT 5329 4987 CONECT 5389 5050 CONECT 5451 5113 CONECT 5499 5176 CONECT 5558 5242 CONECT 5613 5305 END