USER MOD reduce.3.24.130724 H: found=0, std=0, add=3037, rem=0, adj=99 USER MOD reduce.3.24.130724 removed 0 hydrogens (0 hets) HEADER METAL BINDING PROTEIN 17-NOV-00 1G8I TITLE CRYSTAL STRUCTURE OF HUMAN FREQUENIN (NEURONAL CALCIUM TITLE 2 SENSOR 1) COMPND MOL_ID: 1; COMPND 2 MOLECULE: NEURONAL CALCIUM SENSOR 1; COMPND 3 CHAIN: A, B; COMPND 4 SYNONYM: FREQUENIN; COMPND 5 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 3 ORGANISM_COMMON: HUMAN; SOURCE 4 ORGANISM_TAXID: 9606; SOURCE 5 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21; SOURCE 6 EXPRESSION_SYSTEM_TAXID: 511693; SOURCE 7 EXPRESSION_SYSTEM_STRAIN: BL21; SOURCE 8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 9 EXPRESSION_SYSTEM_PLASMID: PET KEYWDS CALCIUM BINDING-PROTEIN, EF-HAND, CALCIUM ION, METAL KEYWDS 2 BINDING PROTEIN EXPDTA X-RAY DIFFRACTION AUTHOR Y.BOURNE,J.DANNENBERG,V.POLLMANN,P.MARCHOT,O.PONGS REVDAT 2 24-FEB-09 1G8I 1 VERSN REVDAT 1 09-MAY-01 1G8I 0 JRNL AUTH Y.BOURNE,J.DANNENBERG,V.POLLMANN,P.MARCHOT,O.PONGS JRNL TITL IMMUNOCYTOCHEMICAL LOCALIZATION AND CRYSTAL JRNL TITL 2 STRUCTURE OF HUMAN FREQUENIN (NEURONAL CALCIUM JRNL TITL 3 SENSOR 1). JRNL REF J.BIOL.CHEM. V. 276 11949 2001 JRNL REFN ISSN 0021-9258 JRNL PMID 11092894 JRNL DOI 10.1074/JBC.M009373200 REMARK 1 REMARK 2 REMARK 2 RESOLUTION. 1.90 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : CNS 1.0 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 : NULL REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 1.90 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 38.75 REMARK 3 DATA CUTOFF (SIGMA(F)) : 0.000 REMARK 3 DATA CUTOFF HIGH (ABS(F)) : 847282.850 REMARK 3 DATA CUTOFF LOW (ABS(F)) : 0.0000 REMARK 3 COMPLETENESS (WORKING+TEST) (%) : 98.8 REMARK 3 NUMBER OF REFLECTIONS : 35876 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) : 0.220 REMARK 3 FREE R VALUE : 0.263 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 3.000 REMARK 3 FREE R VALUE TEST SET COUNT : 1081 REMARK 3 ESTIMATED ERROR OF FREE R VALUE : 0.008 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) : 1.90 REMARK 3 BIN RESOLUTION RANGE LOW (A) : 2.02 REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : 98.70 REMARK 3 REFLECTIONS IN BIN (WORKING SET) : 5710 REMARK 3 BIN R VALUE (WORKING SET) : 0.2750 REMARK 3 BIN FREE R VALUE : 0.3050 REMARK 3 BIN FREE R VALUE TEST SET SIZE (%) : 3.40 REMARK 3 BIN FREE R VALUE TEST SET COUNT : 199 REMARK 3 ESTIMATED ERROR OF BIN FREE R VALUE : 0.022 REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 3015 REMARK 3 NUCLEIC ACID ATOMS : 0 REMARK 3 HETEROGEN ATOMS : 77 REMARK 3 SOLVENT ATOMS : 283 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : 19.90 REMARK 3 MEAN B VALUE (OVERALL, A**2) : 28.50 REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : 2.31000 REMARK 3 B22 (A**2) : -8.65000 REMARK 3 B33 (A**2) : 6.34000 REMARK 3 B12 (A**2) : 0.00000 REMARK 3 B13 (A**2) : -6.86000 REMARK 3 B23 (A**2) : 0.00000 REMARK 3 REMARK 3 ESTIMATED COORDINATE ERROR. REMARK 3 ESD FROM LUZZATI PLOT (A) : 0.24 REMARK 3 ESD FROM SIGMAA (A) : 0.21 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) : 0.28 REMARK 3 ESD FROM C-V SIGMAA (A) : 0.21 REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES. REMARK 3 BOND LENGTHS (A) : 0.015 REMARK 3 BOND ANGLES (DEGREES) : 1.60 REMARK 3 DIHEDRAL ANGLES (DEGREES) : 21.00 REMARK 3 IMPROPER ANGLES (DEGREES) : 1.04 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) : 1.580 ; 1.500 REMARK 3 MAIN-CHAIN ANGLE (A**2) : 2.400 ; 2.000 REMARK 3 SIDE-CHAIN BOND (A**2) : 2.320 ; 2.000 REMARK 3 SIDE-CHAIN ANGLE (A**2) : 3.520 ; 2.500 REMARK 3 REMARK 3 BULK SOLVENT MODELING. REMARK 3 METHOD USED : FLAT MODEL REMARK 3 KSOL : 0.35 REMARK 3 BSOL : 41.38 REMARK 3 REMARK 3 NCS MODEL : CONSTRAINED 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 : WATER_REP.PARAM REMARK 3 PARAMETER FILE 3 : ION.PARAM REMARK 3 PARAMETER FILE 4 : LIG.PAR REMARK 3 PARAMETER FILE 5 : NULL REMARK 3 TOPOLOGY FILE 1 : PROTEIN.TOP REMARK 3 TOPOLOGY FILE 2 : WATER.TOP REMARK 3 TOPOLOGY FILE 3 : ION.TOP REMARK 3 TOPOLOGY FILE 4 : LIG.TOP REMARK 3 TOPOLOGY FILE 5 : NULL REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 1G8I COMPLIES WITH FORMAT V. 3.15, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 29-NOV-00. REMARK 100 THE RCSB ID CODE IS RCSB012365. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 12-JUL-00 REMARK 200 TEMPERATURE (KELVIN) : 100 REMARK 200 PH : 6.5 REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : Y REMARK 200 RADIATION SOURCE : ESRF REMARK 200 BEAMLINE : ID14-2 REMARK 200 X-RAY GENERATOR MODEL : NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 0.93 REMARK 200 MONOCHROMATOR : NULL REMARK 200 OPTICS : NULL REMARK 200 REMARK 200 DETECTOR TYPE : CCD REMARK 200 DETECTOR MANUFACTURER : ADSC QUANTUM 4 REMARK 200 INTENSITY-INTEGRATION SOFTWARE : DENZO REMARK 200 DATA SCALING SOFTWARE : CCP4 (SCALA) REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 34949 REMARK 200 RESOLUTION RANGE HIGH (A) : 1.900 REMARK 200 RESOLUTION RANGE LOW (A) : 40.000 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : 2.000 REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 99.0 REMARK 200 DATA REDUNDANCY : 3.300 REMARK 200 R MERGE (I) : NULL REMARK 200 R SYM (I) : 6.00000 REMARK 200 FOR THE DATA SET : 8.9000 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 1.90 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 1.95 REMARK 200 COMPLETENESS FOR SHELL (%) : 98.9 REMARK 200 DATA REDUNDANCY IN SHELL : 3.40 REMARK 200 R MERGE FOR SHELL (I) : NULL REMARK 200 R SYM FOR SHELL (I) : 34.00000 REMARK 200 FOR SHELL : 2.000 REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REPLACEMENT REMARK 200 SOFTWARE USED: AMORE REMARK 200 STARTING MODEL: PDB ENTRY 1BJF REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 53.44 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.64 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: 30% PEG 8K, 0.1 M NACACODYLATE, 0.2 REMARK 280 M NAAC, PH 6.5, VAPOR DIFFUSION, SITTING DROP, TEMPERATURE 298K REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 1 21 1 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -X,Y+1/2,-Z REMARK 290 REMARK 290 WHERE NNN -> OPERATOR NUMBER REMARK 290 MMM -> TRANSLATION VECTOR REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY REMARK 290 RELATED MOLECULES. REMARK 290 SMTRY1 1 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 1 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 1 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 2 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 2 0.000000 1.000000 0.000000 27.76200 REMARK 290 SMTRY3 2 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: MONOMERIC REMARK 350 APPLY THE FOLLOWING TO CHAINS: A REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 350 REMARK 350 BIOMOLECULE: 2 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: MONOMERIC REMARK 350 APPLY THE FOLLOWING TO CHAINS: B REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 465 REMARK 465 MISSING RESIDUES REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE REMARK 465 EXPERIMENT. (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 465 IDENTIFIER; SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.) REMARK 465 REMARK 465 M RES C SSSEQI REMARK 465 MET A 1 REMARK 465 GLY A 2 REMARK 465 LYS A 3 REMARK 465 GLY A 133 REMARK 465 ASN A 134 REMARK 465 THR A 135 REMARK 465 VAL A 136 REMARK 465 GLU A 137 REMARK 465 MET B 1 REMARK 465 GLY B 2 REMARK 465 LEU B 189 REMARK 465 VAL B 190 REMARK 470 REMARK 470 MISSING ATOM REMARK 470 THE FOLLOWING RESIDUES HAVE MISSING ATOMS(M=MODEL NUMBER; REMARK 470 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE NUMBER; REMARK 470 I=INSERTION CODE): REMARK 470 M RES CSSEQI ATOMS REMARK 470 LYS B 3 CG CD CE NZ REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: CLOSE CONTACTS IN SAME ASYMMETRIC UNIT REMARK 500 REMARK 500 THE FOLLOWING ATOMS ARE IN CLOSE CONTACT. REMARK 500 REMARK 500 ATM1 RES C SSEQI ATM2 RES C SSEQI DISTANCE REMARK 500 NE2 GLN A 181 O HOH A 672 2.15 REMARK 500 O HOH A 606 O HOH A 727 2.19 REMARK 500 NH2 ARG A 102 O HOH A 758 2.19 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: CLOSE CONTACTS REMARK 500 REMARK 500 THE FOLLOWING ATOMS THAT ARE RELATED BY CRYSTALLOGRAPHIC REMARK 500 SYMMETRY ARE IN CLOSE CONTACT. AN ATOM LOCATED WITHIN 0.15 REMARK 500 ANGSTROMS OF A SYMMETRY RELATED ATOM IS ASSUMED TO BE ON A REMARK 500 SPECIAL POSITION AND IS, THEREFORE, LISTED IN REMARK 375 REMARK 500 INSTEAD OF REMARK 500. ATOMS WITH NON-BLANK ALTERNATE REMARK 500 LOCATION INDICATORS ARE NOT INCLUDED IN THE CALCULATIONS. REMARK 500 REMARK 500 DISTANCE CUTOFF: REMARK 500 2.2 ANGSTROMS FOR CONTACTS NOT INVOLVING HYDROGEN ATOMS REMARK 500 1.6 ANGSTROMS FOR CONTACTS INVOLVING HYDROGEN ATOMS REMARK 500 REMARK 500 ATM1 RES C SSEQI ATM2 RES C SSEQI SSYMOP DISTANCE REMARK 500 O ALA A 160 OG SER B 6 2655 2.19 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 ASN A 5 -28.57 79.57 REMARK 500 SER A 6 15.80 -55.17 REMARK 500 SER B 4 -16.39 82.47 REMARK 500 ASN B 134 55.39 -115.92 REMARK 500 ALA B 160 50.07 39.22 REMARK 500 REMARK 500 REMARK: NULL REMARK 525 REMARK 525 SOLVENT REMARK 525 REMARK 525 THE SOLVENT MOLECULES HAVE CHAIN IDENTIFIERS THAT REMARK 525 INDICATE THE POLYMER CHAIN WITH WHICH THEY ARE MOST REMARK 525 CLOSELY ASSOCIATED. THE REMARK LISTS ALL THE SOLVENT REMARK 525 MOLECULES WHICH ARE MORE THAN 5A AWAY FROM THE REMARK 525 NEAREST POLYMER CHAIN (M = MODEL NUMBER; REMARK 525 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE REMARK 525 NUMBER; I=INSERTION CODE): REMARK 525 REMARK 525 M RES CSSEQI REMARK 525 HOH A 715 DISTANCE = 6.67 ANGSTROMS REMARK 610 REMARK 610 MISSING HETEROATOM REMARK 610 THE FOLLOWING RESIDUES HAVE MISSING ATOMS (M=MODEL NUMBER; REMARK 610 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE NUMBER; REMARK 610 I=INSERTION CODE): REMARK 610 M RES C SSEQI REMARK 610 1PE A 951 REMARK 610 1PE A 952 REMARK 610 1PE B 953 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 NA A1596 NA REMARK 620 N RES CSSEQI ATOM REMARK 620 1 HOH A 501 O REMARK 620 2 ALA A 175 O 79.3 REMARK 620 N 1 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 CA A1597 CA REMARK 620 N RES CSSEQI ATOM REMARK 620 1 HOH A 733 O REMARK 620 2 ASP A 73 OD1 158.6 REMARK 620 3 ASN A 75 OD1 73.5 86.1 REMARK 620 4 ASP A 77 OD1 92.1 82.5 93.3 REMARK 620 5 ARG A 79 O 110.9 88.4 170.8 78.6 REMARK 620 6 GLU A 84 OE1 82.0 108.6 100.5 162.7 88.2 REMARK 620 7 GLU A 84 OE2 77.6 95.5 52.9 146.2 135.2 48.3 REMARK 620 N 1 2 3 4 5 6 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 CA A1598 CA REMARK 620 N RES CSSEQI ATOM REMARK 620 1 ASP A 111 OD2 REMARK 620 2 ASP A 113 OD1 80.9 REMARK 620 3 ASP A 109 OD1 82.1 89.9 REMARK 620 4 HOH A 507 O 83.6 79.0 163.1 REMARK 620 5 GLU A 120 OE1 120.3 155.4 104.4 90.6 REMARK 620 6 GLU A 120 OE2 70.2 148.7 97.5 86.0 50.1 REMARK 620 7 TYR A 115 O 158.2 82.9 83.4 107.5 79.1 128.0 REMARK 620 N 1 2 3 4 5 6 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 CA A1599 CA REMARK 620 N RES CSSEQI ATOM REMARK 620 1 HOH A 565 O REMARK 620 2 LYS A 163 O 90.8 REMARK 620 3 GLU A 168 OE1 90.0 80.2 REMARK 620 4 GLU A 168 OE2 108.0 128.3 53.1 REMARK 620 5 ASN A 159 OD1 87.4 152.0 127.7 78.4 REMARK 620 6 ASP A 157 OD1 158.6 87.4 110.7 89.7 84.2 REMARK 620 7 ASP A 161 OD1 74.8 78.5 153.5 152.2 74.0 84.0 REMARK 620 N 1 2 3 4 5 6 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 NA B1595 NA REMARK 620 N RES CSSEQI ATOM REMARK 620 1 THR B 17 O REMARK 620 2 THR B 20 O 84.6 REMARK 620 3 PHE B 22 O 111.0 118.8 REMARK 620 4 HOH B 568 O 86.7 121.2 118.6 REMARK 620 N 1 2 3 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 CA B1600 CA REMARK 620 N RES CSSEQI ATOM REMARK 620 1 HOH B 696 O REMARK 620 2 GLU B 84 OE1 83.1 REMARK 620 3 GLU B 84 OE2 96.9 50.3 REMARK 620 4 ASP B 73 OD1 165.4 103.4 97.3 REMARK 620 5 ASN B 75 OD1 101.5 120.9 70.9 86.6 REMARK 620 6 ASP B 77 OD2 85.0 151.4 157.6 83.2 86.9 REMARK 620 7 ARG B 79 O 88.9 78.6 127.0 79.7 158.6 75.2 REMARK 620 N 1 2 3 4 5 6 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 CA B1601 CA REMARK 620 N RES CSSEQI ATOM REMARK 620 1 GLU B 120 OE2 REMARK 620 2 ASP B 109 OD1 100.7 REMARK 620 3 ASP B 111 OD1 75.8 77.9 REMARK 620 4 ASP B 113 OD1 151.0 78.3 75.6 REMARK 620 5 TYR B 115 O 133.6 81.3 147.0 75.3 REMARK 620 6 HOH B 583 O 85.1 155.9 80.9 85.4 111.7 REMARK 620 7 GLU B 120 OE1 53.9 109.0 129.7 154.2 81.3 93.4 REMARK 620 N 1 2 3 4 5 6 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 CA B1602 CA REMARK 620 N RES CSSEQI ATOM REMARK 620 1 GLU B 168 OE1 REMARK 620 2 ASP B 157 OD1 119.9 REMARK 620 3 ASN B 159 OD1 107.2 87.4 REMARK 620 4 GLU B 168 OE2 51.5 85.5 68.2 REMARK 620 5 HOH B 701 O 75.5 164.1 83.5 103.1 REMARK 620 6 ASP B 161 OD1 155.3 81.4 84.6 150.3 84.7 REMARK 620 7 LYS B 163 O 86.4 89.6 165.8 125.4 96.1 81.1 REMARK 620 N 1 2 3 4 5 6 REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE NA B 1595 REMARK 800 SITE_IDENTIFIER: AC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE NA A 1596 REMARK 800 SITE_IDENTIFIER: AC3 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE CA A 1597 REMARK 800 SITE_IDENTIFIER: AC4 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE CA A 1598 REMARK 800 SITE_IDENTIFIER: AC5 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE CA A 1599 REMARK 800 SITE_IDENTIFIER: AC6 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE CA B 1600 REMARK 800 SITE_IDENTIFIER: AC7 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE CA B 1601 REMARK 800 SITE_IDENTIFIER: AC8 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE CA B 1602 REMARK 800 SITE_IDENTIFIER: AC9 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE 1PE A 951 REMARK 800 SITE_IDENTIFIER: BC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE 1PE A 952 REMARK 800 SITE_IDENTIFIER: BC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE 1PE B 953 REMARK 800 SITE_IDENTIFIER: BC3 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE P6G A 954 REMARK 800 SITE_IDENTIFIER: BC4 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE EDO A 901 REMARK 800 SITE_IDENTIFIER: BC5 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE EDO B 902 REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 1REC RELATED DB: PDB REMARK 900 RELATED ID: 1BJF RELATED DB: PDB DBREF 1G8I A 1 190 UNP P62166 NCS1_HUMAN 1 190 DBREF 1G8I B 1 190 UNP P62166 NCS1_HUMAN 1 190 SEQRES 1 A 190 MET GLY LYS SER ASN SER LYS LEU LYS PRO GLU VAL VAL SEQRES 2 A 190 GLU GLU LEU THR ARG LYS THR TYR PHE THR GLU LYS GLU SEQRES 3 A 190 VAL GLN GLN TRP TYR LYS GLY PHE ILE LYS ASP CYS PRO SEQRES 4 A 190 SER GLY GLN LEU ASP ALA ALA GLY PHE GLN LYS ILE TYR SEQRES 5 A 190 LYS GLN PHE PHE PRO PHE GLY ASP PRO THR LYS PHE ALA SEQRES 6 A 190 THR PHE VAL PHE ASN VAL PHE ASP GLU ASN LYS ASP GLY SEQRES 7 A 190 ARG ILE GLU PHE SER GLU PHE ILE GLN ALA LEU SER VAL SEQRES 8 A 190 THR SER ARG GLY THR LEU ASP GLU LYS LEU ARG TRP ALA SEQRES 9 A 190 PHE LYS LEU TYR ASP LEU ASP ASN ASP GLY TYR ILE THR SEQRES 10 A 190 ARG ASN GLU MET LEU ASP ILE VAL ASP ALA ILE TYR GLN SEQRES 11 A 190 MET VAL GLY ASN THR VAL GLU LEU PRO GLU GLU GLU ASN SEQRES 12 A 190 THR PRO GLU LYS ARG VAL ASP ARG ILE PHE ALA MET MET SEQRES 13 A 190 ASP LYS ASN ALA ASP GLY LYS LEU THR LEU GLN GLU PHE SEQRES 14 A 190 GLN GLU GLY SER LYS ALA ASP PRO SER ILE VAL GLN ALA SEQRES 15 A 190 LEU SER LEU TYR ASP GLY LEU VAL SEQRES 1 B 190 MET GLY LYS SER ASN SER LYS LEU LYS PRO GLU VAL VAL SEQRES 2 B 190 GLU GLU LEU THR ARG LYS THR TYR PHE THR GLU LYS GLU SEQRES 3 B 190 VAL GLN GLN TRP TYR LYS GLY PHE ILE LYS ASP CYS PRO SEQRES 4 B 190 SER GLY GLN LEU ASP ALA ALA GLY PHE GLN LYS ILE TYR SEQRES 5 B 190 LYS GLN PHE PHE PRO PHE GLY ASP PRO THR LYS PHE ALA SEQRES 6 B 190 THR PHE VAL PHE ASN VAL PHE ASP GLU ASN LYS ASP GLY SEQRES 7 B 190 ARG ILE GLU PHE SER GLU PHE ILE GLN ALA LEU SER VAL SEQRES 8 B 190 THR SER ARG GLY THR LEU ASP GLU LYS LEU ARG TRP ALA SEQRES 9 B 190 PHE LYS LEU TYR ASP LEU ASP ASN ASP GLY TYR ILE THR SEQRES 10 B 190 ARG ASN GLU MET LEU ASP ILE VAL ASP ALA ILE TYR GLN SEQRES 11 B 190 MET VAL GLY ASN THR VAL GLU LEU PRO GLU GLU GLU ASN SEQRES 12 B 190 THR PRO GLU LYS ARG VAL ASP ARG ILE PHE ALA MET MET SEQRES 13 B 190 ASP LYS ASN ALA ASP GLY LYS LEU THR LEU GLN GLU PHE SEQRES 14 B 190 GLN GLU GLY SER LYS ALA ASP PRO SER ILE VAL GLN ALA SEQRES 15 B 190 LEU SER LEU TYR ASP GLY LEU VAL HET NA B1595 1 HET NA A1596 1 HET CA A1597 1 HET CA A1598 1 HET CA A1599 1 HET CA B1600 1 HET CA B1601 1 HET CA B1602 1 HET 1PE A 951 14 HET 1PE A 952 14 HET 1PE B 953 14 HET P6G A 954 19 HET EDO A 901 4 HET EDO B 902 4 HETNAM NA SODIUM ION HETNAM CA CALCIUM ION HETNAM 1PE PENTAETHYLENE GLYCOL HETNAM P6G HEXAETHYLENE GLYCOL HETNAM EDO 1,2-ETHANEDIOL HETSYN 1PE PEG400 HETSYN P6G POLYETHYLENE GLYCOL PEG400 HETSYN EDO ETHYLENE GLYCOL FORMUL 3 NA 2(NA 1+) FORMUL 5 CA 6(CA 2+) FORMUL 11 1PE 3(C10 H22 O6) FORMUL 14 P6G C12 H26 O7 FORMUL 15 EDO 2(C2 H6 O2) FORMUL 17 HOH *283(H2 O) HELIX 1 1 LYS A 9 LYS A 19 1 11 HELIX 2 2 THR A 23 CYS A 38 1 16 HELIX 3 3 ALA A 45 PHE A 56 1 12 HELIX 4 4 PRO A 61 ASP A 73 1 13 HELIX 5 5 PHE A 82 GLY A 95 1 14 HELIX 6 6 THR A 96 ASP A 109 1 14 HELIX 7 7 ARG A 118 VAL A 132 1 15 HELIX 8 8 PRO A 139 ASN A 143 5 5 HELIX 9 9 THR A 144 ASP A 157 1 14 HELIX 10 10 LEU A 166 ASP A 176 1 11 HELIX 11 11 ASP A 176 SER A 184 1 9 HELIX 12 12 LYS B 9 LYS B 19 1 11 HELIX 13 13 THR B 23 CYS B 38 1 16 HELIX 14 14 ASP B 44 PHE B 56 1 13 HELIX 15 15 PRO B 61 ASP B 73 1 13 HELIX 16 16 PHE B 82 GLY B 95 1 14 HELIX 17 17 THR B 96 ASP B 109 1 14 HELIX 18 18 ARG B 118 GLY B 133 1 16 HELIX 19 19 PRO B 139 ASN B 143 5 5 HELIX 20 20 THR B 144 ASP B 157 1 14 HELIX 21 21 THR B 165 ASP B 176 1 12 HELIX 22 22 ASP B 176 SER B 184 1 9 SHEET 1 A 2 GLN A 42 ASP A 44 0 SHEET 2 A 2 ARG A 79 GLU A 81 -1 N ILE A 80 O LEU A 43 SHEET 1 B 2 TYR A 115 THR A 117 0 SHEET 2 B 2 LYS A 163 THR A 165 -1 O LEU A 164 N ILE A 116 SHEET 1 C 2 GLN B 42 LEU B 43 0 SHEET 2 C 2 ILE B 80 GLU B 81 -1 N ILE B 80 O LEU B 43 SHEET 1 D 2 ILE B 116 THR B 117 0 SHEET 2 D 2 LYS B 163 LEU B 164 -1 O LEU B 164 N ILE B 116 LINK NA NA A1596 O HOH A 501 1555 1555 2.44 LINK NA NA A1596 O ALA A 175 1555 1555 2.53 LINK CA CA A1597 O HOH A 733 1555 1555 2.34 LINK CA CA A1597 OD1 ASP A 73 1555 1555 2.17 LINK CA CA A1597 OD1 ASN A 75 1555 1555 1.84 LINK CA CA A1597 OD1 ASP A 77 1555 1555 2.43 LINK CA CA A1597 O ARG A 79 1555 1555 2.03 LINK CA CA A1597 OE1 GLU A 84 1555 1555 2.49 LINK CA CA A1597 OE2 GLU A 84 1555 1555 2.82 LINK CA CA A1598 OD2 ASP A 111 1555 1555 2.41 LINK CA CA A1598 OD1 ASP A 113 1555 1555 2.20 LINK CA CA A1598 OD1 ASP A 109 1555 1555 2.24 LINK CA CA A1598 O HOH A 507 1555 1555 2.31 LINK CA CA A1598 OE1 GLU A 120 1555 1555 2.49 LINK CA CA A1598 OE2 GLU A 120 1555 1555 2.64 LINK CA CA A1598 O TYR A 115 1555 1555 2.32 LINK CA CA A1599 O HOH A 565 1555 1555 2.44 LINK CA CA A1599 O LYS A 163 1555 1555 2.30 LINK CA CA A1599 OE1 GLU A 168 1555 1555 2.33 LINK CA CA A1599 OE2 GLU A 168 1555 1555 2.53 LINK CA CA A1599 OD1 ASN A 159 1555 1555 2.39 LINK CA CA A1599 OD1 ASP A 157 1555 1555 2.24 LINK CA CA A1599 OD1 ASP A 161 1555 1555 2.45 LINK NA NA B1595 O THR B 17 1555 1555 2.28 LINK NA NA B1595 O THR B 20 1555 1555 2.33 LINK NA NA B1595 O PHE B 22 1555 1555 2.29 LINK NA NA B1595 O HOH B 568 1555 1555 2.31 LINK CA CA B1600 O HOH B 696 1555 1555 2.52 LINK CA CA B1600 OE1 GLU B 84 1555 1555 2.60 LINK CA CA B1600 OE2 GLU B 84 1555 1555 2.55 LINK CA CA B1600 OD1 ASP B 73 1555 1555 2.18 LINK CA CA B1600 OD1 ASN B 75 1555 1555 2.17 LINK CA CA B1600 OD2 ASP B 77 1555 1555 2.52 LINK CA CA B1600 O ARG B 79 1555 1555 2.06 LINK CA CA B1601 OE2 GLU B 120 1555 1555 2.37 LINK CA CA B1601 OD1 ASP B 109 1555 1555 2.45 LINK CA CA B1601 OD1 ASP B 111 1555 1555 2.42 LINK CA CA B1601 OD1 ASP B 113 1555 1555 2.03 LINK CA CA B1601 O TYR B 115 1555 1555 2.41 LINK CA CA B1601 O HOH B 583 1555 1555 2.41 LINK CA CA B1601 OE1 GLU B 120 1555 1555 2.47 LINK CA CA B1602 OE1 GLU B 168 1555 1555 2.44 LINK CA CA B1602 OD1 ASP B 157 1555 1555 2.34 LINK CA CA B1602 OD1 ASN B 159 1555 1555 2.34 LINK CA CA B1602 OE2 GLU B 168 1555 1555 2.61 LINK CA CA B1602 O HOH B 701 1555 1555 2.48 LINK CA CA B1602 OD1 ASP B 161 1555 1555 2.40 LINK CA CA B1602 O LYS B 163 1555 1555 2.31 SITE *** AC1 4 THR B 17 THR B 20 PHE B 22 HOH B 568 SITE *** AC2 2 ALA A 175 HOH A 501 SITE *** AC3 6 ASP A 73 ASN A 75 ASP A 77 ARG A 79 SITE *** AC3 6 GLU A 84 HOH A 733 SITE *** AC4 6 ASP A 109 ASP A 111 ASP A 113 TYR A 115 SITE *** AC4 6 GLU A 120 HOH A 507 SITE *** AC5 6 ASP A 157 ASN A 159 ASP A 161 LYS A 163 SITE *** AC5 6 GLU A 168 HOH A 565 SITE *** AC6 6 ASP B 73 ASN B 75 ASP B 77 ARG B 79 SITE *** AC6 6 GLU B 84 HOH B 696 SITE *** AC7 6 ASP B 109 ASP B 111 ASP B 113 TYR B 115 SITE *** AC7 6 GLU B 120 HOH B 583 SITE *** AC8 6 ASP B 157 ASN B 159 ASP B 161 LYS B 163 SITE *** AC8 6 GLU B 168 HOH B 701 SITE *** AC9 10 TYR A 108 VAL A 125 ARG A 148 PHE A 169 SITE *** AC9 10 SER A 173 ILE A 179 LEU A 183 HOH A 676 SITE *** AC9 10 HOH A 735 1PE A 952 SITE *** BC1 5 THR A 92 TRP A 103 HOH A 676 HOH A 710 SITE *** BC1 5 1PE A 951 SITE *** BC2 8 TYR B 108 ARG B 148 PHE B 169 SER B 173 SITE *** BC2 8 ILE B 179 LEU B 183 HOH B 627 HOH B 737 SITE *** BC3 7 TRP A 30 PHE A 85 LEU A 89 SER A 93 SITE *** BC3 7 ARG A 94 ASP A 187 HOH A 755 SITE *** BC4 3 GLU A 26 TYR A 186 HOH A 541 SITE *** BC5 4 PHE B 22 TRP B 30 SER B 93 ASP B 187 CRYST1 53.811 55.524 77.705 90.00 94.25 90.00 P 1 21 1 4 ORIGX1 1.000000 0.000000 0.000000 0.00000 ORIGX2 0.000000 1.000000 0.000000 0.00000 ORIGX3 0.000000 0.000000 1.000000 0.00000 SCALE1 0.018584 0.000000 0.001382 0.00000 SCALE2 0.000000 0.018010 0.000000 0.00000 SCALE3 0.000000 0.000000 0.012905 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 : A 75 ASNHD21 : A 75 ASN OD1 : A1597 CACA :(metal ligand) USER MOD NoAdj : A 75 ASNHD22 : A 75 ASN OD1 : A1597 CACA :(metal ligand) USER MOD NoAdj : A 159 ASNHD21 : A 159 ASN OD1 : A1599 CACA :(metal ligand) USER MOD NoAdj : A 159 ASNHD22 : A 159 ASN OD1 : A1599 CACA :(metal ligand) USER MOD NoAdj : B 75 ASNHD21 : B 75 ASN OD1 : B1600 CACA :(metal ligand) USER MOD NoAdj : B 75 ASNHD22 : B 75 ASN OD1 : B1600 CACA :(metal ligand) USER MOD NoAdj : B 159 ASNHD21 : B 159 ASN OD1 : B1602 CACA :(metal ligand) USER MOD NoAdj : B 159 ASNHD22 : B 159 ASN OD1 : B1602 CACA :(metal ligand) USER MOD Set 1.1: B 156 MET CE :methyl 158:sc= -0.214 (180deg=-0.594) USER MOD Set 1.2: B 173 SER OG : rot 92:sc= 0.278 USER MOD Set 2.1: B 143 ASN : amide:sc= 0.446 K(o=1.7,f=-4.5!) USER MOD Set 2.2: B 147 LYS NZ :NH3+ -178:sc= 1.28 (180deg=0.438) USER MOD Set 3.1: B 83 SER OG : rot 180:sc= 0 USER MOD Set 3.2: B 87 GLN : amide:sc= 0.0786 X(o=0.079,f=0) USER MOD Set 4.1: B 38 CYS SG A: rot 100:sc= -1.67 USER MOD Set 4.2: B 40 SER OG : rot 180:sc= 0.0942 USER MOD Set 5.1: A 186 TYR OH : rot 35:sc= 2.62 USER MOD Set 5.2: A 901 EDO O1 : rot -151:sc= 1.29 USER MOD Set 6.1: A 156 MET CE :methyl 176:sc= 0 (180deg=-0.0128) USER MOD Set 6.2: A 173 SER OG : rot 85:sc= 0.912 USER MOD Set 7.1: A 143 ASN : amide:sc= 0.576 K(o=2.3,f=-11!) USER MOD Set 7.2: A 147 LYS NZ :NH3+ 166:sc= 1.69 (180deg=0.129) USER MOD Set 8.1: A 83 SER OG A: rot 150:sc= 1.76 USER MOD Set 8.2: A 87 GLN : amide:sc= -0.0769 K(o=1.7,f=2.4) USER MOD Set 9.1: A 38 CYS SG A: rot 100:sc= -0.668 USER MOD Set 9.2: A 40 SER OG : rot 180:sc= 0.0191 USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 5 ASN : amide:sc=0.000728 X(o=0.00073,f=-0.13) USER MOD Single : A 6 SER OG : rot -47:sc= 0.173 USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 THR OG1 : rot 83:sc= 0.619 USER MOD Single : A 19 LYS NZ :NH3+ -116:sc= 1.24 (180deg=-0.691!) USER MOD Single : A 20 THR OG1 : rot -81:sc= 0.964 USER MOD Single : A 21 TYR OH : rot 8:sc= 2.19 USER MOD Single : A 23 THR OG1 : rot -162:sc= 1.52 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 GLN : amide:sc=-0.00339 X(o=-0.0034,f=0) USER MOD Single : A 29 GLN : amide:sc= -1.69! K(o=-1.7!,f=-0.083) USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 32 LYS NZ :NH3+ 172:sc= 0.276 (180deg=0.187) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 CYS SG B: rot 168:sc= -2.49! USER MOD Single : A 42 GLN : amide:sc= -0.542 K(o=-0.54,f=-2.7!) USER MOD Single : A 49 GLN : amide:sc= -10.5! C(o=-10!,f=-8.1!) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 TYR OH : rot 180:sc= 0 USER MOD Single : A 53 LYS NZ :NH3+ -126:sc= 0.413 (180deg=-0.195) USER MOD Single : A 54 GLN : amide:sc= -0.052 K(o=-0.052,f=-1.1) USER MOD Single : A 62 THR OG1 : rot 91:sc= 0.694 USER MOD Single : A 63 LYS NZ :NH3+ -108:sc= 0.301 (180deg=-0.584) USER MOD Single : A 66 THR OG1 : rot 84:sc= 0.0171 USER MOD Single : A 70 ASN : amide:sc= 0.264 K(o=0.26,f=-1.1) USER MOD Single : A 76 LYS NZ :NH3+ -171:sc= 0.54 (180deg=0.502) USER MOD Single : A 83 SER OG B: rot -113:sc= 1.17 USER MOD Single : A 90 SER OG : rot -142:sc= 1.63 USER MOD Single : A 92 THR OG1 : rot 114:sc= 1.44 USER MOD Single : A 93 SER OG A: rot -83:sc= 0.194 USER MOD Single : A 93 SER OG B: rot -77:sc= 0.0581 USER MOD Single : A 96 THR OG1 : rot -169:sc= 1.14 USER MOD Single : A 100 LYS NZ :NH3+ 141:sc= 2 (180deg=0.843) USER MOD Single : A 106 LYS NZ :NH3+ -169:sc= 0.62 (180deg=0.613) USER MOD Single : A 108 TYR OH : rot 20:sc= 1.15 USER MOD Single : A 112 ASN : amide:sc= 0.964 K(o=0.96,f=-0.21) USER MOD Single : A 115 TYR OH : rot 180:sc= 0 USER MOD Single : A 117 THR OG1 : rot -168:sc= 1.31 USER MOD Single : A 119 ASN : amide:sc= -0.065 K(o=-0.065,f=-0.69) USER MOD Single : A 121 MET CE :methyl -117:sc= -0.136 (180deg=-0.661) USER MOD Single : A 129 TYR OH : rot -163:sc= 1.3 USER MOD Single : A 130 GLN : amide:sc= -0.0553 X(o=-0.055,f=-0.31) USER MOD Single : A 131 MET CE :methyl 168:sc= -0.0992 (180deg=-0.433) USER MOD Single : A 144 THR OG1 : rot 180:sc= -0.24 USER MOD Single : A 155 MET CE :methyl -109:sc= -0.061 (180deg=-1.45) USER MOD Single : A 158 LYS NZ :NH3+ -164:sc=-0.00793 (180deg=-0.274) USER MOD Single : A 163 LYS NZ :NH3+ -106:sc= 0.0267 (180deg=0) USER MOD Single : A 165 THR OG1 : rot 174:sc= 1.43 USER MOD Single : A 167 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 170 GLN : amide:sc= -0.82 K(o=-0.82,f=0.9) USER MOD Single : A 174 LYS NZ :NH3+ -173:sc= 0.909 (180deg=0.831) USER MOD Single : A 178 SER OG : rot -35:sc= 1.33 USER MOD Single : A 181 GLN : amide:sc= -6.12! C(o=-6.1!,f=-3.6!) USER MOD Single : A 184 SER OG A: rot 180:sc=-0.00617 USER MOD Single : A 184 SER OG B: rot 94:sc= 2.32 USER MOD Single : A 901 EDO O2 : rot 58:sc= 0.892 USER MOD Single : A 951 1PE OH2 : rot 4:sc= 0.656 USER MOD Single : A 952 1PE OH2 : rot 3:sc= 0.213 USER MOD Single : A 954 P6G O1 : rot 180:sc= 0 USER MOD Single : A 954 P6G O19 : rot 180:sc= 0 USER MOD Single : B 4 SER OG : rot -18:sc= 0.218 USER MOD Single : B 5 ASN : amide:sc= 0.156 K(o=0.16,f=-1.8!) USER MOD Single : B 6 SER OG : rot 180:sc= -0.416 USER MOD Single : B 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 17 THR OG1 : rot 83:sc= 0.841 USER MOD Single : B 19 LYS NZ :NH3+ -136:sc= 0.207 (180deg=-1.67!) USER MOD Single : B 20 THR OG1 : rot -84:sc= 1.02 USER MOD Single : B 21 TYR OH : rot 40:sc= 0.57 USER MOD Single : B 23 THR OG1 : rot -155:sc= 1.12 USER MOD Single : B 25 LYS NZ :NH3+ 159:sc= -0.189 (180deg=-0.697) USER MOD Single : B 28 GLN : amide:sc= -0.195 K(o=-0.2,f=-2.5!) USER MOD Single : B 29 GLN : amide:sc= -0.742 K(o=-0.74,f=0) USER MOD Single : B 31 TYR OH : rot 160:sc= 2.17 USER MOD Single : B 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 36 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0249) USER MOD Single : B 38 CYS SG B: rot 143:sc= -3.81! USER MOD Single : B 42 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 49 GLN : amide:sc= 0.704 X(o=0.7,f=0.63) USER MOD Single : B 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 52 TYR OH : rot 180:sc= -0.0495 USER MOD Single : B 53 LYS NZ :NH3+ -114:sc= -0.285 (180deg=-2.22!) USER MOD Single : B 54 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 62 THR OG1 : rot 82:sc= 1.38 USER MOD Single : B 63 LYS NZ :NH3+ 165:sc= 1.13 (180deg=1.02) USER MOD Single : B 66 THR OG1 : rot 92:sc= 0.78 USER MOD Single : B 70 ASN : amide:sc= 0.649 K(o=0.65,f=-0.48) USER MOD Single : B 76 LYS NZ :NH3+ -165:sc= 0.674 (180deg=0.454) USER MOD Single : B 90 SER OG : rot -138:sc= 1.66 USER MOD Single : B 92 THR OG1A: rot 180:sc= 0 USER MOD Single : B 92 THR OG1B: rot -79:sc= 0.263 USER MOD Single : B 93 SER OG : rot -71:sc= 0.413 USER MOD Single : B 96 THR OG1 : rot 180:sc= 0.211 USER MOD Single : B 100 LYS NZ :NH3+ 135:sc= 1.44 (180deg=-0.0987!) USER MOD Single : B 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 108 TYR OH : rot -145:sc= 1.38 USER MOD Single : B 112 ASN : amide:sc= -1.3! C(o=-1.3!,f=-1.3!) USER MOD Single : B 115 TYR OH : rot 180:sc= 0 USER MOD Single : B 117 THR OG1 : rot 128:sc= 0.486 USER MOD Single : B 119 ASN : amide:sc= -0.0495 K(o=-0.049,f=-0.84) USER MOD Single : B 121 MET CE :methyl -157:sc=-0.00139 (180deg=-0.11) USER MOD Single : B 129 TYR OH : rot -166:sc= 1.18 USER MOD Single : B 130 GLN : amide:sc= 0.428 K(o=0.43,f=1) USER MOD Single : B 131 MET CE A:methyl 170:sc= -11.5! (180deg=-12.7!) USER MOD Single : B 131 MET CE B:methyl 163:sc= -0.0579 (180deg=-0.38) USER MOD Single : B 134 ASN : amide:sc= -0.402 K(o=-0.4,f=-3.7!) USER MOD Single : B 135 THR OG1 : rot -170:sc= 0 USER MOD Single : B 144 THR OG1 : rot -175:sc= -0.281 USER MOD Single : B 155 MET CE :methyl 142:sc= -0.549 (180deg=-2.05) USER MOD Single : B 158 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 163 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 165 THR OG1 : rot 180:sc= 0.338 USER MOD Single : B 167 GLN : amide:sc= -2.17! K(o=-2.2!,f=-0.21) USER MOD Single : B 170 GLN : amide:sc=-0.00211 X(o=-0.0021,f=-0.016) USER MOD Single : B 174 LYS NZ :NH3+ 175:sc= 1.05 (180deg=0.842) USER MOD Single : B 178 SER OG : rot -39:sc= 0.716 USER MOD Single : B 181 GLN : amide:sc= 0 X(o=0,f=-0.18) USER MOD Single : B 184 SER OG : rot -106:sc= 1.28 USER MOD Single : B 186 TYR OH : rot 180:sc= 1.17 USER MOD Single : B 902 EDO O1 : rot 180:sc= 0 USER MOD Single : B 902 EDO O2 : rot -17:sc= 0.529 USER MOD Single : B 953 1PE OH2 : rot -29:sc= 0.632 USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 4 2.302 -25.225 17.032 1.00 45.61 N ATOM 2 CA SER A 4 1.528 -25.576 15.789 1.00 46.80 C ATOM 3 C SER A 4 1.607 -24.552 14.634 1.00 47.56 C ATOM 4 O SER A 4 1.264 -23.360 14.790 1.00 46.91 O ATOM 5 CB SER A 4 0.064 -25.835 16.154 1.00 45.67 C ATOM 6 OG SER A 4 -0.320 -27.140 15.722 1.00 45.61 O ATOM 0 HA SER A 4 1.957 -26.373 15.441 1.00 46.80 H new ATOM 0 HB2 SER A 4 -0.058 -25.754 17.113 1.00 45.67 H new ATOM 0 HB3 SER A 4 -0.504 -25.168 15.738 1.00 45.67 H new ATOM 0 HG SER A 4 -1.123 -27.278 15.926 1.00 45.61 H new ATOM 7 N ASN A 5 2.008 -25.072 13.465 1.00 49.01 N ATOM 8 CA ASN A 5 2.226 -24.318 12.207 1.00 48.61 C ATOM 9 C ASN A 5 3.599 -23.687 12.413 1.00 48.98 C ATOM 10 O ASN A 5 4.337 -23.486 11.454 1.00 50.92 O ATOM 11 CB ASN A 5 1.154 -23.231 11.950 1.00 46.85 C ATOM 12 CG ASN A 5 0.305 -23.483 10.642 1.00 47.57 C ATOM 13 OD1 ASN A 5 -0.115 -24.611 10.342 1.00 45.35 O ATOM 14 ND2 ASN A 5 0.034 -22.407 9.898 1.00 47.34 N ATOM 0 H ASN A 5 2.169 -25.912 13.375 1.00 49.01 H new ATOM 0 HA ASN A 5 2.168 -24.895 11.430 1.00 48.61 H new ATOM 0 HB2 ASN A 5 0.556 -23.190 12.713 1.00 46.85 H new ATOM 0 HB3 ASN A 5 1.589 -22.367 11.883 1.00 46.85 H new ATOM 0 HD21 ASN A 5 -0.445 -22.485 9.188 1.00 47.34 H new ATOM 0 HD22 ASN A 5 0.338 -21.637 10.129 1.00 47.34 H new ATOM 15 N SER A 6 3.951 -23.427 13.678 1.00 49.24 N ATOM 16 CA SER A 6 5.229 -22.817 14.063 1.00 47.28 C ATOM 17 C SER A 6 6.443 -23.584 13.528 1.00 47.35 C ATOM 18 O SER A 6 7.583 -23.406 14.000 1.00 45.75 O ATOM 19 CB SER A 6 5.315 -22.691 15.586 1.00 49.27 C ATOM 20 OG SER A 6 6.320 -21.784 16.004 1.00 48.96 O ATOM 0 H SER A 6 3.443 -23.604 14.349 1.00 49.24 H new ATOM 0 HA SER A 6 5.253 -21.936 13.658 1.00 47.28 H new ATOM 0 HB2 SER A 6 4.457 -22.399 15.932 1.00 49.27 H new ATOM 0 HB3 SER A 6 5.493 -23.564 15.969 1.00 49.27 H new ATOM 0 HG SER A 6 7.032 -21.943 15.588 1.00 48.96 H new ATOM 21 N LYS A 7 6.150 -24.449 12.555 1.00 45.74 N ATOM 22 CA LYS A 7 7.112 -25.236 11.804 1.00 44.54 C ATOM 23 C LYS A 7 6.697 -25.063 10.322 1.00 41.85 C ATOM 24 O LYS A 7 5.497 -25.060 9.955 1.00 41.61 O ATOM 25 CB LYS A 7 7.082 -26.720 12.200 1.00 45.97 C ATOM 26 CG LYS A 7 7.916 -27.083 13.454 1.00 49.10 C ATOM 27 CD LYS A 7 9.416 -26.724 13.330 1.00 50.40 C ATOM 28 CE LYS A 7 10.232 -27.382 14.450 1.00 52.51 C ATOM 29 NZ LYS A 7 11.725 -27.119 14.387 1.00 53.75 N ATOM 0 H LYS A 7 5.340 -24.596 12.307 1.00 45.74 H new ATOM 0 HA LYS A 7 8.019 -24.938 11.978 1.00 44.54 H new ATOM 0 HB2 LYS A 7 6.161 -26.980 12.355 1.00 45.97 H new ATOM 0 HB3 LYS A 7 7.403 -27.247 11.451 1.00 45.97 H new ATOM 0 HG2 LYS A 7 7.544 -26.624 14.223 1.00 49.10 H new ATOM 0 HG3 LYS A 7 7.832 -28.034 13.624 1.00 49.10 H new ATOM 0 HD2 LYS A 7 9.751 -27.014 12.467 1.00 50.40 H new ATOM 0 HD3 LYS A 7 9.526 -25.761 13.368 1.00 50.40 H new ATOM 0 HE2 LYS A 7 9.897 -27.068 15.304 1.00 52.51 H new ATOM 0 HE3 LYS A 7 10.083 -28.340 14.421 1.00 52.51 H new ATOM 0 HZ1 LYS A 7 12.128 -27.531 15.065 1.00 53.75 H new ATOM 0 HZ2 LYS A 7 12.049 -27.428 13.618 1.00 53.75 H new ATOM 0 HZ3 LYS A 7 11.875 -26.243 14.441 1.00 53.75 H new ATOM 30 N LEU A 8 7.694 -24.862 9.472 1.00 37.86 N ATOM 31 CA LEU A 8 7.449 -24.702 8.045 1.00 33.15 C ATOM 32 C LEU A 8 7.484 -26.100 7.432 1.00 31.42 C ATOM 33 O LEU A 8 8.093 -26.997 7.995 1.00 30.94 O ATOM 34 CB LEU A 8 8.580 -23.853 7.436 1.00 31.69 C ATOM 35 CG LEU A 8 8.686 -22.458 8.051 1.00 31.48 C ATOM 36 CD1 LEU A 8 9.979 -21.743 7.670 1.00 27.27 C ATOM 37 CD2 LEU A 8 7.494 -21.689 7.583 1.00 31.81 C ATOM 0 H LEU A 8 8.522 -24.815 9.701 1.00 37.86 H new ATOM 0 HA LEU A 8 6.599 -24.267 7.877 1.00 33.15 H new ATOM 0 HB2 LEU A 8 9.424 -24.317 7.554 1.00 31.69 H new ATOM 0 HB3 LEU A 8 8.434 -23.768 6.481 1.00 31.69 H new ATOM 0 HG LEU A 8 8.706 -22.529 9.018 1.00 31.48 H new ATOM 0 HD11 LEU A 8 9.998 -20.866 8.084 1.00 27.27 H new ATOM 0 HD12 LEU A 8 10.739 -22.262 7.978 1.00 27.27 H new ATOM 0 HD13 LEU A 8 10.024 -21.646 6.706 1.00 27.27 H new ATOM 0 HD21 LEU A 8 7.522 -20.792 7.952 1.00 31.81 H new ATOM 0 HD22 LEU A 8 7.500 -21.640 6.614 1.00 31.81 H new ATOM 0 HD23 LEU A 8 6.685 -22.135 7.878 1.00 31.81 H new ATOM 38 N LYS A 9 6.824 -26.310 6.303 1.00 29.63 N ATOM 39 CA LYS A 9 6.926 -27.617 5.660 1.00 27.59 C ATOM 40 C LYS A 9 8.404 -27.726 5.198 1.00 25.24 C ATOM 41 O LYS A 9 9.063 -26.707 4.952 1.00 23.31 O ATOM 42 CB LYS A 9 5.971 -27.686 4.456 1.00 29.87 C ATOM 43 CG LYS A 9 4.480 -27.663 4.877 1.00 31.77 C ATOM 44 CD LYS A 9 3.555 -27.348 3.711 1.00 36.54 C ATOM 45 CE LYS A 9 2.078 -27.537 4.118 1.00 38.36 C ATOM 46 NZ LYS A 9 1.115 -27.037 3.085 1.00 40.29 N ATOM 0 H LYS A 9 6.327 -25.734 5.902 1.00 29.63 H new ATOM 0 HA LYS A 9 6.683 -28.343 6.256 1.00 27.59 H new ATOM 0 HB2 LYS A 9 6.148 -26.939 3.864 1.00 29.87 H new ATOM 0 HB3 LYS A 9 6.149 -28.496 3.952 1.00 29.87 H new ATOM 0 HG2 LYS A 9 4.239 -28.524 5.254 1.00 31.77 H new ATOM 0 HG3 LYS A 9 4.353 -27.002 5.575 1.00 31.77 H new ATOM 0 HD2 LYS A 9 3.699 -26.436 3.415 1.00 36.54 H new ATOM 0 HD3 LYS A 9 3.765 -27.926 2.961 1.00 36.54 H new ATOM 0 HE2 LYS A 9 1.911 -28.479 4.279 1.00 38.36 H new ATOM 0 HE3 LYS A 9 1.917 -27.073 4.954 1.00 38.36 H new ATOM 0 HZ1 LYS A 9 0.281 -27.169 3.367 1.00 40.29 H new ATOM 0 HZ2 LYS A 9 1.248 -26.167 2.951 1.00 40.29 H new ATOM 0 HZ3 LYS A 9 1.243 -27.477 2.322 1.00 40.29 H new ATOM 47 N PRO A 10 8.926 -28.961 5.057 1.00 24.52 N ATOM 48 CA PRO A 10 10.311 -29.230 4.631 1.00 22.63 C ATOM 49 C PRO A 10 10.674 -28.538 3.328 1.00 23.01 C ATOM 50 O PRO A 10 11.777 -27.975 3.179 1.00 20.40 O ATOM 51 CB PRO A 10 10.341 -30.748 4.449 1.00 24.37 C ATOM 52 CG PRO A 10 9.220 -31.248 5.338 1.00 24.90 C ATOM 53 CD PRO A 10 8.149 -30.220 5.160 1.00 24.52 C ATOM 0 HA PRO A 10 10.952 -28.896 5.278 1.00 22.63 H new ATOM 0 HB2 PRO A 10 10.197 -30.997 3.523 1.00 24.37 H new ATOM 0 HB3 PRO A 10 11.197 -31.120 4.714 1.00 24.37 H new ATOM 0 HG2 PRO A 10 8.917 -32.130 5.069 1.00 24.90 H new ATOM 0 HG3 PRO A 10 9.501 -31.315 6.264 1.00 24.90 H new ATOM 0 HD2 PRO A 10 7.620 -30.384 4.364 1.00 24.52 H new ATOM 0 HD3 PRO A 10 7.535 -30.205 5.911 1.00 24.52 H new ATOM 54 N GLU A 11 9.744 -28.586 2.375 1.00 20.31 N ATOM 55 CA GLU A 11 9.995 -27.999 1.084 1.00 20.70 C ATOM 56 C GLU A 11 10.062 -26.482 1.195 1.00 19.03 C ATOM 57 O GLU A 11 10.795 -25.828 0.447 1.00 18.81 O ATOM 58 CB GLU A 11 8.916 -28.438 0.068 1.00 23.04 C ATOM 59 CG GLU A 11 7.556 -27.932 0.409 1.00 28.23 C ATOM 60 CD GLU A 11 6.781 -28.863 1.331 1.00 32.33 C ATOM 61 OE1 GLU A 11 7.376 -29.722 2.052 1.00 31.52 O ATOM 62 OE2 GLU A 11 5.537 -28.701 1.343 1.00 35.81 O ATOM 0 H GLU A 11 8.971 -28.953 2.464 1.00 20.31 H new ATOM 0 HA GLU A 11 10.853 -28.315 0.761 1.00 20.70 H new ATOM 0 HB2 GLU A 11 9.162 -28.121 -0.815 1.00 23.04 H new ATOM 0 HB3 GLU A 11 8.894 -29.407 0.025 1.00 23.04 H new ATOM 0 HG2 GLU A 11 7.638 -27.063 0.832 1.00 28.23 H new ATOM 0 HG3 GLU A 11 7.051 -27.803 -0.409 1.00 28.23 H new ATOM 63 N VAL A 12 9.316 -25.914 2.132 1.00 17.58 N ATOM 64 CA VAL A 12 9.338 -24.468 2.294 1.00 18.04 C ATOM 65 C VAL A 12 10.638 -24.025 2.996 1.00 17.53 C ATOM 66 O VAL A 12 11.179 -23.000 2.639 1.00 15.58 O ATOM 67 CB VAL A 12 8.092 -23.965 3.050 1.00 19.00 C ATOM 68 CG1 VAL A 12 8.173 -22.446 3.235 1.00 19.18 C ATOM 69 CG2 VAL A 12 6.824 -24.327 2.208 1.00 22.44 C ATOM 0 H VAL A 12 8.800 -26.337 2.674 1.00 17.58 H new ATOM 0 HA VAL A 12 9.317 -24.066 1.412 1.00 18.04 H new ATOM 0 HB VAL A 12 8.043 -24.383 3.924 1.00 19.00 H new ATOM 0 HG11 VAL A 12 7.387 -22.135 3.711 1.00 19.18 H new ATOM 0 HG12 VAL A 12 8.968 -22.224 3.745 1.00 19.18 H new ATOM 0 HG13 VAL A 12 8.216 -22.016 2.367 1.00 19.18 H new ATOM 0 HG21 VAL A 12 6.029 -24.017 2.670 1.00 22.44 H new ATOM 0 HG22 VAL A 12 6.880 -23.900 1.339 1.00 22.44 H new ATOM 0 HG23 VAL A 12 6.776 -25.289 2.092 1.00 22.44 H new ATOM 70 N VAL A 13 11.128 -24.806 3.962 1.00 18.07 N ATOM 71 CA VAL A 13 12.405 -24.491 4.627 1.00 18.74 C ATOM 72 C VAL A 13 13.487 -24.528 3.566 1.00 16.83 C ATOM 73 O VAL A 13 14.292 -23.626 3.520 1.00 15.47 O ATOM 74 CB VAL A 13 12.805 -25.533 5.725 1.00 20.34 C ATOM 75 CG1 VAL A 13 14.264 -25.269 6.226 1.00 20.61 C ATOM 76 CG2 VAL A 13 11.817 -25.471 6.874 1.00 19.85 C ATOM 0 H VAL A 13 10.742 -25.519 4.248 1.00 18.07 H new ATOM 0 HA VAL A 13 12.307 -23.627 5.057 1.00 18.74 H new ATOM 0 HB VAL A 13 12.779 -26.424 5.342 1.00 20.34 H new ATOM 0 HG11 VAL A 13 14.496 -25.922 6.905 1.00 20.61 H new ATOM 0 HG12 VAL A 13 14.881 -25.344 5.481 1.00 20.61 H new ATOM 0 HG13 VAL A 13 14.320 -24.377 6.603 1.00 20.61 H new ATOM 0 HG21 VAL A 13 12.068 -26.118 7.552 1.00 19.85 H new ATOM 0 HG22 VAL A 13 11.823 -24.581 7.259 1.00 19.85 H new ATOM 0 HG23 VAL A 13 10.927 -25.675 6.547 1.00 19.85 H new ATOM 77 N GLU A 14 13.485 -25.550 2.710 1.00 16.06 N ATOM 78 CA GLU A 14 14.516 -25.681 1.649 1.00 18.50 C ATOM 79 C GLU A 14 14.468 -24.493 0.706 1.00 17.43 C ATOM 80 O GLU A 14 15.513 -23.924 0.333 1.00 14.05 O ATOM 81 CB GLU A 14 14.332 -26.965 0.808 1.00 20.07 C ATOM 82 CG GLU A 14 15.373 -27.211 -0.340 1.00 26.19 C ATOM 83 CD GLU A 14 15.182 -26.371 -1.652 1.00 30.51 C ATOM 84 OE1 GLU A 14 14.044 -25.952 -1.997 1.00 32.32 O ATOM 85 OE2 GLU A 14 16.183 -26.141 -2.382 1.00 32.73 O ATOM 0 H GLU A 14 12.901 -26.182 2.718 1.00 16.06 H new ATOM 0 HA GLU A 14 15.371 -25.722 2.105 1.00 18.50 H new ATOM 0 HB2 GLU A 14 14.358 -27.726 1.408 1.00 20.07 H new ATOM 0 HB3 GLU A 14 13.446 -26.944 0.414 1.00 20.07 H new ATOM 0 HG2 GLU A 14 16.259 -27.030 0.010 1.00 26.19 H new ATOM 0 HG3 GLU A 14 15.348 -28.152 -0.576 1.00 26.19 H new ATOM 86 N GLU A 15 13.254 -24.113 0.325 1.00 15.17 N ATOM 87 CA GLU A 15 13.080 -22.991 -0.593 1.00 16.90 C ATOM 88 C GLU A 15 13.494 -21.631 0.008 1.00 15.47 C ATOM 89 O GLU A 15 14.174 -20.852 -0.639 1.00 14.98 O ATOM 90 CB GLU A 15 11.611 -22.898 -1.066 1.00 18.37 C ATOM 91 CG GLU A 15 11.306 -21.509 -1.672 1.00 26.01 C ATOM 92 CD GLU A 15 9.805 -21.145 -1.664 1.00 31.75 C ATOM 93 OE1 GLU A 15 9.033 -21.671 -0.800 1.00 31.80 O ATOM 94 OE2 GLU A 15 9.425 -20.303 -2.524 1.00 34.63 O ATOM 0 H GLU A 15 12.524 -24.487 0.583 1.00 15.17 H new ATOM 0 HA GLU A 15 13.671 -23.172 -1.341 1.00 16.90 H new ATOM 0 HB2 GLU A 15 11.437 -23.587 -1.726 1.00 18.37 H new ATOM 0 HB3 GLU A 15 11.016 -23.065 -0.318 1.00 18.37 H new ATOM 0 HG2 GLU A 15 11.797 -20.834 -1.178 1.00 26.01 H new ATOM 0 HG3 GLU A 15 11.632 -21.485 -2.585 1.00 26.01 H new ATOM 95 N LEU A 16 13.057 -21.329 1.232 1.00 13.25 N ATOM 96 CA LEU A 16 13.390 -20.054 1.815 1.00 12.85 C ATOM 97 C LEU A 16 14.885 -19.971 2.163 1.00 12.91 C ATOM 98 O LEU A 16 15.451 -18.862 2.112 1.00 12.91 O ATOM 99 CB LEU A 16 12.539 -19.768 3.062 1.00 14.28 C ATOM 100 CG LEU A 16 11.053 -19.648 2.659 1.00 13.03 C ATOM 101 CD1 LEU A 16 10.199 -19.400 3.863 1.00 15.35 C ATOM 102 CD2 LEU A 16 10.870 -18.549 1.643 1.00 16.37 C ATOM 0 H LEU A 16 12.576 -21.845 1.725 1.00 13.25 H new ATOM 0 HA LEU A 16 13.193 -19.376 1.149 1.00 12.85 H new ATOM 0 HB2 LEU A 16 12.651 -20.480 3.711 1.00 14.28 H new ATOM 0 HB3 LEU A 16 12.836 -18.948 3.486 1.00 14.28 H new ATOM 0 HG LEU A 16 10.776 -20.486 2.257 1.00 13.03 H new ATOM 0 HD11 LEU A 16 9.270 -19.327 3.592 1.00 15.35 H new ATOM 0 HD12 LEU A 16 10.297 -20.137 4.487 1.00 15.35 H new ATOM 0 HD13 LEU A 16 10.476 -18.575 4.292 1.00 15.35 H new ATOM 0 HD21 LEU A 16 9.933 -18.486 1.400 1.00 16.37 H new ATOM 0 HD22 LEU A 16 11.163 -17.706 2.022 1.00 16.37 H new ATOM 0 HD23 LEU A 16 11.396 -18.748 0.853 1.00 16.37 H new ATOM 103 N THR A 17 15.490 -21.109 2.508 1.00 11.44 N ATOM 104 CA THR A 17 16.935 -21.127 2.814 1.00 11.25 C ATOM 105 C THR A 17 17.704 -20.837 1.520 1.00 12.50 C ATOM 106 O THR A 17 18.674 -20.061 1.513 1.00 11.55 O ATOM 107 CB THR A 17 17.351 -22.479 3.436 1.00 12.33 C ATOM 108 OG1 THR A 17 16.664 -22.656 4.681 1.00 11.20 O ATOM 109 CG2 THR A 17 18.889 -22.486 3.755 1.00 12.12 C ATOM 0 H THR A 17 15.096 -21.871 2.572 1.00 11.44 H new ATOM 0 HA THR A 17 17.145 -20.445 3.471 1.00 11.25 H new ATOM 0 HB THR A 17 17.134 -23.183 2.805 1.00 12.33 H new ATOM 0 HG1 THR A 17 15.892 -22.955 4.536 1.00 11.20 H new ATOM 0 HG21 THR A 17 19.135 -23.340 4.144 1.00 12.12 H new ATOM 0 HG22 THR A 17 19.390 -22.348 2.936 1.00 12.12 H new ATOM 0 HG23 THR A 17 19.093 -21.774 4.382 1.00 12.12 H new ATOM 110 N ARG A 18 17.262 -21.429 0.411 1.00 12.98 N ATOM 111 CA ARG A 18 17.924 -21.192 -0.888 1.00 15.75 C ATOM 112 C ARG A 18 17.684 -19.754 -1.461 1.00 16.80 C ATOM 113 O ARG A 18 18.488 -19.257 -2.242 1.00 17.53 O ATOM 114 CB ARG A 18 17.479 -22.283 -1.888 1.00 16.18 C ATOM 115 CG ARG A 18 17.752 -21.977 -3.365 1.00 21.51 C ATOM 116 CD ARG A 18 17.509 -23.218 -4.262 1.00 22.27 C ATOM 117 NE ARG A 18 16.144 -23.746 -4.123 1.00 25.92 N ATOM 118 CZ ARG A 18 15.044 -23.145 -4.574 1.00 26.40 C ATOM 119 NH1 ARG A 18 15.126 -21.978 -5.221 1.00 26.78 N ATOM 120 NH2 ARG A 18 13.848 -23.691 -4.336 1.00 28.13 N ATOM 0 H ARG A 18 16.590 -21.965 0.381 1.00 12.98 H new ATOM 0 HA ARG A 18 18.882 -21.248 -0.744 1.00 15.75 H new ATOM 0 HB2 ARG A 18 17.926 -23.112 -1.658 1.00 16.18 H new ATOM 0 HB3 ARG A 18 16.527 -22.434 -1.776 1.00 16.18 H new ATOM 0 HG2 ARG A 18 17.180 -21.250 -3.656 1.00 21.51 H new ATOM 0 HG3 ARG A 18 18.668 -21.676 -3.469 1.00 21.51 H new ATOM 0 HD2 ARG A 18 17.670 -22.981 -5.189 1.00 22.27 H new ATOM 0 HD3 ARG A 18 18.147 -23.911 -4.032 1.00 22.27 H new ATOM 0 HE ARG A 18 16.048 -24.500 -3.720 1.00 25.92 H new ATOM 0 HH11 ARG A 18 15.893 -21.610 -5.349 1.00 26.78 H new ATOM 0 HH12 ARG A 18 14.412 -21.595 -5.510 1.00 26.78 H new ATOM 0 HH21 ARG A 18 13.791 -24.426 -3.894 1.00 28.13 H new ATOM 0 HH22 ARG A 18 13.135 -23.307 -4.625 1.00 28.13 H new ATOM 121 N LYS A 19 16.603 -19.082 -1.063 1.00 14.99 N ATOM 122 CA LYS A 19 16.338 -17.710 -1.523 1.00 15.78 C ATOM 123 C LYS A 19 16.853 -16.603 -0.593 1.00 14.40 C ATOM 124 O LYS A 19 16.666 -15.436 -0.896 1.00 15.43 O ATOM 125 CB LYS A 19 14.820 -17.495 -1.720 1.00 15.73 C ATOM 126 CG LYS A 19 14.231 -18.360 -2.801 1.00 19.37 C ATOM 127 CD LYS A 19 12.755 -17.963 -3.041 1.00 20.02 C ATOM 128 CE LYS A 19 12.039 -18.991 -3.891 1.00 27.19 C ATOM 129 NZ LYS A 19 10.578 -18.627 -4.010 1.00 29.01 N ATOM 0 H LYS A 19 16.009 -19.399 -0.528 1.00 14.99 H new ATOM 0 HA LYS A 19 16.829 -17.634 -2.356 1.00 15.78 H new ATOM 0 HB2 LYS A 19 14.363 -17.677 -0.884 1.00 15.73 H new ATOM 0 HB3 LYS A 19 14.657 -16.563 -1.935 1.00 15.73 H new ATOM 0 HG2 LYS A 19 14.739 -18.259 -3.621 1.00 19.37 H new ATOM 0 HG3 LYS A 19 14.286 -19.294 -2.546 1.00 19.37 H new ATOM 0 HD2 LYS A 19 12.300 -17.871 -2.189 1.00 20.02 H new ATOM 0 HD3 LYS A 19 12.718 -17.097 -3.477 1.00 20.02 H new ATOM 0 HE2 LYS A 19 12.443 -19.033 -4.772 1.00 27.19 H new ATOM 0 HE3 LYS A 19 12.130 -19.871 -3.494 1.00 27.19 H new ATOM 0 HZ1 LYS A 19 10.082 -19.258 -3.625 1.00 29.01 H new ATOM 0 HZ2 LYS A 19 10.432 -17.848 -3.606 1.00 29.01 H new ATOM 0 HZ3 LYS A 19 10.357 -18.561 -4.870 1.00 29.01 H new ATOM 130 N THR A 20 17.502 -16.940 0.536 1.00 10.92 N ATOM 131 CA THR A 20 17.961 -15.916 1.441 1.00 8.27 C ATOM 132 C THR A 20 19.403 -16.188 1.915 1.00 8.14 C ATOM 133 O THR A 20 19.962 -17.251 1.666 1.00 8.07 O ATOM 134 CB THR A 20 17.107 -15.872 2.738 1.00 7.23 C ATOM 135 OG1 THR A 20 17.200 -17.156 3.391 1.00 9.27 O ATOM 136 CG2 THR A 20 15.581 -15.518 2.394 1.00 8.27 C ATOM 0 H THR A 20 17.676 -17.746 0.779 1.00 10.92 H new ATOM 0 HA THR A 20 17.896 -15.086 0.943 1.00 8.27 H new ATOM 0 HB THR A 20 17.442 -15.180 3.330 1.00 7.23 H new ATOM 0 HG1 THR A 20 16.665 -17.694 3.030 1.00 9.27 H new ATOM 0 HG21 THR A 20 15.062 -15.494 3.213 1.00 8.27 H new ATOM 0 HG22 THR A 20 15.540 -14.651 1.960 1.00 8.27 H new ATOM 0 HG23 THR A 20 15.218 -16.194 1.801 1.00 8.27 H new ATOM 137 N TYR A 21 19.961 -15.235 2.664 1.00 9.34 N ATOM 138 CA TYR A 21 21.312 -15.396 3.227 1.00 8.41 C ATOM 139 C TYR A 21 21.256 -16.043 4.608 1.00 11.15 C ATOM 140 O TYR A 21 22.187 -15.926 5.394 1.00 10.30 O ATOM 141 CB TYR A 21 22.018 -14.035 3.332 1.00 10.74 C ATOM 142 CG TYR A 21 22.415 -13.530 1.993 1.00 12.32 C ATOM 143 CD1 TYR A 21 21.825 -12.371 1.464 1.00 11.21 C ATOM 144 CD2 TYR A 21 23.419 -14.183 1.250 1.00 12.98 C ATOM 145 CE1 TYR A 21 22.236 -11.860 0.209 1.00 12.18 C ATOM 146 CE2 TYR A 21 23.834 -13.662 -0.002 1.00 14.36 C ATOM 147 CZ TYR A 21 23.242 -12.513 -0.495 1.00 14.53 C ATOM 148 OH TYR A 21 23.670 -11.980 -1.709 1.00 15.47 O ATOM 0 H TYR A 21 19.579 -14.490 2.859 1.00 9.34 H new ATOM 0 HA TYR A 21 21.812 -15.973 2.629 1.00 8.41 H new ATOM 0 HB2 TYR A 21 21.429 -13.394 3.760 1.00 10.74 H new ATOM 0 HB3 TYR A 21 22.804 -14.118 3.895 1.00 10.74 H new ATOM 0 HD1 TYR A 21 21.158 -11.935 1.943 1.00 11.21 H new ATOM 0 HD2 TYR A 21 23.811 -14.958 1.582 1.00 12.98 H new ATOM 0 HE1 TYR A 21 21.837 -11.096 -0.141 1.00 12.18 H new ATOM 0 HE2 TYR A 21 24.500 -14.090 -0.489 1.00 14.36 H new ATOM 0 HH TYR A 21 23.319 -11.225 -1.823 1.00 15.47 H new ATOM 149 N PHE A 22 20.134 -16.699 4.922 1.00 11.08 N ATOM 150 CA PHE A 22 19.979 -17.382 6.198 1.00 9.17 C ATOM 151 C PHE A 22 20.218 -18.890 6.062 1.00 9.42 C ATOM 152 O PHE A 22 20.070 -19.449 4.966 1.00 7.76 O ATOM 153 CB PHE A 22 18.537 -17.182 6.727 1.00 8.18 C ATOM 154 CG PHE A 22 18.189 -15.738 7.063 1.00 8.54 C ATOM 155 CD1 PHE A 22 18.846 -15.068 8.106 1.00 12.62 C ATOM 156 CD2 PHE A 22 17.198 -15.049 6.343 1.00 9.32 C ATOM 157 CE1 PHE A 22 18.518 -13.702 8.421 1.00 13.16 C ATOM 158 CE2 PHE A 22 16.864 -13.713 6.638 1.00 13.18 C ATOM 159 CZ PHE A 22 17.507 -13.033 7.663 1.00 12.00 C ATOM 0 H PHE A 22 19.451 -16.757 4.403 1.00 11.08 H new ATOM 0 HA PHE A 22 20.633 -17.005 6.808 1.00 9.17 H new ATOM 0 HB2 PHE A 22 17.911 -17.508 6.062 1.00 8.18 H new ATOM 0 HB3 PHE A 22 18.416 -17.726 7.521 1.00 8.18 H new ATOM 0 HD1 PHE A 22 19.499 -15.510 8.598 1.00 12.62 H new ATOM 0 HD2 PHE A 22 16.751 -15.486 5.654 1.00 9.32 H new ATOM 0 HE1 PHE A 22 18.959 -13.260 9.110 1.00 13.16 H new ATOM 0 HE2 PHE A 22 16.206 -13.282 6.141 1.00 13.18 H new ATOM 0 HZ PHE A 22 17.282 -12.151 7.855 1.00 12.00 H new ATOM 160 N THR A 23 20.578 -19.520 7.185 1.00 7.81 N ATOM 161 CA THR A 23 20.726 -20.969 7.279 1.00 8.65 C ATOM 162 C THR A 23 19.291 -21.537 7.560 1.00 10.29 C ATOM 163 O THR A 23 18.367 -20.768 7.871 1.00 9.08 O ATOM 164 CB THR A 23 21.557 -21.418 8.504 1.00 10.99 C ATOM 165 OG1 THR A 23 20.903 -20.962 9.738 1.00 7.85 O ATOM 166 CG2 THR A 23 22.991 -20.901 8.418 1.00 10.71 C ATOM 0 H THR A 23 20.744 -19.108 7.921 1.00 7.81 H new ATOM 0 HA THR A 23 21.156 -21.275 6.465 1.00 8.65 H new ATOM 0 HB THR A 23 21.601 -22.387 8.513 1.00 10.99 H new ATOM 0 HG1 THR A 23 21.454 -20.985 10.372 1.00 7.85 H new ATOM 0 HG21 THR A 23 23.489 -21.196 9.196 1.00 10.71 H new ATOM 0 HG22 THR A 23 23.412 -21.246 7.615 1.00 10.71 H new ATOM 0 HG23 THR A 23 22.984 -19.932 8.388 1.00 10.71 H new ATOM 167 N GLU A 24 19.132 -22.846 7.474 1.00 10.08 N ATOM 168 CA GLU A 24 17.848 -23.477 7.756 1.00 12.52 C ATOM 169 C GLU A 24 17.421 -23.195 9.188 1.00 12.79 C ATOM 170 O GLU A 24 16.231 -22.936 9.450 1.00 13.86 O ATOM 171 CB GLU A 24 17.926 -24.994 7.547 1.00 11.96 C ATOM 172 CG GLU A 24 18.347 -25.349 6.123 1.00 18.27 C ATOM 173 CD GLU A 24 18.183 -26.825 5.734 1.00 20.29 C ATOM 174 OE1 GLU A 24 17.616 -27.636 6.538 1.00 22.56 O ATOM 175 OE2 GLU A 24 18.603 -27.163 4.593 1.00 20.93 O ATOM 0 H GLU A 24 19.757 -23.393 7.253 1.00 10.08 H new ATOM 0 HA GLU A 24 17.196 -23.105 7.142 1.00 12.52 H new ATOM 0 HB2 GLU A 24 18.559 -25.375 8.176 1.00 11.96 H new ATOM 0 HB3 GLU A 24 17.062 -25.392 7.738 1.00 11.96 H new ATOM 0 HG2 GLU A 24 17.830 -24.809 5.505 1.00 18.27 H new ATOM 0 HG3 GLU A 24 19.278 -25.101 6.006 1.00 18.27 H new ATOM 176 N LYS A 25 18.372 -23.263 10.111 1.00 12.55 N ATOM 177 CA LYS A 25 18.078 -23.003 11.511 1.00 15.78 C ATOM 178 C LYS A 25 17.635 -21.528 11.737 1.00 15.28 C ATOM 179 O LYS A 25 16.684 -21.224 12.526 1.00 12.70 O ATOM 180 CB LYS A 25 19.311 -23.392 12.341 1.00 19.03 C ATOM 181 CG LYS A 25 19.352 -22.882 13.746 1.00 24.45 C ATOM 182 CD LYS A 25 20.413 -23.672 14.528 1.00 30.48 C ATOM 183 CE LYS A 25 20.482 -23.224 16.013 1.00 33.75 C ATOM 184 NZ LYS A 25 21.336 -24.149 16.845 1.00 36.04 N ATOM 0 H LYS A 25 19.193 -23.458 9.947 1.00 12.55 H new ATOM 0 HA LYS A 25 17.325 -23.542 11.801 1.00 15.78 H new ATOM 0 HB2 LYS A 25 19.368 -24.360 12.367 1.00 19.03 H new ATOM 0 HB3 LYS A 25 20.102 -23.074 11.878 1.00 19.03 H new ATOM 0 HG2 LYS A 25 19.564 -21.936 13.754 1.00 24.45 H new ATOM 0 HG3 LYS A 25 18.483 -22.981 14.165 1.00 24.45 H new ATOM 0 HD2 LYS A 25 20.209 -24.619 14.484 1.00 30.48 H new ATOM 0 HD3 LYS A 25 21.281 -23.549 14.112 1.00 30.48 H new ATOM 0 HE2 LYS A 25 20.840 -22.324 16.062 1.00 33.75 H new ATOM 0 HE3 LYS A 25 19.586 -23.193 16.382 1.00 33.75 H new ATOM 0 HZ1 LYS A 25 21.352 -23.861 17.687 1.00 36.04 H new ATOM 0 HZ2 LYS A 25 20.996 -24.971 16.819 1.00 36.04 H new ATOM 0 HZ3 LYS A 25 22.165 -24.161 16.520 1.00 36.04 H new ATOM 185 N GLU A 26 18.298 -20.607 11.049 1.00 12.08 N ATOM 186 CA GLU A 26 17.910 -19.205 11.126 1.00 12.24 C ATOM 187 C GLU A 26 16.512 -18.970 10.537 1.00 13.16 C ATOM 188 O GLU A 26 15.729 -18.189 11.119 1.00 12.50 O ATOM 189 CB GLU A 26 18.927 -18.288 10.409 1.00 11.47 C ATOM 190 CG GLU A 26 20.240 -18.164 11.228 1.00 14.83 C ATOM 191 CD GLU A 26 21.361 -17.382 10.504 1.00 14.97 C ATOM 192 OE1 GLU A 26 21.466 -17.472 9.249 1.00 9.98 O ATOM 193 OE2 GLU A 26 22.129 -16.674 11.207 1.00 15.30 O ATOM 0 H GLU A 26 18.969 -20.770 10.536 1.00 12.08 H new ATOM 0 HA GLU A 26 17.896 -18.979 12.069 1.00 12.24 H new ATOM 0 HB2 GLU A 26 19.124 -18.644 9.528 1.00 11.47 H new ATOM 0 HB3 GLU A 26 18.539 -17.409 10.279 1.00 11.47 H new ATOM 0 HG2 GLU A 26 20.045 -17.725 12.071 1.00 14.83 H new ATOM 0 HG3 GLU A 26 20.564 -19.054 11.440 1.00 14.83 H new ATOM 194 N VAL A 27 16.201 -19.595 9.390 1.00 10.31 N ATOM 195 CA VAL A 27 14.867 -19.416 8.804 1.00 12.10 C ATOM 196 C VAL A 27 13.787 -19.917 9.802 1.00 13.09 C ATOM 197 O VAL A 27 12.722 -19.266 9.994 1.00 14.03 O ATOM 198 CB VAL A 27 14.722 -20.242 7.474 1.00 9.57 C ATOM 199 CG1 VAL A 27 13.260 -20.295 7.039 1.00 10.44 C ATOM 200 CG2 VAL A 27 15.566 -19.565 6.342 1.00 10.55 C ATOM 0 H VAL A 27 16.731 -20.110 8.950 1.00 10.31 H new ATOM 0 HA VAL A 27 14.749 -18.472 8.614 1.00 12.10 H new ATOM 0 HB VAL A 27 15.041 -21.144 7.632 1.00 9.57 H new ATOM 0 HG11 VAL A 27 13.185 -20.807 6.218 1.00 10.44 H new ATOM 0 HG12 VAL A 27 12.731 -20.718 7.733 1.00 10.44 H new ATOM 0 HG13 VAL A 27 12.934 -19.394 6.889 1.00 10.44 H new ATOM 0 HG21 VAL A 27 15.476 -20.075 5.522 1.00 10.55 H new ATOM 0 HG22 VAL A 27 15.246 -18.661 6.197 1.00 10.55 H new ATOM 0 HG23 VAL A 27 16.499 -19.539 6.605 1.00 10.55 H new ATOM 201 N GLN A 28 14.023 -21.085 10.393 1.00 13.26 N ATOM 202 CA GLN A 28 13.064 -21.637 11.378 1.00 16.51 C ATOM 203 C GLN A 28 12.945 -20.766 12.639 1.00 18.17 C ATOM 204 O GLN A 28 11.849 -20.640 13.183 1.00 13.56 O ATOM 205 CB GLN A 28 13.442 -23.084 11.742 1.00 18.67 C ATOM 206 CG GLN A 28 13.318 -23.960 10.468 1.00 24.04 C ATOM 207 CD GLN A 28 13.698 -25.397 10.671 1.00 29.81 C ATOM 208 OE1 GLN A 28 14.865 -25.723 10.898 1.00 32.05 O ATOM 209 NE2 GLN A 28 12.705 -26.280 10.600 1.00 31.76 N ATOM 0 H GLN A 28 14.716 -21.573 10.248 1.00 13.26 H new ATOM 0 HA GLN A 28 12.190 -21.636 10.958 1.00 16.51 H new ATOM 0 HB2 GLN A 28 14.347 -23.119 12.088 1.00 18.67 H new ATOM 0 HB3 GLN A 28 12.858 -23.420 12.440 1.00 18.67 H new ATOM 0 HG2 GLN A 28 12.403 -23.920 10.148 1.00 24.04 H new ATOM 0 HG3 GLN A 28 13.879 -23.583 9.772 1.00 24.04 H new ATOM 0 HE21 GLN A 28 11.903 -26.013 10.440 1.00 31.76 H new ATOM 0 HE22 GLN A 28 12.865 -27.117 10.715 1.00 31.76 H new ATOM 210 N GLN A 29 14.052 -20.174 13.095 1.00 15.64 N ATOM 211 CA GLN A 29 14.016 -19.297 14.251 1.00 17.69 C ATOM 212 C GLN A 29 13.200 -18.040 13.929 1.00 18.45 C ATOM 213 O GLN A 29 12.378 -17.604 14.769 1.00 17.16 O ATOM 214 CB GLN A 29 15.438 -18.920 14.730 1.00 21.74 C ATOM 215 CG GLN A 29 16.197 -20.099 15.338 1.00 28.91 C ATOM 216 CD GLN A 29 17.708 -19.825 15.495 1.00 35.36 C ATOM 217 OE1 GLN A 29 18.431 -20.560 16.201 1.00 37.73 O ATOM 218 NE2 GLN A 29 18.189 -18.781 14.815 1.00 35.68 N ATOM 0 H GLN A 29 14.831 -20.272 12.744 1.00 15.64 H new ATOM 0 HA GLN A 29 13.587 -19.776 14.977 1.00 17.69 H new ATOM 0 HB2 GLN A 29 15.944 -18.569 13.980 1.00 21.74 H new ATOM 0 HB3 GLN A 29 15.374 -18.209 15.387 1.00 21.74 H new ATOM 0 HG2 GLN A 29 15.819 -20.308 16.207 1.00 28.91 H new ATOM 0 HG3 GLN A 29 16.071 -20.881 14.779 1.00 28.91 H new ATOM 0 HE21 GLN A 29 17.661 -18.297 14.339 1.00 35.68 H new ATOM 0 HE22 GLN A 29 19.027 -18.592 14.853 1.00 35.68 H new ATOM 219 N TRP A 30 13.363 -17.477 12.723 1.00 14.95 N ATOM 220 CA TRP A 30 12.592 -16.304 12.342 1.00 15.62 C ATOM 221 C TRP A 30 11.088 -16.646 12.216 1.00 14.17 C ATOM 222 O TRP A 30 10.235 -15.835 12.562 1.00 14.34 O ATOM 223 CB TRP A 30 13.095 -15.695 10.997 1.00 16.02 C ATOM 224 CG TRP A 30 14.170 -14.662 11.236 1.00 18.04 C ATOM 225 CD1 TRP A 30 15.508 -14.741 10.883 1.00 22.23 C ATOM 226 CD2 TRP A 30 14.022 -13.447 11.959 1.00 21.41 C ATOM 227 NE1 TRP A 30 16.185 -13.639 11.354 1.00 22.35 N ATOM 228 CE2 TRP A 30 15.303 -12.830 12.021 1.00 23.89 C ATOM 229 CE3 TRP A 30 12.940 -12.812 12.569 1.00 21.23 C ATOM 230 CZ2 TRP A 30 15.512 -11.606 12.676 1.00 25.72 C ATOM 231 CZ3 TRP A 30 13.158 -11.577 13.227 1.00 24.90 C ATOM 232 CH2 TRP A 30 14.423 -11.002 13.269 1.00 25.12 C ATOM 0 H TRP A 30 13.910 -17.761 12.123 1.00 14.95 H new ATOM 0 HA TRP A 30 12.715 -15.647 13.045 1.00 15.62 H new ATOM 0 HB2 TRP A 30 13.441 -16.401 10.429 1.00 16.02 H new ATOM 0 HB3 TRP A 30 12.352 -15.289 10.524 1.00 16.02 H new ATOM 0 HD1 TRP A 30 15.892 -15.436 10.399 1.00 22.23 H new ATOM 0 HE1 TRP A 30 17.024 -13.484 11.247 1.00 22.35 H new ATOM 0 HE3 TRP A 30 12.092 -13.192 12.544 1.00 21.23 H new ATOM 0 HZ2 TRP A 30 16.356 -11.216 12.709 1.00 25.72 H new ATOM 0 HZ3 TRP A 30 12.444 -11.144 13.637 1.00 24.90 H new ATOM 0 HH2 TRP A 30 14.538 -10.190 13.708 1.00 25.12 H new ATOM 233 N TYR A 31 10.772 -17.833 11.728 1.00 14.16 N ATOM 234 CA TYR A 31 9.376 -18.211 11.598 1.00 18.01 C ATOM 235 C TYR A 31 8.735 -18.313 12.999 1.00 20.13 C ATOM 236 O TYR A 31 7.583 -17.881 13.170 1.00 21.64 O ATOM 237 CB TYR A 31 9.223 -19.540 10.844 1.00 17.44 C ATOM 238 CG TYR A 31 7.771 -19.849 10.546 1.00 19.47 C ATOM 239 CD1 TYR A 31 7.051 -19.036 9.678 1.00 19.91 C ATOM 240 CD2 TYR A 31 7.106 -20.902 11.166 1.00 21.38 C ATOM 241 CE1 TYR A 31 5.692 -19.245 9.419 1.00 22.69 C ATOM 242 CE2 TYR A 31 5.715 -21.128 10.904 1.00 23.40 C ATOM 243 CZ TYR A 31 5.040 -20.292 10.028 1.00 23.89 C ATOM 244 OH TYR A 31 3.737 -20.527 9.665 1.00 24.16 O ATOM 0 H TYR A 31 11.339 -18.426 11.470 1.00 14.16 H new ATOM 0 HA TYR A 31 8.921 -17.527 11.082 1.00 18.01 H new ATOM 0 HB2 TYR A 31 9.723 -19.501 10.014 1.00 17.44 H new ATOM 0 HB3 TYR A 31 9.605 -20.258 11.372 1.00 17.44 H new ATOM 0 HD1 TYR A 31 7.486 -18.331 9.256 1.00 19.91 H new ATOM 0 HD2 TYR A 31 7.565 -21.460 11.751 1.00 21.38 H new ATOM 0 HE1 TYR A 31 5.233 -18.680 8.840 1.00 22.69 H new ATOM 0 HE2 TYR A 31 5.268 -21.830 11.319 1.00 23.40 H new ATOM 0 HH TYR A 31 3.440 -21.185 10.095 1.00 24.16 H new ATOM 245 N LYS A 32 9.448 -18.902 13.964 1.00 19.31 N ATOM 246 CA LYS A 32 8.942 -19.003 15.328 1.00 23.93 C ATOM 247 C LYS A 32 8.615 -17.605 15.872 1.00 25.89 C ATOM 248 O LYS A 32 7.536 -17.415 16.441 1.00 25.10 O ATOM 249 CB LYS A 32 9.949 -19.652 16.272 1.00 23.80 C ATOM 250 CG LYS A 32 9.910 -21.142 16.293 1.00 29.58 C ATOM 251 CD LYS A 32 11.163 -21.764 16.956 1.00 32.29 C ATOM 252 CE LYS A 32 12.447 -21.384 16.160 1.00 33.62 C ATOM 253 NZ LYS A 32 13.460 -22.470 15.897 1.00 31.30 N ATOM 0 H LYS A 32 10.226 -19.248 13.845 1.00 19.31 H new ATOM 0 HA LYS A 32 8.147 -19.558 15.290 1.00 23.93 H new ATOM 0 HB2 LYS A 32 10.841 -19.367 16.019 1.00 23.80 H new ATOM 0 HB3 LYS A 32 9.790 -19.323 17.171 1.00 23.80 H new ATOM 0 HG2 LYS A 32 9.118 -21.434 16.770 1.00 29.58 H new ATOM 0 HG3 LYS A 32 9.832 -21.472 15.384 1.00 29.58 H new ATOM 0 HD2 LYS A 32 11.239 -21.453 17.871 1.00 32.29 H new ATOM 0 HD3 LYS A 32 11.072 -22.729 16.991 1.00 32.29 H new ATOM 0 HE2 LYS A 32 12.170 -21.021 15.304 1.00 33.62 H new ATOM 0 HE3 LYS A 32 12.894 -20.669 16.640 1.00 33.62 H new ATOM 0 HZ1 LYS A 32 14.085 -22.165 15.342 1.00 31.30 H new ATOM 0 HZ2 LYS A 32 13.839 -22.715 16.664 1.00 31.30 H new ATOM 0 HZ3 LYS A 32 13.054 -23.172 15.530 1.00 31.30 H new ATOM 254 N GLY A 33 9.551 -16.655 15.717 1.00 24.43 N ATOM 255 CA GLY A 33 9.335 -15.293 16.164 1.00 25.82 C ATOM 256 C GLY A 33 8.202 -14.613 15.409 1.00 25.40 C ATOM 257 O GLY A 33 7.360 -13.927 15.999 1.00 25.68 O ATOM 0 H GLY A 33 10.318 -16.792 15.352 1.00 24.43 H new ATOM 0 HA2 GLY A 33 9.134 -15.294 17.113 1.00 25.82 H new ATOM 0 HA3 GLY A 33 10.152 -14.783 16.047 1.00 25.82 H new ATOM 258 N PHE A 34 8.147 -14.829 14.096 1.00 23.23 N ATOM 259 CA PHE A 34 7.121 -14.239 13.268 1.00 24.34 C ATOM 260 C PHE A 34 5.746 -14.740 13.750 1.00 25.92 C ATOM 261 O PHE A 34 4.807 -13.969 13.893 1.00 27.74 O ATOM 262 CB PHE A 34 7.324 -14.663 11.815 1.00 19.27 C ATOM 263 CG PHE A 34 6.324 -14.092 10.861 1.00 20.62 C ATOM 264 CD1 PHE A 34 6.502 -12.804 10.332 1.00 23.08 C ATOM 265 CD2 PHE A 34 5.256 -14.865 10.405 1.00 20.85 C ATOM 266 CE1 PHE A 34 5.643 -12.298 9.358 1.00 22.93 C ATOM 267 CE2 PHE A 34 4.381 -14.369 9.423 1.00 22.20 C ATOM 268 CZ PHE A 34 4.579 -13.075 8.895 1.00 21.57 C ATOM 0 H PHE A 34 8.707 -15.322 13.668 1.00 23.23 H new ATOM 0 HA PHE A 34 7.168 -13.272 13.331 1.00 24.34 H new ATOM 0 HB2 PHE A 34 8.213 -14.397 11.533 1.00 19.27 H new ATOM 0 HB3 PHE A 34 7.288 -15.631 11.764 1.00 19.27 H new ATOM 0 HD1 PHE A 34 7.206 -12.279 10.637 1.00 23.08 H new ATOM 0 HD2 PHE A 34 5.122 -15.717 10.754 1.00 20.85 H new ATOM 0 HE1 PHE A 34 5.778 -11.444 9.017 1.00 22.93 H new ATOM 0 HE2 PHE A 34 3.673 -14.892 9.122 1.00 22.20 H new ATOM 0 HZ PHE A 34 4.005 -12.742 8.243 1.00 21.57 H new ATOM 269 N ILE A 35 5.637 -16.042 13.962 1.00 28.17 N ATOM 270 CA ILE A 35 4.384 -16.649 14.427 1.00 31.93 C ATOM 271 C ILE A 35 3.999 -16.218 15.842 1.00 32.88 C ATOM 272 O ILE A 35 2.814 -15.976 16.111 1.00 34.41 O ATOM 273 CB ILE A 35 4.450 -18.204 14.346 1.00 31.59 C ATOM 274 CG1 ILE A 35 4.225 -18.612 12.899 1.00 30.72 C ATOM 275 CG2 ILE A 35 3.404 -18.864 15.244 1.00 32.53 C ATOM 276 CD1 ILE A 35 2.979 -18.031 12.304 1.00 32.44 C ATOM 0 H ILE A 35 6.279 -16.602 13.843 1.00 28.17 H new ATOM 0 HA ILE A 35 3.693 -16.325 13.829 1.00 31.93 H new ATOM 0 HB ILE A 35 5.320 -18.500 14.657 1.00 31.59 H new ATOM 0 HG12 ILE A 35 4.988 -18.334 12.369 1.00 30.72 H new ATOM 0 HG13 ILE A 35 4.180 -19.580 12.846 1.00 30.72 H new ATOM 0 HG21 ILE A 35 3.474 -19.828 15.168 1.00 32.53 H new ATOM 0 HG22 ILE A 35 3.555 -18.601 16.165 1.00 32.53 H new ATOM 0 HG23 ILE A 35 2.517 -18.582 14.969 1.00 32.53 H new ATOM 0 HD11 ILE A 35 2.891 -18.326 11.384 1.00 32.44 H new ATOM 0 HD12 ILE A 35 2.208 -18.327 12.813 1.00 32.44 H new ATOM 0 HD13 ILE A 35 3.029 -17.063 12.329 1.00 32.44 H new ATOM 277 N LYS A 36 4.969 -16.110 16.743 1.00 35.71 N ATOM 278 CA LYS A 36 4.635 -15.689 18.099 1.00 38.45 C ATOM 279 C LYS A 36 4.000 -14.290 18.020 1.00 40.23 C ATOM 280 O LYS A 36 2.921 -14.058 18.581 1.00 40.00 O ATOM 281 CB LYS A 36 5.864 -15.634 18.986 1.00 40.35 C ATOM 282 CG LYS A 36 5.537 -15.240 20.427 1.00 42.65 C ATOM 283 CD LYS A 36 6.790 -14.965 21.227 1.00 44.52 C ATOM 284 CE LYS A 36 6.462 -14.490 22.647 1.00 46.38 C ATOM 285 NZ LYS A 36 7.697 -14.020 23.350 1.00 47.60 N ATOM 0 H LYS A 36 5.801 -16.270 16.598 1.00 35.71 H new ATOM 0 HA LYS A 36 4.021 -16.332 18.487 1.00 38.45 H new ATOM 0 HB2 LYS A 36 6.299 -16.501 18.983 1.00 40.35 H new ATOM 0 HB3 LYS A 36 6.496 -14.998 18.617 1.00 40.35 H new ATOM 0 HG2 LYS A 36 4.972 -14.451 20.427 1.00 42.65 H new ATOM 0 HG3 LYS A 36 5.031 -15.951 20.851 1.00 42.65 H new ATOM 0 HD2 LYS A 36 7.329 -15.770 21.271 1.00 44.52 H new ATOM 0 HD3 LYS A 36 7.322 -14.292 20.775 1.00 44.52 H new ATOM 0 HE2 LYS A 36 5.813 -13.770 22.610 1.00 46.38 H new ATOM 0 HE3 LYS A 36 6.055 -15.214 23.149 1.00 46.38 H new ATOM 0 HZ1 LYS A 36 7.486 -13.749 24.171 1.00 47.60 H new ATOM 0 HZ2 LYS A 36 8.283 -14.688 23.400 1.00 47.60 H new ATOM 0 HZ3 LYS A 36 8.057 -13.343 22.898 1.00 47.60 H new ATOM 286 N ASP A 37 4.648 -13.376 17.295 1.00 39.39 N ATOM 287 CA ASP A 37 4.117 -12.025 17.162 1.00 39.55 C ATOM 288 C ASP A 37 2.919 -11.875 16.220 1.00 38.92 C ATOM 289 O ASP A 37 2.125 -10.952 16.381 1.00 40.28 O ATOM 290 CB ASP A 37 5.204 -11.055 16.715 1.00 41.20 C ATOM 291 CG ASP A 37 6.368 -11.008 17.668 1.00 43.03 C ATOM 292 OD1 ASP A 37 6.172 -11.322 18.867 1.00 45.12 O ATOM 293 OD2 ASP A 37 7.486 -10.645 17.224 1.00 44.72 O ATOM 0 H ASP A 37 5.387 -13.518 16.878 1.00 39.39 H new ATOM 0 HA ASP A 37 3.795 -11.815 18.053 1.00 39.55 H new ATOM 0 HB2 ASP A 37 5.521 -11.313 15.835 1.00 41.20 H new ATOM 0 HB3 ASP A 37 4.824 -10.166 16.630 1.00 41.20 H new ATOM 294 N CYS A 38 2.773 -12.745 15.224 1.00 37.24 N ATOM 295 CA CYS A 38 1.645 -12.644 14.290 1.00 37.05 C ATOM 296 C CYS A 38 0.956 -13.998 14.133 1.00 35.82 C ATOM 297 O CYS A 38 1.120 -14.679 13.103 1.00 33.66 O ATOM 298 CB CYS A 38 2.083 -12.201 12.877 1.00 37.81 C ATOM 299 SG ACYS A 38 0.679 -11.767 11.851 0.50 39.44 S ATOM 300 SG BCYS A 38 2.921 -10.626 12.696 0.50 39.16 S ATOM 0 H CYS A 38 3.310 -13.398 15.069 1.00 37.24 H new ATOM 0 HA CYS A 38 1.048 -11.980 14.669 1.00 37.05 H new ATOM 0 HB2ACYS A 38 2.680 -11.440 12.947 0.50 37.81 H new ATOM 0 HB2BCYS A 38 2.667 -12.889 12.520 0.50 37.81 H new ATOM 0 HB3ACYS A 38 2.584 -12.916 12.454 0.50 37.81 H new ATOM 0 HB3BCYS A 38 1.292 -12.181 12.316 0.50 37.81 H new ATOM 0 HG ACYS A 38 0.555 -10.574 11.826 0.50 39.16 H new ATOM 0 HG BCYS A 38 3.394 -10.548 11.596 0.50 39.16 H new ATOM 301 N PRO A 39 0.124 -14.379 15.117 1.00 36.46 N ATOM 302 CA PRO A 39 -0.603 -15.653 15.126 1.00 36.12 C ATOM 303 C PRO A 39 -1.205 -16.117 13.816 1.00 37.42 C ATOM 304 O PRO A 39 -1.120 -17.308 13.452 1.00 38.29 O ATOM 305 CB PRO A 39 -1.646 -15.435 16.221 1.00 36.33 C ATOM 306 CG PRO A 39 -0.873 -14.665 17.224 1.00 36.33 C ATOM 307 CD PRO A 39 -0.162 -13.616 16.348 1.00 36.68 C ATOM 0 HA PRO A 39 0.008 -16.389 15.287 1.00 36.12 H new ATOM 0 HB2 PRO A 39 -2.416 -14.942 15.898 1.00 36.33 H new ATOM 0 HB3 PRO A 39 -1.977 -16.273 16.581 1.00 36.33 H new ATOM 0 HG2 PRO A 39 -1.449 -14.253 17.888 1.00 36.33 H new ATOM 0 HG3 PRO A 39 -0.242 -15.225 17.704 1.00 36.33 H new ATOM 0 HD2 PRO A 39 -0.726 -12.847 16.174 1.00 36.68 H new ATOM 0 HD3 PRO A 39 0.649 -13.285 16.765 1.00 36.68 H new ATOM 308 N SER A 40 -1.806 -15.184 13.095 1.00 36.77 N ATOM 309 CA SER A 40 -2.447 -15.476 11.815 1.00 35.82 C ATOM 310 C SER A 40 -1.463 -15.782 10.688 1.00 37.38 C ATOM 311 O SER A 40 -1.858 -16.316 9.642 1.00 36.50 O ATOM 312 CB SER A 40 -3.285 -14.272 11.387 1.00 36.55 C ATOM 313 OG SER A 40 -2.431 -13.149 11.127 1.00 34.44 O ATOM 0 H SER A 40 -1.856 -14.359 13.332 1.00 36.77 H new ATOM 0 HA SER A 40 -2.986 -16.270 11.958 1.00 35.82 H new ATOM 0 HB2 SER A 40 -3.796 -14.490 10.592 1.00 36.55 H new ATOM 0 HB3 SER A 40 -3.923 -14.049 12.082 1.00 36.55 H new ATOM 0 HG SER A 40 -2.897 -12.491 10.891 1.00 34.44 H new ATOM 314 N GLY A 41 -0.195 -15.407 10.872 1.00 37.53 N ATOM 315 CA GLY A 41 0.785 -15.635 9.824 1.00 38.70 C ATOM 316 C GLY A 41 0.682 -14.589 8.716 1.00 40.02 C ATOM 317 O GLY A 41 1.315 -14.720 7.671 1.00 39.66 O ATOM 0 H GLY A 41 0.108 -15.028 11.582 1.00 37.53 H new ATOM 0 HA2 GLY A 41 1.677 -15.616 10.205 1.00 38.70 H new ATOM 0 HA3 GLY A 41 0.656 -16.519 9.447 1.00 38.70 H new ATOM 318 N GLN A 42 -0.131 -13.560 8.948 1.00 41.26 N ATOM 319 CA GLN A 42 -0.344 -12.468 7.994 1.00 42.61 C ATOM 320 C GLN A 42 -0.114 -11.140 8.721 1.00 42.78 C ATOM 321 O GLN A 42 -0.975 -10.688 9.479 1.00 42.83 O ATOM 322 CB GLN A 42 -1.792 -12.443 7.472 1.00 44.64 C ATOM 323 CG GLN A 42 -2.313 -13.694 6.796 1.00 46.70 C ATOM 324 CD GLN A 42 -1.653 -13.956 5.461 1.00 48.20 C ATOM 325 OE1 GLN A 42 -1.631 -13.088 4.590 1.00 50.08 O ATOM 326 NE2 GLN A 42 -1.119 -15.164 5.288 1.00 47.75 N ATOM 0 H GLN A 42 -0.582 -13.474 9.675 1.00 41.26 H new ATOM 0 HA GLN A 42 0.265 -12.599 7.251 1.00 42.61 H new ATOM 0 HB2 GLN A 42 -2.376 -12.241 8.220 1.00 44.64 H new ATOM 0 HB3 GLN A 42 -1.871 -11.708 6.844 1.00 44.64 H new ATOM 0 HG2 GLN A 42 -2.168 -14.456 7.379 1.00 46.70 H new ATOM 0 HG3 GLN A 42 -3.271 -13.613 6.668 1.00 46.70 H new ATOM 0 HE21 GLN A 42 -1.154 -15.745 5.921 1.00 47.75 H new ATOM 0 HE22 GLN A 42 -0.739 -15.363 4.543 1.00 47.75 H new ATOM 327 N LEU A 43 1.033 -10.514 8.487 1.00 42.58 N ATOM 328 CA LEU A 43 1.349 -9.233 9.114 1.00 42.45 C ATOM 329 C LEU A 43 0.607 -8.141 8.327 1.00 42.57 C ATOM 330 O LEU A 43 0.802 -7.978 7.123 1.00 42.40 O ATOM 331 CB LEU A 43 2.870 -9.028 9.074 1.00 42.42 C ATOM 332 CG LEU A 43 3.605 -7.825 9.676 1.00 42.94 C ATOM 333 CD1 LEU A 43 3.216 -7.629 11.118 1.00 43.62 C ATOM 334 CD2 LEU A 43 5.105 -8.077 9.572 1.00 42.27 C ATOM 0 H LEU A 43 1.647 -10.815 7.965 1.00 42.58 H new ATOM 0 HA LEU A 43 1.069 -9.201 10.042 1.00 42.45 H new ATOM 0 HB2 LEU A 43 3.257 -9.814 9.490 1.00 42.42 H new ATOM 0 HB3 LEU A 43 3.119 -9.052 8.137 1.00 42.42 H new ATOM 0 HG LEU A 43 3.364 -7.021 9.189 1.00 42.94 H new ATOM 0 HD11 LEU A 43 3.691 -6.865 11.480 1.00 43.62 H new ATOM 0 HD12 LEU A 43 2.260 -7.474 11.177 1.00 43.62 H new ATOM 0 HD13 LEU A 43 3.446 -8.423 11.626 1.00 43.62 H new ATOM 0 HD21 LEU A 43 5.587 -7.324 9.949 1.00 42.27 H new ATOM 0 HD22 LEU A 43 5.333 -8.883 10.061 1.00 42.27 H new ATOM 0 HD23 LEU A 43 5.351 -8.184 8.640 1.00 42.27 H new ATOM 335 N ASP A 44 -0.271 -7.405 8.989 1.00 43.25 N ATOM 336 CA ASP A 44 -1.016 -6.370 8.281 1.00 43.78 C ATOM 337 C ASP A 44 -0.419 -4.981 8.534 1.00 42.51 C ATOM 338 O ASP A 44 0.391 -4.800 9.448 1.00 40.22 O ATOM 339 CB ASP A 44 -2.506 -6.423 8.682 1.00 46.32 C ATOM 340 CG ASP A 44 -2.780 -5.820 10.061 1.00 48.74 C ATOM 341 OD1 ASP A 44 -2.936 -4.580 10.146 1.00 51.63 O ATOM 342 OD2 ASP A 44 -2.843 -6.574 11.063 1.00 51.04 O ATOM 0 H ASP A 44 -0.450 -7.482 9.827 1.00 43.25 H new ATOM 0 HA ASP A 44 -0.948 -6.540 7.328 1.00 43.78 H new ATOM 0 HB2 ASP A 44 -3.031 -5.949 8.018 1.00 46.32 H new ATOM 0 HB3 ASP A 44 -2.805 -7.346 8.674 1.00 46.32 H new ATOM 343 N ALA A 45 -0.820 -4.020 7.701 1.00 43.30 N ATOM 344 CA ALA A 45 -0.343 -2.630 7.790 1.00 43.63 C ATOM 345 C ALA A 45 -0.353 -2.095 9.223 1.00 43.69 C ATOM 346 O ALA A 45 0.606 -1.466 9.669 1.00 43.48 O ATOM 347 CB ALA A 45 -1.180 -1.724 6.868 1.00 43.23 C ATOM 0 H ALA A 45 -1.380 -4.153 7.063 1.00 43.30 H new ATOM 0 HA ALA A 45 0.581 -2.624 7.496 1.00 43.63 H new ATOM 0 HB1 ALA A 45 -0.859 -0.811 6.933 1.00 43.23 H new ATOM 0 HB2 ALA A 45 -1.098 -2.031 5.951 1.00 43.23 H new ATOM 0 HB3 ALA A 45 -2.111 -1.759 7.138 1.00 43.23 H new ATOM 348 N ALA A 46 -1.432 -2.369 9.952 1.00 44.41 N ATOM 349 CA ALA A 46 -1.560 -1.918 11.337 1.00 44.91 C ATOM 350 C ALA A 46 -0.578 -2.630 12.261 1.00 44.97 C ATOM 351 O ALA A 46 -0.057 -2.042 13.208 1.00 46.01 O ATOM 352 CB ALA A 46 -3.005 -2.141 11.832 1.00 45.34 C ATOM 0 H ALA A 46 -2.106 -2.818 9.661 1.00 44.41 H new ATOM 0 HA ALA A 46 -1.349 -0.971 11.358 1.00 44.91 H new ATOM 0 HB1 ALA A 46 -3.083 -1.840 12.751 1.00 45.34 H new ATOM 0 HB2 ALA A 46 -3.619 -1.638 11.274 1.00 45.34 H new ATOM 0 HB3 ALA A 46 -3.222 -3.085 11.782 1.00 45.34 H new ATOM 353 N GLY A 47 -0.336 -3.906 12.009 1.00 45.30 N ATOM 354 CA GLY A 47 0.601 -4.626 12.849 1.00 45.87 C ATOM 355 C GLY A 47 2.007 -4.182 12.492 1.00 46.26 C ATOM 356 O GLY A 47 2.919 -4.161 13.337 1.00 46.91 O ATOM 0 H GLY A 47 -0.693 -4.363 11.374 1.00 45.30 H new ATOM 0 HA2 GLY A 47 0.419 -4.449 13.785 1.00 45.87 H new ATOM 0 HA3 GLY A 47 0.506 -5.582 12.717 1.00 45.87 H new ATOM 357 N PHE A 48 2.196 -3.817 11.229 1.00 45.58 N ATOM 358 CA PHE A 48 3.517 -3.375 10.799 1.00 46.10 C ATOM 359 C PHE A 48 3.801 -2.003 11.405 1.00 47.64 C ATOM 360 O PHE A 48 4.930 -1.699 11.759 1.00 47.13 O ATOM 361 CB PHE A 48 3.594 -3.318 9.265 1.00 42.88 C ATOM 362 CG PHE A 48 5.000 -3.272 8.738 1.00 39.33 C ATOM 363 CD1 PHE A 48 5.537 -2.087 8.247 1.00 37.13 C ATOM 364 CD2 PHE A 48 5.804 -4.410 8.776 1.00 37.18 C ATOM 365 CE1 PHE A 48 6.873 -2.045 7.801 1.00 36.83 C ATOM 366 CE2 PHE A 48 7.138 -4.375 8.333 1.00 37.45 C ATOM 367 CZ PHE A 48 7.666 -3.186 7.847 1.00 35.41 C ATOM 0 H PHE A 48 1.590 -3.817 10.619 1.00 45.58 H new ATOM 0 HA PHE A 48 4.186 -4.007 11.105 1.00 46.10 H new ATOM 0 HB2 PHE A 48 3.143 -4.094 8.896 1.00 42.88 H new ATOM 0 HB3 PHE A 48 3.113 -2.536 8.953 1.00 42.88 H new ATOM 0 HD1 PHE A 48 5.013 -1.320 8.213 1.00 37.13 H new ATOM 0 HD2 PHE A 48 5.452 -5.207 9.100 1.00 37.18 H new ATOM 0 HE1 PHE A 48 7.226 -1.249 7.474 1.00 36.83 H new ATOM 0 HE2 PHE A 48 7.663 -5.142 8.365 1.00 37.45 H new ATOM 0 HZ PHE A 48 8.548 -3.153 7.553 1.00 35.41 H new ATOM 368 N GLN A 49 2.753 -1.192 11.537 1.00 50.29 N ATOM 369 CA GLN A 49 2.867 0.148 12.108 1.00 52.26 C ATOM 370 C GLN A 49 3.365 0.148 13.545 1.00 53.82 C ATOM 371 O GLN A 49 3.966 1.123 13.997 1.00 53.78 O ATOM 372 CB GLN A 49 1.519 0.851 12.091 1.00 53.41 C ATOM 373 CG GLN A 49 1.627 2.300 11.736 1.00 54.25 C ATOM 374 CD GLN A 49 1.784 2.454 10.257 1.00 54.69 C ATOM 375 OE1 GLN A 49 2.154 1.506 9.571 1.00 56.18 O ATOM 376 NE2 GLN A 49 1.498 3.636 9.747 1.00 54.91 N ATOM 0 H GLN A 49 1.955 -1.404 11.297 1.00 50.29 H new ATOM 0 HA GLN A 49 3.516 0.611 11.555 1.00 52.26 H new ATOM 0 HB2 GLN A 49 0.936 0.409 11.454 1.00 53.41 H new ATOM 0 HB3 GLN A 49 1.103 0.766 12.963 1.00 53.41 H new ATOM 0 HG2 GLN A 49 0.836 2.774 12.036 1.00 54.25 H new ATOM 0 HG3 GLN A 49 2.385 2.697 12.192 1.00 54.25 H new ATOM 0 HE21 GLN A 49 1.242 4.276 10.261 1.00 54.91 H new ATOM 0 HE22 GLN A 49 1.568 3.767 8.900 1.00 54.91 H new ATOM 377 N LYS A 50 3.090 -0.935 14.269 1.00 55.35 N ATOM 378 CA LYS A 50 3.502 -1.037 15.663 1.00 56.52 C ATOM 379 C LYS A 50 4.977 -1.347 15.814 1.00 56.41 C ATOM 380 O LYS A 50 5.645 -0.782 16.676 1.00 56.67 O ATOM 381 CB LYS A 50 2.674 -2.097 16.389 1.00 58.09 C ATOM 382 CG LYS A 50 1.218 -1.725 16.548 1.00 59.37 C ATOM 383 CD LYS A 50 0.502 -2.753 17.401 1.00 61.38 C ATOM 384 CE LYS A 50 -0.953 -2.364 17.617 1.00 61.89 C ATOM 385 NZ LYS A 50 -1.739 -3.544 18.063 1.00 62.59 N ATOM 0 H LYS A 50 2.666 -1.621 13.970 1.00 55.35 H new ATOM 0 HA LYS A 50 3.345 -0.168 16.064 1.00 56.52 H new ATOM 0 HB2 LYS A 50 2.735 -2.933 15.902 1.00 58.09 H new ATOM 0 HB3 LYS A 50 3.058 -2.251 17.266 1.00 58.09 H new ATOM 0 HG2 LYS A 50 1.145 -0.849 16.957 1.00 59.37 H new ATOM 0 HG3 LYS A 50 0.795 -1.668 15.677 1.00 59.37 H new ATOM 0 HD2 LYS A 50 0.548 -3.622 16.973 1.00 61.38 H new ATOM 0 HD3 LYS A 50 0.949 -2.835 18.258 1.00 61.38 H new ATOM 0 HE2 LYS A 50 -1.011 -1.659 18.280 1.00 61.89 H new ATOM 0 HE3 LYS A 50 -1.326 -2.011 16.794 1.00 61.89 H new ATOM 0 HZ1 LYS A 50 -2.588 -3.306 18.186 1.00 62.59 H new ATOM 0 HZ2 LYS A 50 -1.697 -4.181 17.443 1.00 62.59 H new ATOM 0 HZ3 LYS A 50 -1.404 -3.853 18.827 1.00 62.59 H new ATOM 386 N ILE A 51 5.493 -2.244 14.984 1.00 56.27 N ATOM 387 CA ILE A 51 6.911 -2.566 15.055 1.00 56.60 C ATOM 388 C ILE A 51 7.703 -1.260 15.006 1.00 56.62 C ATOM 389 O ILE A 51 8.700 -1.094 15.710 1.00 56.71 O ATOM 390 CB ILE A 51 7.378 -3.437 13.863 1.00 56.19 C ATOM 391 CG1 ILE A 51 6.795 -4.848 13.960 1.00 56.23 C ATOM 392 CG2 ILE A 51 8.888 -3.504 13.849 1.00 55.70 C ATOM 393 CD1 ILE A 51 7.333 -5.806 12.883 1.00 55.24 C ATOM 0 H ILE A 51 5.049 -2.670 14.383 1.00 56.27 H new ATOM 0 HA ILE A 51 7.060 -3.061 15.876 1.00 56.60 H new ATOM 0 HB ILE A 51 7.062 -3.033 13.040 1.00 56.19 H new ATOM 0 HG12 ILE A 51 6.993 -5.213 14.837 1.00 56.23 H new ATOM 0 HG13 ILE A 51 5.829 -4.798 13.885 1.00 56.23 H new ATOM 0 HG21 ILE A 51 9.181 -4.050 13.102 1.00 55.70 H new ATOM 0 HG22 ILE A 51 9.251 -2.609 13.757 1.00 55.70 H new ATOM 0 HG23 ILE A 51 9.202 -3.896 14.679 1.00 55.70 H new ATOM 0 HD11 ILE A 51 6.928 -6.680 12.996 1.00 55.24 H new ATOM 0 HD12 ILE A 51 7.114 -5.460 12.004 1.00 55.24 H new ATOM 0 HD13 ILE A 51 8.296 -5.882 12.969 1.00 55.24 H new ATOM 394 N TYR A 52 7.253 -0.338 14.159 1.00 56.41 N ATOM 395 CA TYR A 52 7.923 0.947 14.015 1.00 56.46 C ATOM 396 C TYR A 52 7.606 1.887 15.176 1.00 57.68 C ATOM 397 O TYR A 52 8.509 2.490 15.752 1.00 57.80 O ATOM 398 CB TYR A 52 7.558 1.599 12.670 1.00 53.16 C ATOM 399 CG TYR A 52 8.483 1.197 11.538 1.00 50.02 C ATOM 400 CD1 TYR A 52 8.198 0.100 10.721 1.00 48.16 C ATOM 401 CD2 TYR A 52 9.699 1.865 11.342 1.00 48.65 C ATOM 402 CE1 TYR A 52 9.103 -0.332 9.736 1.00 46.36 C ATOM 403 CE2 TYR A 52 10.610 1.441 10.372 1.00 47.15 C ATOM 404 CZ TYR A 52 10.310 0.338 9.571 1.00 46.74 C ATOM 405 OH TYR A 52 11.252 -0.113 8.659 1.00 44.30 O ATOM 0 H TYR A 52 6.561 -0.439 13.659 1.00 56.41 H new ATOM 0 HA TYR A 52 8.879 0.781 14.031 1.00 56.46 H new ATOM 0 HB2 TYR A 52 6.648 1.357 12.437 1.00 53.16 H new ATOM 0 HB3 TYR A 52 7.579 2.564 12.769 1.00 53.16 H new ATOM 0 HD1 TYR A 52 7.394 -0.353 10.831 1.00 48.16 H new ATOM 0 HD2 TYR A 52 9.903 2.605 11.868 1.00 48.65 H new ATOM 0 HE1 TYR A 52 8.896 -1.062 9.198 1.00 46.36 H new ATOM 0 HE2 TYR A 52 11.415 1.893 10.260 1.00 47.15 H new ATOM 0 HH TYR A 52 11.922 0.393 8.674 1.00 44.30 H new ATOM 406 N LYS A 53 6.330 1.996 15.530 1.00 59.59 N ATOM 407 CA LYS A 53 5.942 2.865 16.629 1.00 61.62 C ATOM 408 C LYS A 53 6.792 2.508 17.842 1.00 62.51 C ATOM 409 O LYS A 53 7.076 3.367 18.670 1.00 62.68 O ATOM 410 CB LYS A 53 4.451 2.704 16.960 1.00 61.89 C ATOM 411 CG LYS A 53 3.805 3.968 17.529 1.00 61.58 C ATOM 412 CD LYS A 53 3.592 5.012 16.437 1.00 62.49 C ATOM 413 CE LYS A 53 3.337 6.416 17.000 1.00 62.90 C ATOM 414 NZ LYS A 53 4.554 6.977 17.682 1.00 63.84 N ATOM 0 H LYS A 53 5.681 1.579 15.150 1.00 59.59 H new ATOM 0 HA LYS A 53 6.086 3.790 16.376 1.00 61.62 H new ATOM 0 HB2 LYS A 53 3.976 2.442 16.156 1.00 61.89 H new ATOM 0 HB3 LYS A 53 4.346 1.982 17.599 1.00 61.89 H new ATOM 0 HG2 LYS A 53 2.954 3.745 17.938 1.00 61.58 H new ATOM 0 HG3 LYS A 53 4.368 4.336 18.228 1.00 61.58 H new ATOM 0 HD2 LYS A 53 4.372 5.036 15.861 1.00 62.49 H new ATOM 0 HD3 LYS A 53 2.840 4.748 15.885 1.00 62.49 H new ATOM 0 HE2 LYS A 53 3.068 7.008 16.281 1.00 62.90 H new ATOM 0 HE3 LYS A 53 2.600 6.382 17.630 1.00 62.90 H new ATOM 0 HZ1 LYS A 53 4.342 7.228 18.509 1.00 63.84 H new ATOM 0 HZ2 LYS A 53 5.190 6.355 17.715 1.00 63.84 H new ATOM 0 HZ3 LYS A 53 4.852 7.681 17.226 1.00 63.84 H new ATOM 415 N GLN A 54 7.206 1.243 17.931 1.00 63.92 N ATOM 416 CA GLN A 54 8.050 0.771 19.036 1.00 65.43 C ATOM 417 C GLN A 54 9.351 1.568 19.062 1.00 66.14 C ATOM 418 O GLN A 54 9.659 2.254 20.038 1.00 66.09 O ATOM 419 CB GLN A 54 8.434 -0.708 18.867 1.00 66.00 C ATOM 420 CG GLN A 54 7.297 -1.680 18.600 1.00 66.68 C ATOM 421 CD GLN A 54 6.366 -1.841 19.783 1.00 67.14 C ATOM 422 OE1 GLN A 54 5.738 -0.879 20.223 1.00 66.90 O ATOM 423 NE2 GLN A 54 6.274 -3.063 20.305 1.00 66.65 N ATOM 0 H GLN A 54 7.007 0.635 17.356 1.00 63.92 H new ATOM 0 HA GLN A 54 7.540 0.885 19.853 1.00 65.43 H new ATOM 0 HB2 GLN A 54 9.068 -0.775 18.136 1.00 66.00 H new ATOM 0 HB3 GLN A 54 8.896 -0.995 19.670 1.00 66.00 H new ATOM 0 HG2 GLN A 54 6.788 -1.372 17.834 1.00 66.68 H new ATOM 0 HG3 GLN A 54 7.667 -2.546 18.366 1.00 66.68 H new ATOM 0 HE21 GLN A 54 6.730 -3.710 19.968 1.00 66.65 H new ATOM 0 HE22 GLN A 54 5.759 -3.205 20.979 1.00 66.65 H new ATOM 424 N PHE A 55 10.104 1.455 17.968 1.00 66.91 N ATOM 425 CA PHE A 55 11.398 2.111 17.799 1.00 67.41 C ATOM 426 C PHE A 55 11.369 3.629 17.734 1.00 67.36 C ATOM 427 O PHE A 55 12.407 4.271 17.889 1.00 67.57 O ATOM 428 CB PHE A 55 12.079 1.613 16.526 1.00 67.65 C ATOM 429 CG PHE A 55 12.334 0.145 16.508 1.00 68.82 C ATOM 430 CD1 PHE A 55 11.279 -0.757 16.563 1.00 69.40 C ATOM 431 CD2 PHE A 55 13.632 -0.342 16.403 1.00 69.35 C ATOM 432 CE1 PHE A 55 11.510 -2.129 16.509 1.00 69.87 C ATOM 433 CE2 PHE A 55 13.877 -1.707 16.348 1.00 69.85 C ATOM 434 CZ PHE A 55 12.812 -2.606 16.401 1.00 70.06 C ATOM 0 H PHE A 55 9.870 0.983 17.288 1.00 66.91 H new ATOM 0 HA PHE A 55 11.884 1.874 18.604 1.00 67.41 H new ATOM 0 HB2 PHE A 55 11.527 1.845 15.763 1.00 67.65 H new ATOM 0 HB3 PHE A 55 12.923 2.080 16.418 1.00 67.65 H new ATOM 0 HD1 PHE A 55 10.408 -0.441 16.637 1.00 69.40 H new ATOM 0 HD2 PHE A 55 14.345 0.254 16.369 1.00 69.35 H new ATOM 0 HE1 PHE A 55 10.796 -2.724 16.545 1.00 69.87 H new ATOM 0 HE2 PHE A 55 14.749 -2.021 16.276 1.00 69.85 H new ATOM 0 HZ PHE A 55 12.972 -3.521 16.364 1.00 70.06 H new ATOM 435 N PHE A 56 10.200 4.207 17.494 1.00 67.28 N ATOM 436 CA PHE A 56 10.114 5.655 17.382 1.00 67.07 C ATOM 437 C PHE A 56 8.915 6.245 18.106 1.00 67.08 C ATOM 438 O PHE A 56 8.039 6.850 17.489 1.00 66.92 O ATOM 439 CB PHE A 56 10.077 6.039 15.901 1.00 66.98 C ATOM 440 CG PHE A 56 11.256 5.533 15.123 1.00 66.67 C ATOM 441 CD1 PHE A 56 12.508 6.128 15.262 1.00 66.71 C ATOM 442 CD2 PHE A 56 11.128 4.441 14.273 1.00 66.85 C ATOM 443 CE1 PHE A 56 13.615 5.639 14.562 1.00 66.49 C ATOM 444 CE2 PHE A 56 12.231 3.943 13.569 1.00 66.41 C ATOM 445 CZ PHE A 56 13.474 4.544 13.715 1.00 66.06 C ATOM 0 H PHE A 56 9.456 3.787 17.394 1.00 67.28 H new ATOM 0 HA PHE A 56 10.899 6.026 17.814 1.00 67.07 H new ATOM 0 HB2 PHE A 56 9.263 5.691 15.504 1.00 66.98 H new ATOM 0 HB3 PHE A 56 10.039 7.005 15.825 1.00 66.98 H new ATOM 0 HD1 PHE A 56 12.609 6.859 15.827 1.00 66.71 H new ATOM 0 HD2 PHE A 56 10.298 4.035 14.170 1.00 66.85 H new ATOM 0 HE1 PHE A 56 14.445 6.045 14.662 1.00 66.49 H new ATOM 0 HE2 PHE A 56 12.131 3.211 13.004 1.00 66.41 H new ATOM 0 HZ PHE A 56 14.209 4.216 13.249 1.00 66.06 H new ATOM 446 N PRO A 57 8.870 6.095 19.438 1.00 67.48 N ATOM 447 CA PRO A 57 7.746 6.636 20.210 1.00 67.54 C ATOM 448 C PRO A 57 7.689 8.159 20.146 1.00 67.50 C ATOM 449 O PRO A 57 6.661 8.763 20.462 1.00 67.89 O ATOM 450 CB PRO A 57 8.023 6.128 21.624 1.00 67.36 C ATOM 451 CG PRO A 57 9.529 6.106 21.676 1.00 67.56 C ATOM 452 CD PRO A 57 9.894 5.514 20.328 1.00 67.38 C ATOM 0 HA PRO A 57 6.882 6.354 19.871 1.00 67.54 H new ATOM 0 HB2 PRO A 57 7.647 6.715 22.298 1.00 67.36 H new ATOM 0 HB3 PRO A 57 7.644 5.247 21.772 1.00 67.36 H new ATOM 0 HG2 PRO A 57 9.900 6.995 21.793 1.00 67.56 H new ATOM 0 HG3 PRO A 57 9.857 5.563 22.410 1.00 67.56 H new ATOM 0 HD2 PRO A 57 10.792 5.761 20.056 1.00 67.38 H new ATOM 0 HD3 PRO A 57 9.857 4.545 20.337 1.00 67.38 H new ATOM 453 N PHE A 58 8.793 8.771 19.721 1.00 67.25 N ATOM 454 CA PHE A 58 8.887 10.229 19.641 1.00 66.87 C ATOM 455 C PHE A 58 8.292 10.889 18.391 1.00 65.31 C ATOM 456 O PHE A 58 7.834 12.031 18.452 1.00 65.79 O ATOM 457 CB PHE A 58 10.351 10.657 19.800 1.00 68.06 C ATOM 458 CG PHE A 58 10.934 10.328 21.151 1.00 69.51 C ATOM 459 CD1 PHE A 58 10.402 10.901 22.312 1.00 69.76 C ATOM 460 CD2 PHE A 58 12.013 9.450 21.266 1.00 69.62 C ATOM 461 CE1 PHE A 58 10.936 10.605 23.566 1.00 70.01 C ATOM 462 CE2 PHE A 58 12.557 9.147 22.518 1.00 70.02 C ATOM 463 CZ PHE A 58 12.018 9.726 23.670 1.00 70.20 C ATOM 0 H PHE A 58 9.504 8.357 19.472 1.00 67.25 H new ATOM 0 HA PHE A 58 8.330 10.547 20.369 1.00 66.87 H new ATOM 0 HB2 PHE A 58 10.883 10.225 19.113 1.00 68.06 H new ATOM 0 HB3 PHE A 58 10.418 11.613 19.651 1.00 68.06 H new ATOM 0 HD1 PHE A 58 9.683 11.487 22.246 1.00 69.76 H new ATOM 0 HD2 PHE A 58 12.374 9.062 20.502 1.00 69.62 H new ATOM 0 HE1 PHE A 58 10.573 10.991 24.330 1.00 70.01 H new ATOM 0 HE2 PHE A 58 13.276 8.561 22.584 1.00 70.02 H new ATOM 0 HZ PHE A 58 12.378 9.527 24.504 1.00 70.20 H new ATOM 464 N GLY A 59 8.301 10.184 17.264 1.00 63.08 N ATOM 465 CA GLY A 59 7.762 10.754 16.040 1.00 59.66 C ATOM 466 C GLY A 59 6.544 9.997 15.563 1.00 57.71 C ATOM 467 O GLY A 59 6.037 9.120 16.271 1.00 58.91 O ATOM 0 H GLY A 59 8.611 9.385 17.189 1.00 63.08 H new ATOM 0 HA2 GLY A 59 7.528 11.683 16.191 1.00 59.66 H new ATOM 0 HA3 GLY A 59 8.443 10.741 15.349 1.00 59.66 H new ATOM 468 N ASP A 60 6.045 10.348 14.381 1.00 54.57 N ATOM 469 CA ASP A 60 4.887 9.663 13.828 1.00 51.38 C ATOM 470 C ASP A 60 5.386 8.800 12.666 1.00 49.07 C ATOM 471 O ASP A 60 5.437 9.265 11.520 1.00 47.16 O ATOM 472 CB ASP A 60 3.834 10.668 13.328 1.00 52.18 C ATOM 473 CG ASP A 60 2.594 9.977 12.758 1.00 54.01 C ATOM 474 OD1 ASP A 60 2.442 8.756 13.024 1.00 54.77 O ATOM 475 OD2 ASP A 60 1.775 10.637 12.060 1.00 53.20 O ATOM 0 H ASP A 60 6.362 10.977 13.887 1.00 54.57 H new ATOM 0 HA ASP A 60 4.462 9.120 14.510 1.00 51.38 H new ATOM 0 HB2 ASP A 60 3.571 11.248 14.060 1.00 52.18 H new ATOM 0 HB3 ASP A 60 4.228 11.234 12.646 1.00 52.18 H new ATOM 476 N PRO A 61 5.784 7.535 12.955 1.00 47.00 N ATOM 477 CA PRO A 61 6.276 6.645 11.892 1.00 43.31 C ATOM 478 C PRO A 61 5.245 6.077 10.956 1.00 40.59 C ATOM 479 O PRO A 61 5.578 5.249 10.112 1.00 40.41 O ATOM 480 CB PRO A 61 7.044 5.565 12.653 1.00 43.90 C ATOM 481 CG PRO A 61 6.367 5.528 14.001 1.00 46.33 C ATOM 482 CD PRO A 61 6.135 7.001 14.288 1.00 47.00 C ATOM 0 HA PRO A 61 6.819 7.148 11.265 1.00 43.31 H new ATOM 0 HB2 PRO A 61 6.991 4.707 12.204 1.00 43.90 H new ATOM 0 HB3 PRO A 61 7.985 5.786 12.733 1.00 43.90 H new ATOM 0 HG2 PRO A 61 5.535 5.029 13.975 1.00 46.33 H new ATOM 0 HG3 PRO A 61 6.926 5.112 14.675 1.00 46.33 H new ATOM 0 HD2 PRO A 61 5.421 7.136 14.930 1.00 47.00 H new ATOM 0 HD3 PRO A 61 6.927 7.427 14.651 1.00 47.00 H new ATOM 483 N THR A 62 4.005 6.534 11.066 1.00 37.26 N ATOM 484 CA THR A 62 2.962 6.023 10.185 1.00 34.71 C ATOM 485 C THR A 62 3.273 6.097 8.691 1.00 31.52 C ATOM 486 O THR A 62 3.155 5.102 7.965 1.00 28.41 O ATOM 487 CB THR A 62 1.622 6.757 10.411 1.00 36.11 C ATOM 488 OG1 THR A 62 1.199 6.559 11.761 1.00 37.98 O ATOM 489 CG2 THR A 62 0.562 6.247 9.455 1.00 35.46 C ATOM 0 H THR A 62 3.748 7.128 11.632 1.00 37.26 H new ATOM 0 HA THR A 62 2.907 5.086 10.429 1.00 34.71 H new ATOM 0 HB THR A 62 1.749 7.704 10.244 1.00 36.11 H new ATOM 0 HG1 THR A 62 1.505 7.175 12.244 1.00 37.98 H new ATOM 0 HG21 THR A 62 -0.270 6.719 9.613 1.00 35.46 H new ATOM 0 HG22 THR A 62 0.851 6.397 8.541 1.00 35.46 H new ATOM 0 HG23 THR A 62 0.426 5.297 9.599 1.00 35.46 H new ATOM 490 N LYS A 63 3.690 7.263 8.217 1.00 28.21 N ATOM 491 CA LYS A 63 3.924 7.359 6.799 1.00 26.38 C ATOM 492 C LYS A 63 5.131 6.521 6.338 1.00 23.82 C ATOM 493 O LYS A 63 5.048 5.840 5.309 1.00 23.70 O ATOM 494 CB LYS A 63 4.052 8.829 6.393 1.00 27.95 C ATOM 495 CG LYS A 63 3.703 9.034 4.922 1.00 32.12 C ATOM 496 CD LYS A 63 3.255 10.445 4.593 1.00 32.70 C ATOM 497 CE LYS A 63 3.852 10.896 3.246 1.00 34.18 C ATOM 498 NZ LYS A 63 5.315 11.339 3.448 1.00 28.45 N ATOM 0 H LYS A 63 3.836 7.974 8.678 1.00 28.21 H new ATOM 0 HA LYS A 63 3.157 6.979 6.342 1.00 26.38 H new ATOM 0 HB2 LYS A 63 3.466 9.371 6.944 1.00 27.95 H new ATOM 0 HB3 LYS A 63 4.958 9.134 6.558 1.00 27.95 H new ATOM 0 HG2 LYS A 63 4.477 8.814 4.380 1.00 32.12 H new ATOM 0 HG3 LYS A 63 2.999 8.414 4.675 1.00 32.12 H new ATOM 0 HD2 LYS A 63 2.287 10.482 4.553 1.00 32.70 H new ATOM 0 HD3 LYS A 63 3.534 11.052 5.297 1.00 32.70 H new ATOM 0 HE2 LYS A 63 3.810 10.170 2.604 1.00 34.18 H new ATOM 0 HE3 LYS A 63 3.331 11.628 2.880 1.00 34.18 H new ATOM 0 HZ1 LYS A 63 5.370 12.224 3.375 1.00 28.45 H new ATOM 0 HZ2 LYS A 63 5.592 11.090 4.257 1.00 28.45 H new ATOM 0 HZ3 LYS A 63 5.829 10.958 2.829 1.00 28.45 H new ATOM 499 N PHE A 64 6.220 6.526 7.095 1.00 24.26 N ATOM 500 CA PHE A 64 7.414 5.757 6.670 1.00 24.84 C ATOM 501 C PHE A 64 7.162 4.259 6.820 1.00 24.77 C ATOM 502 O PHE A 64 7.570 3.485 5.982 1.00 24.30 O ATOM 503 CB PHE A 64 8.665 6.116 7.491 1.00 24.11 C ATOM 504 CG PHE A 64 9.942 5.415 7.008 1.00 23.78 C ATOM 505 CD1 PHE A 64 10.530 5.766 5.791 1.00 24.63 C ATOM 506 CD2 PHE A 64 10.524 4.382 7.757 1.00 22.27 C ATOM 507 CE1 PHE A 64 11.665 5.100 5.319 1.00 21.11 C ATOM 508 CE2 PHE A 64 11.665 3.704 7.288 1.00 24.66 C ATOM 509 CZ PHE A 64 12.236 4.069 6.061 1.00 23.22 C ATOM 0 H PHE A 64 6.301 6.950 7.839 1.00 24.26 H new ATOM 0 HA PHE A 64 7.573 5.989 5.742 1.00 24.84 H new ATOM 0 HB2 PHE A 64 8.800 7.076 7.457 1.00 24.11 H new ATOM 0 HB3 PHE A 64 8.510 5.884 8.420 1.00 24.11 H new ATOM 0 HD1 PHE A 64 10.160 6.454 5.286 1.00 24.63 H new ATOM 0 HD2 PHE A 64 10.151 4.142 8.574 1.00 22.27 H new ATOM 0 HE1 PHE A 64 12.041 5.347 4.505 1.00 21.11 H new ATOM 0 HE2 PHE A 64 12.039 3.016 7.790 1.00 24.66 H new ATOM 0 HZ PHE A 64 12.990 3.626 5.745 1.00 23.22 H new ATOM 510 N ALA A 65 6.503 3.851 7.901 1.00 24.33 N ATOM 511 CA ALA A 65 6.238 2.425 8.072 1.00 25.51 C ATOM 512 C ALA A 65 5.361 1.948 6.918 1.00 24.65 C ATOM 513 O ALA A 65 5.548 0.831 6.423 1.00 25.22 O ATOM 514 CB ALA A 65 5.595 2.147 9.449 1.00 24.52 C ATOM 0 H ALA A 65 6.210 4.362 8.527 1.00 24.33 H new ATOM 0 HA ALA A 65 7.070 1.927 8.054 1.00 25.51 H new ATOM 0 HB1 ALA A 65 5.427 1.196 9.542 1.00 24.52 H new ATOM 0 HB2 ALA A 65 6.196 2.439 10.152 1.00 24.52 H new ATOM 0 HB3 ALA A 65 4.757 2.631 9.519 1.00 24.52 H new ATOM 515 N THR A 66 4.432 2.777 6.444 1.00 25.53 N ATOM 516 CA THR A 66 3.600 2.385 5.307 1.00 24.58 C ATOM 517 C THR A 66 4.386 2.236 4.024 1.00 24.01 C ATOM 518 O THR A 66 4.093 1.380 3.179 1.00 21.83 O ATOM 519 CB THR A 66 2.485 3.411 5.024 1.00 27.29 C ATOM 520 OG1 THR A 66 1.485 3.264 6.016 1.00 28.09 O ATOM 521 CG2 THR A 66 1.861 3.197 3.673 1.00 25.72 C ATOM 0 H THR A 66 4.269 3.560 6.761 1.00 25.53 H new ATOM 0 HA THR A 66 3.226 1.529 5.568 1.00 24.58 H new ATOM 0 HB THR A 66 2.873 4.300 5.038 1.00 27.29 H new ATOM 0 HG1 THR A 66 1.699 3.706 6.698 1.00 28.09 H new ATOM 0 HG21 THR A 66 1.166 3.858 3.529 1.00 25.72 H new ATOM 0 HG22 THR A 66 2.539 3.286 2.985 1.00 25.72 H new ATOM 0 HG23 THR A 66 1.475 2.308 3.632 1.00 25.72 H new ATOM 522 N PHE A 67 5.361 3.117 3.838 1.00 21.85 N ATOM 523 CA PHE A 67 6.181 3.037 2.634 1.00 19.85 C ATOM 524 C PHE A 67 7.013 1.752 2.638 1.00 17.39 C ATOM 525 O PHE A 67 7.173 1.111 1.604 1.00 17.99 O ATOM 526 CB PHE A 67 7.133 4.226 2.552 1.00 18.57 C ATOM 527 CG PHE A 67 6.455 5.486 2.160 1.00 19.54 C ATOM 528 CD1 PHE A 67 5.533 5.481 1.112 1.00 18.79 C ATOM 529 CD2 PHE A 67 6.757 6.689 2.785 1.00 21.96 C ATOM 530 CE1 PHE A 67 4.913 6.663 0.676 1.00 20.05 C ATOM 531 CE2 PHE A 67 6.136 7.876 2.349 1.00 21.74 C ATOM 532 CZ PHE A 67 5.216 7.842 1.291 1.00 21.99 C ATOM 0 H PHE A 67 5.562 3.754 4.380 1.00 21.85 H new ATOM 0 HA PHE A 67 5.583 3.042 1.870 1.00 19.85 H new ATOM 0 HB2 PHE A 67 7.562 4.350 3.413 1.00 18.57 H new ATOM 0 HB3 PHE A 67 7.834 4.029 1.911 1.00 18.57 H new ATOM 0 HD1 PHE A 67 5.325 4.677 0.693 1.00 18.79 H new ATOM 0 HD2 PHE A 67 7.366 6.711 3.488 1.00 21.96 H new ATOM 0 HE1 PHE A 67 4.302 6.642 -0.025 1.00 20.05 H new ATOM 0 HE2 PHE A 67 6.337 8.684 2.764 1.00 21.74 H new ATOM 0 HZ PHE A 67 4.810 8.629 1.007 1.00 21.99 H new ATOM 533 N VAL A 68 7.494 1.370 3.806 1.00 16.65 N ATOM 534 CA VAL A 68 8.351 0.168 3.915 1.00 17.11 C ATOM 535 C VAL A 68 7.449 -1.057 3.795 1.00 18.84 C ATOM 536 O VAL A 68 7.812 -2.081 3.188 1.00 16.05 O ATOM 537 CB VAL A 68 9.114 0.100 5.263 1.00 17.02 C ATOM 538 CG1 VAL A 68 9.825 -1.275 5.397 1.00 17.14 C ATOM 539 CG2 VAL A 68 10.198 1.274 5.369 1.00 17.71 C ATOM 0 H VAL A 68 7.347 1.777 4.549 1.00 16.65 H new ATOM 0 HA VAL A 68 9.017 0.202 3.211 1.00 17.11 H new ATOM 0 HB VAL A 68 8.471 0.208 5.981 1.00 17.02 H new ATOM 0 HG11 VAL A 68 10.301 -1.313 6.242 1.00 17.14 H new ATOM 0 HG12 VAL A 68 9.165 -1.985 5.366 1.00 17.14 H new ATOM 0 HG13 VAL A 68 10.454 -1.387 4.667 1.00 17.14 H new ATOM 0 HG21 VAL A 68 10.661 1.211 6.219 1.00 17.71 H new ATOM 0 HG22 VAL A 68 10.838 1.190 4.645 1.00 17.71 H new ATOM 0 HG23 VAL A 68 9.752 2.133 5.307 1.00 17.71 H new ATOM 540 N PHE A 69 6.269 -0.953 4.384 1.00 18.12 N ATOM 541 CA PHE A 69 5.346 -2.077 4.332 1.00 17.47 C ATOM 542 C PHE A 69 5.046 -2.444 2.890 1.00 17.19 C ATOM 543 O PHE A 69 5.056 -3.629 2.538 1.00 18.48 O ATOM 544 CB PHE A 69 4.068 -1.753 5.144 1.00 18.59 C ATOM 545 CG PHE A 69 3.003 -2.777 4.988 1.00 20.09 C ATOM 546 CD1 PHE A 69 2.245 -2.802 3.834 1.00 19.76 C ATOM 547 CD2 PHE A 69 2.796 -3.728 5.967 1.00 22.38 C ATOM 548 CE1 PHE A 69 1.257 -3.801 3.644 1.00 24.66 C ATOM 549 CE2 PHE A 69 1.814 -4.739 5.800 1.00 24.73 C ATOM 550 CZ PHE A 69 1.059 -4.766 4.644 1.00 24.38 C ATOM 0 H PHE A 69 5.987 -0.261 4.809 1.00 18.12 H new ATOM 0 HA PHE A 69 5.755 -2.855 4.742 1.00 17.47 H new ATOM 0 HB2 PHE A 69 4.299 -1.675 6.083 1.00 18.59 H new ATOM 0 HB3 PHE A 69 3.723 -0.891 4.864 1.00 18.59 H new ATOM 0 HD1 PHE A 69 2.384 -2.159 3.177 1.00 19.76 H new ATOM 0 HD2 PHE A 69 3.306 -3.706 6.745 1.00 22.38 H new ATOM 0 HE1 PHE A 69 0.747 -3.817 2.867 1.00 24.66 H new ATOM 0 HE2 PHE A 69 1.680 -5.377 6.463 1.00 24.73 H new ATOM 0 HZ PHE A 69 0.416 -5.427 4.527 1.00 24.38 H new ATOM 551 N ASN A 70 4.801 -1.447 2.043 1.00 18.06 N ATOM 552 CA ASN A 70 4.504 -1.709 0.644 1.00 21.29 C ATOM 553 C ASN A 70 5.606 -2.415 -0.118 1.00 21.38 C ATOM 554 O ASN A 70 5.307 -3.176 -1.048 1.00 22.67 O ATOM 555 CB ASN A 70 4.083 -0.434 -0.095 1.00 23.41 C ATOM 556 CG ASN A 70 2.746 0.110 0.425 1.00 30.29 C ATOM 557 OD1 ASN A 70 1.997 -0.608 1.121 1.00 31.16 O ATOM 558 ND2 ASN A 70 2.436 1.373 0.099 1.00 31.05 N ATOM 0 H ASN A 70 4.803 -0.615 2.261 1.00 18.06 H new ATOM 0 HA ASN A 70 3.758 -2.329 0.670 1.00 21.29 H new ATOM 0 HB2 ASN A 70 4.770 0.243 0.010 1.00 23.41 H new ATOM 0 HB3 ASN A 70 4.010 -0.619 -1.044 1.00 23.41 H new ATOM 0 HD21 ASN A 70 1.697 1.718 0.371 1.00 31.05 H new ATOM 0 HD22 ASN A 70 2.976 1.838 -0.382 1.00 31.05 H new ATOM 559 N VAL A 71 6.877 -2.176 0.233 1.00 19.25 N ATOM 560 CA VAL A 71 7.971 -2.879 -0.425 1.00 15.92 C ATOM 561 C VAL A 71 8.072 -4.341 0.118 1.00 16.66 C ATOM 562 O VAL A 71 8.376 -5.275 -0.626 1.00 16.57 O ATOM 563 CB VAL A 71 9.358 -2.179 -0.195 1.00 17.39 C ATOM 564 CG1AVAL A 71 9.839 -2.451 1.166 0.50 16.47 C ATOM 565 CG1BVAL A 71 10.472 -2.983 -0.893 0.50 14.88 C ATOM 566 CG2AVAL A 71 10.381 -2.701 -1.223 0.50 17.45 C ATOM 567 CG2BVAL A 71 9.307 -0.743 -0.679 0.50 11.12 C ATOM 0 H VAL A 71 7.118 -1.618 0.841 1.00 19.25 H new ATOM 0 HA VAL A 71 7.773 -2.872 -1.375 1.00 15.92 H new ATOM 0 HB AVAL A 71 9.251 -1.221 -0.307 0.50 17.39 H new ATOM 0 HB BVAL A 71 9.558 -2.158 0.754 0.50 17.39 H new ATOM 0 HG11AVAL A 71 10.695 -2.016 1.300 0.50 14.88 H new ATOM 0 HG11BVAL A 71 11.326 -2.546 -0.748 0.50 14.88 H new ATOM 0 HG12AVAL A 71 9.199 -2.110 1.810 0.50 14.88 H new ATOM 0 HG12BVAL A 71 10.502 -3.881 -0.526 0.50 14.88 H new ATOM 0 HG13AVAL A 71 9.941 -3.408 1.288 0.50 14.88 H new ATOM 0 HG13BVAL A 71 10.290 -3.029 -1.845 0.50 14.88 H new ATOM 0 HG21AVAL A 71 11.236 -2.267 -1.078 0.50 11.12 H new ATOM 0 HG21BVAL A 71 10.168 -0.321 -0.532 0.50 11.12 H new ATOM 0 HG22AVAL A 71 10.484 -3.660 -1.119 0.50 11.12 H new ATOM 0 HG22BVAL A 71 9.097 -0.728 -1.626 0.50 11.12 H new ATOM 0 HG23AVAL A 71 10.067 -2.505 -2.120 0.50 11.12 H new ATOM 0 HG23BVAL A 71 8.623 -0.260 -0.189 0.50 11.12 H new ATOM 568 N PHE A 72 7.833 -4.540 1.416 1.00 15.10 N ATOM 569 CA PHE A 72 7.842 -5.881 1.977 1.00 16.32 C ATOM 570 C PHE A 72 6.738 -6.716 1.277 1.00 19.40 C ATOM 571 O PHE A 72 6.934 -7.904 0.949 1.00 16.61 O ATOM 572 CB PHE A 72 7.538 -5.841 3.488 1.00 15.54 C ATOM 573 CG PHE A 72 8.767 -5.758 4.376 1.00 17.39 C ATOM 574 CD1 PHE A 72 9.637 -4.677 4.281 1.00 15.50 C ATOM 575 CD2 PHE A 72 9.064 -6.785 5.285 1.00 17.56 C ATOM 576 CE1 PHE A 72 10.785 -4.613 5.074 1.00 18.74 C ATOM 577 CE2 PHE A 72 10.216 -6.740 6.099 1.00 18.87 C ATOM 578 CZ PHE A 72 11.087 -5.638 5.988 1.00 18.84 C ATOM 0 H PHE A 72 7.665 -3.913 1.981 1.00 15.10 H new ATOM 0 HA PHE A 72 8.718 -6.274 1.840 1.00 16.32 H new ATOM 0 HB2 PHE A 72 6.968 -5.078 3.672 1.00 15.54 H new ATOM 0 HB3 PHE A 72 7.034 -6.635 3.726 1.00 15.54 H new ATOM 0 HD1 PHE A 72 9.452 -3.989 3.683 1.00 15.50 H new ATOM 0 HD2 PHE A 72 8.488 -7.512 5.353 1.00 17.56 H new ATOM 0 HE1 PHE A 72 11.357 -3.884 4.997 1.00 18.74 H new ATOM 0 HE2 PHE A 72 10.397 -7.427 6.699 1.00 18.87 H new ATOM 0 HZ PHE A 72 11.853 -5.589 6.513 1.00 18.84 H new ATOM 579 N ASP A 73 5.583 -6.070 1.081 1.00 22.17 N ATOM 580 CA ASP A 73 4.383 -6.684 0.491 1.00 25.15 C ATOM 581 C ASP A 73 4.557 -6.845 -0.998 1.00 28.06 C ATOM 582 O ASP A 73 3.932 -6.138 -1.810 1.00 29.30 O ATOM 583 CB ASP A 73 3.180 -5.792 0.779 1.00 25.70 C ATOM 584 CG ASP A 73 1.848 -6.453 0.408 1.00 28.43 C ATOM 585 OD1 ASP A 73 1.762 -7.706 0.388 1.00 25.26 O ATOM 586 OD2 ASP A 73 0.891 -5.690 0.153 1.00 27.27 O ATOM 0 H ASP A 73 5.472 -5.244 1.292 1.00 22.17 H new ATOM 0 HA ASP A 73 4.244 -7.561 0.881 1.00 25.15 H new ATOM 0 HB2 ASP A 73 3.171 -5.563 1.721 1.00 25.70 H new ATOM 0 HB3 ASP A 73 3.273 -4.962 0.286 1.00 25.70 H new ATOM 587 N GLU A 74 5.392 -7.804 -1.378 1.00 29.30 N ATOM 588 CA GLU A 74 5.679 -7.981 -2.779 1.00 31.84 C ATOM 589 C GLU A 74 4.457 -8.310 -3.634 1.00 33.13 C ATOM 590 O GLU A 74 4.454 -7.949 -4.812 1.00 34.95 O ATOM 591 CB GLU A 74 6.771 -9.036 -2.963 1.00 33.33 C ATOM 592 CG GLU A 74 7.494 -8.986 -4.300 1.00 37.92 C ATOM 593 CD GLU A 74 6.833 -9.835 -5.403 1.00 42.64 C ATOM 594 OE1 GLU A 74 5.987 -10.707 -5.074 1.00 44.08 O ATOM 595 OE2 GLU A 74 7.181 -9.655 -6.609 1.00 44.34 O ATOM 0 H GLU A 74 5.792 -8.349 -0.847 1.00 29.30 H new ATOM 0 HA GLU A 74 5.993 -7.121 -3.100 1.00 31.84 H new ATOM 0 HB2 GLU A 74 7.424 -8.933 -2.253 1.00 33.33 H new ATOM 0 HB3 GLU A 74 6.374 -9.915 -2.858 1.00 33.33 H new ATOM 0 HG2 GLU A 74 7.540 -8.064 -4.598 1.00 37.92 H new ATOM 0 HG3 GLU A 74 8.407 -9.289 -4.175 1.00 37.92 H new ATOM 596 N ASN A 75 3.445 -8.968 -3.057 1.00 33.14 N ATOM 597 CA ASN A 75 2.213 -9.328 -3.789 1.00 35.57 C ATOM 598 C ASN A 75 1.068 -8.308 -3.647 1.00 37.47 C ATOM 599 O ASN A 75 -0.045 -8.515 -4.140 1.00 38.18 O ATOM 600 CB ASN A 75 1.730 -10.708 -3.350 1.00 31.20 C ATOM 601 CG ASN A 75 1.220 -10.744 -1.903 1.00 32.05 C ATOM 602 OD1 ASN A 75 1.768 -10.101 -0.953 1.00 18.66 O ATOM 603 ND2 ASN A 75 0.171 -11.559 -1.714 1.00 34.53 N ATOM 0 H ASN A 75 3.449 -9.219 -2.234 1.00 33.14 H new ATOM 0 HA ASN A 75 2.456 -9.330 -4.728 1.00 35.57 H new ATOM 0 HB2 ASN A 75 1.020 -10.998 -3.943 1.00 31.20 H new ATOM 0 HB3 ASN A 75 2.457 -11.343 -3.445 1.00 31.20 H new ATOM 0 HD21 ASN A 75 -0.157 -11.662 -0.926 1.00 34.53 H new ATOM 0 HD22 ASN A 75 -0.174 -11.978 -2.381 1.00 34.53 H new ATOM 604 N LYS A 76 1.360 -7.205 -2.971 1.00 39.13 N ATOM 605 CA LYS A 76 0.393 -6.133 -2.755 1.00 39.57 C ATOM 606 C LYS A 76 -1.038 -6.616 -2.378 1.00 39.24 C ATOM 607 O LYS A 76 -2.043 -6.044 -2.823 1.00 41.02 O ATOM 608 CB LYS A 76 0.384 -5.238 -4.013 1.00 39.56 C ATOM 609 CG LYS A 76 1.783 -4.946 -4.608 1.00 39.57 C ATOM 610 CD LYS A 76 2.237 -3.469 -4.447 1.00 39.87 C ATOM 611 CE LYS A 76 3.305 -3.240 -3.369 1.00 37.36 C ATOM 612 NZ LYS A 76 4.709 -3.659 -3.769 1.00 36.56 N ATOM 0 H LYS A 76 2.131 -7.054 -2.621 1.00 39.13 H new ATOM 0 HA LYS A 76 0.677 -5.630 -1.976 1.00 39.57 H new ATOM 0 HB2 LYS A 76 -0.161 -5.663 -4.693 1.00 39.56 H new ATOM 0 HB3 LYS A 76 -0.043 -4.395 -3.793 1.00 39.56 H new ATOM 0 HG2 LYS A 76 2.434 -5.524 -4.181 1.00 39.57 H new ATOM 0 HG3 LYS A 76 1.778 -5.173 -5.551 1.00 39.57 H new ATOM 0 HD2 LYS A 76 2.581 -3.155 -5.298 1.00 39.87 H new ATOM 0 HD3 LYS A 76 1.461 -2.926 -4.237 1.00 39.87 H new ATOM 0 HE2 LYS A 76 3.315 -2.298 -3.136 1.00 37.36 H new ATOM 0 HE3 LYS A 76 3.050 -3.727 -2.570 1.00 37.36 H new ATOM 0 HZ1 LYS A 76 5.244 -3.620 -3.059 1.00 36.56 H new ATOM 0 HZ2 LYS A 76 4.693 -4.492 -4.083 1.00 36.56 H new ATOM 0 HZ3 LYS A 76 5.014 -3.111 -4.400 1.00 36.56 H new ATOM 613 N ASP A 77 -1.122 -7.643 -1.541 1.00 37.48 N ATOM 614 CA ASP A 77 -2.399 -8.187 -1.100 1.00 36.04 C ATOM 615 C ASP A 77 -2.756 -7.567 0.263 1.00 35.05 C ATOM 616 O ASP A 77 -3.795 -7.896 0.860 1.00 34.45 O ATOM 617 CB ASP A 77 -2.300 -9.721 -0.996 1.00 38.05 C ATOM 618 CG ASP A 77 -1.552 -10.184 0.259 1.00 38.87 C ATOM 619 OD1 ASP A 77 -0.746 -9.378 0.767 1.00 37.68 O ATOM 620 OD2 ASP A 77 -1.763 -11.343 0.727 1.00 39.01 O ATOM 0 H ASP A 77 -0.437 -8.045 -1.212 1.00 37.48 H new ATOM 0 HA ASP A 77 -3.096 -7.971 -1.739 1.00 36.04 H new ATOM 0 HB2 ASP A 77 -3.193 -10.099 -0.993 1.00 38.05 H new ATOM 0 HB3 ASP A 77 -1.849 -10.066 -1.782 1.00 38.05 H new ATOM 621 N GLY A 78 -1.884 -6.678 0.763 1.00 32.34 N ATOM 622 CA GLY A 78 -2.168 -6.020 2.030 1.00 29.81 C ATOM 623 C GLY A 78 -1.753 -6.749 3.271 1.00 28.73 C ATOM 624 O GLY A 78 -2.082 -6.358 4.390 1.00 29.93 O ATOM 0 H GLY A 78 -1.143 -6.452 0.389 1.00 32.34 H new ATOM 0 HA2 GLY A 78 -1.731 -5.154 2.027 1.00 29.81 H new ATOM 0 HA3 GLY A 78 -3.123 -5.856 2.079 1.00 29.81 H new ATOM 625 N ARG A 79 -0.979 -7.808 3.094 1.00 28.01 N ATOM 626 CA ARG A 79 -0.520 -8.533 4.249 1.00 26.63 C ATOM 627 C ARG A 79 0.910 -9.001 3.939 1.00 24.31 C ATOM 628 O ARG A 79 1.256 -9.309 2.788 1.00 18.40 O ATOM 629 CB ARG A 79 -1.433 -9.738 4.481 1.00 30.40 C ATOM 630 CG ARG A 79 -2.938 -9.334 4.403 1.00 35.78 C ATOM 631 CD ARG A 79 -3.884 -10.504 4.504 1.00 39.37 C ATOM 632 NE ARG A 79 -3.585 -11.525 3.510 1.00 43.78 N ATOM 633 CZ ARG A 79 -4.352 -12.588 3.271 1.00 44.81 C ATOM 634 NH1 ARG A 79 -5.481 -12.773 3.951 1.00 46.99 N ATOM 635 NH2 ARG A 79 -3.973 -13.481 2.366 1.00 46.71 N ATOM 0 H ARG A 79 -0.717 -8.112 2.333 1.00 28.01 H new ATOM 0 HA ARG A 79 -0.534 -7.982 5.047 1.00 26.63 H new ATOM 0 HB2 ARG A 79 -1.245 -10.421 3.818 1.00 30.40 H new ATOM 0 HB3 ARG A 79 -1.245 -10.126 5.350 1.00 30.40 H new ATOM 0 HG2 ARG A 79 -3.134 -8.707 5.117 1.00 35.78 H new ATOM 0 HG3 ARG A 79 -3.098 -8.870 3.566 1.00 35.78 H new ATOM 0 HD2 ARG A 79 -3.828 -10.890 5.392 1.00 39.37 H new ATOM 0 HD3 ARG A 79 -4.796 -10.194 4.386 1.00 39.37 H new ATOM 0 HE ARG A 79 -2.866 -11.436 3.047 1.00 43.78 H new ATOM 0 HH11 ARG A 79 -5.720 -12.204 4.550 1.00 46.99 H new ATOM 0 HH12 ARG A 79 -5.971 -13.461 3.791 1.00 46.99 H new ATOM 0 HH21 ARG A 79 -3.236 -13.372 1.937 1.00 46.71 H new ATOM 0 HH22 ARG A 79 -4.465 -14.169 2.208 1.00 46.71 H new ATOM 636 N ILE A 80 1.751 -8.980 4.955 1.00 22.49 N ATOM 637 CA ILE A 80 3.082 -9.522 4.732 1.00 20.97 C ATOM 638 C ILE A 80 3.079 -10.985 5.260 1.00 20.22 C ATOM 639 O ILE A 80 2.937 -11.216 6.463 1.00 22.13 O ATOM 640 CB ILE A 80 4.139 -8.723 5.468 1.00 19.36 C ATOM 641 CG1 ILE A 80 4.301 -7.335 4.835 1.00 17.81 C ATOM 642 CG2 ILE A 80 5.464 -9.521 5.407 1.00 16.32 C ATOM 643 CD1 ILE A 80 5.032 -6.349 5.761 1.00 15.58 C ATOM 0 H ILE A 80 1.588 -8.675 5.742 1.00 22.49 H new ATOM 0 HA ILE A 80 3.294 -9.483 3.786 1.00 20.97 H new ATOM 0 HB ILE A 80 3.879 -8.587 6.392 1.00 19.36 H new ATOM 0 HG12 ILE A 80 4.792 -7.417 4.003 1.00 17.81 H new ATOM 0 HG13 ILE A 80 3.426 -6.979 4.614 1.00 17.81 H new ATOM 0 HG21 ILE A 80 6.159 -9.030 5.872 1.00 16.32 H new ATOM 0 HG22 ILE A 80 5.341 -10.385 5.830 1.00 16.32 H new ATOM 0 HG23 ILE A 80 5.723 -9.648 4.481 1.00 16.32 H new ATOM 0 HD11 ILE A 80 5.111 -5.489 5.320 1.00 15.58 H new ATOM 0 HD12 ILE A 80 4.530 -6.245 6.584 1.00 15.58 H new ATOM 0 HD13 ILE A 80 5.917 -6.690 5.963 1.00 15.58 H new ATOM 644 N GLU A 81 3.241 -11.949 4.355 1.00 19.58 N ATOM 645 CA GLU A 81 3.311 -13.385 4.707 1.00 20.36 C ATOM 646 C GLU A 81 4.791 -13.670 4.991 1.00 19.96 C ATOM 647 O GLU A 81 5.647 -12.872 4.595 1.00 16.14 O ATOM 648 CB GLU A 81 2.828 -14.261 3.527 1.00 22.27 C ATOM 649 CG GLU A 81 3.567 -14.128 2.191 1.00 25.33 C ATOM 650 CD GLU A 81 3.079 -15.158 1.158 1.00 32.02 C ATOM 651 OE1 GLU A 81 2.391 -14.764 0.173 1.00 32.81 O ATOM 652 OE2 GLU A 81 3.367 -16.383 1.333 1.00 33.08 O ATOM 0 H GLU A 81 3.315 -11.796 3.512 1.00 19.58 H new ATOM 0 HA GLU A 81 2.746 -13.589 5.468 1.00 20.36 H new ATOM 0 HB2 GLU A 81 2.878 -15.189 3.804 1.00 22.27 H new ATOM 0 HB3 GLU A 81 1.892 -14.062 3.371 1.00 22.27 H new ATOM 0 HG2 GLU A 81 3.439 -13.233 1.839 1.00 25.33 H new ATOM 0 HG3 GLU A 81 4.519 -14.243 2.336 1.00 25.33 H new ATOM 653 N PHE A 82 5.081 -14.768 5.686 1.00 17.20 N ATOM 654 CA PHE A 82 6.449 -15.072 6.054 1.00 17.14 C ATOM 655 C PHE A 82 7.464 -15.063 4.894 1.00 16.51 C ATOM 656 O PHE A 82 8.569 -14.543 5.043 1.00 18.11 O ATOM 657 CB PHE A 82 6.526 -16.416 6.763 1.00 14.68 C ATOM 658 CG PHE A 82 7.876 -16.695 7.303 1.00 15.80 C ATOM 659 CD1 PHE A 82 8.407 -15.883 8.308 1.00 14.81 C ATOM 660 CD2 PHE A 82 8.652 -17.705 6.760 1.00 14.27 C ATOM 661 CE1 PHE A 82 9.723 -16.064 8.771 1.00 16.00 C ATOM 662 CE2 PHE A 82 9.972 -17.894 7.222 1.00 13.89 C ATOM 663 CZ PHE A 82 10.495 -17.057 8.234 1.00 12.39 C ATOM 0 H PHE A 82 4.499 -15.344 5.950 1.00 17.20 H new ATOM 0 HA PHE A 82 6.705 -14.345 6.643 1.00 17.14 H new ATOM 0 HB2 PHE A 82 5.881 -16.434 7.487 1.00 14.68 H new ATOM 0 HB3 PHE A 82 6.277 -17.120 6.144 1.00 14.68 H new ATOM 0 HD1 PHE A 82 7.881 -15.211 8.678 1.00 14.81 H new ATOM 0 HD2 PHE A 82 8.306 -18.255 6.095 1.00 14.27 H new ATOM 0 HE1 PHE A 82 10.065 -15.513 9.437 1.00 16.00 H new ATOM 0 HE2 PHE A 82 10.498 -18.570 6.860 1.00 13.89 H new ATOM 0 HZ PHE A 82 11.366 -17.182 8.535 1.00 12.39 H new ATOM 664 N SER A 83 7.121 -15.681 3.773 1.00 16.54 N ATOM 665 CA SER A 83 8.026 -15.693 2.616 1.00 17.68 C ATOM 666 C SER A 83 8.445 -14.249 2.247 1.00 18.70 C ATOM 667 O SER A 83 9.623 -13.983 1.964 1.00 14.01 O ATOM 668 CB SER A 83 7.384 -16.379 1.415 1.00 20.62 C ATOM 669 OG ASER A 83 8.151 -16.236 0.236 0.50 18.17 O ATOM 670 OG BSER A 83 6.281 -15.644 0.896 0.50 19.59 O ATOM 0 H SER A 83 6.378 -16.097 3.655 1.00 16.54 H new ATOM 0 HA SER A 83 8.816 -16.199 2.862 1.00 17.68 H new ATOM 0 HB2ASER A 83 7.268 -17.322 1.609 0.50 20.62 H new ATOM 0 HB2BSER A 83 8.049 -16.495 0.718 0.50 20.62 H new ATOM 0 HB3ASER A 83 6.500 -16.008 1.269 0.50 20.62 H new ATOM 0 HB3BSER A 83 7.086 -17.265 1.673 0.50 20.62 H new ATOM 0 HG ASER A 83 8.037 -16.907 -0.256 0.50 19.59 H new ATOM 0 HG BSER A 83 5.572 -16.076 1.022 0.50 19.59 H new ATOM 671 N GLU A 84 7.507 -13.302 2.258 1.00 16.12 N ATOM 672 CA GLU A 84 7.896 -11.918 1.934 1.00 15.43 C ATOM 673 C GLU A 84 8.722 -11.312 3.048 1.00 15.14 C ATOM 674 O GLU A 84 9.681 -10.553 2.784 1.00 13.47 O ATOM 675 CB GLU A 84 6.655 -11.029 1.696 1.00 16.43 C ATOM 676 CG GLU A 84 5.840 -11.475 0.482 1.00 18.13 C ATOM 677 CD GLU A 84 4.444 -10.824 0.494 1.00 19.72 C ATOM 678 OE1 GLU A 84 3.895 -10.597 1.597 1.00 18.09 O ATOM 679 OE2 GLU A 84 3.947 -10.547 -0.593 1.00 21.96 O ATOM 0 H GLU A 84 6.676 -13.425 2.441 1.00 16.12 H new ATOM 0 HA GLU A 84 8.424 -11.955 1.121 1.00 15.43 H new ATOM 0 HB2 GLU A 84 6.091 -11.048 2.485 1.00 16.43 H new ATOM 0 HB3 GLU A 84 6.938 -10.110 1.572 1.00 16.43 H new ATOM 0 HG2 GLU A 84 6.307 -11.234 -0.333 1.00 18.13 H new ATOM 0 HG3 GLU A 84 5.751 -12.441 0.483 1.00 18.13 H new ATOM 680 N PHE A 85 8.320 -11.589 4.283 1.00 12.51 N ATOM 681 CA PHE A 85 8.997 -11.048 5.426 1.00 14.36 C ATOM 682 C PHE A 85 10.482 -11.471 5.470 1.00 13.62 C ATOM 683 O PHE A 85 11.361 -10.603 5.596 1.00 10.41 O ATOM 684 CB PHE A 85 8.268 -11.498 6.711 1.00 15.09 C ATOM 685 CG PHE A 85 8.983 -11.140 7.992 1.00 17.80 C ATOM 686 CD1 PHE A 85 8.779 -9.901 8.607 1.00 20.73 C ATOM 687 CD2 PHE A 85 9.818 -12.066 8.617 1.00 19.87 C ATOM 688 CE1 PHE A 85 9.401 -9.593 9.844 1.00 21.32 C ATOM 689 CE2 PHE A 85 10.444 -11.771 9.848 1.00 22.52 C ATOM 690 CZ PHE A 85 10.231 -10.529 10.462 1.00 22.22 C ATOM 0 H PHE A 85 7.650 -12.094 4.470 1.00 12.51 H new ATOM 0 HA PHE A 85 8.979 -10.080 5.361 1.00 14.36 H new ATOM 0 HB2 PHE A 85 7.384 -11.099 6.725 1.00 15.09 H new ATOM 0 HB3 PHE A 85 8.145 -12.460 6.680 1.00 15.09 H new ATOM 0 HD1 PHE A 85 8.229 -9.271 8.200 1.00 20.73 H new ATOM 0 HD2 PHE A 85 9.965 -12.892 8.216 1.00 19.87 H new ATOM 0 HE1 PHE A 85 9.255 -8.766 10.244 1.00 21.32 H new ATOM 0 HE2 PHE A 85 10.997 -12.400 10.251 1.00 22.52 H new ATOM 0 HZ PHE A 85 10.639 -10.331 11.274 1.00 22.22 H new ATOM 691 N ILE A 86 10.741 -12.778 5.350 1.00 11.52 N ATOM 692 CA ILE A 86 12.129 -13.272 5.412 1.00 12.03 C ATOM 693 C ILE A 86 13.002 -12.833 4.236 1.00 12.32 C ATOM 694 O ILE A 86 14.207 -12.589 4.427 1.00 12.74 O ATOM 695 CB ILE A 86 12.154 -14.850 5.625 1.00 10.67 C ATOM 696 CG1 ILE A 86 13.531 -15.293 6.177 1.00 9.40 C ATOM 697 CG2 ILE A 86 11.804 -15.626 4.334 1.00 8.51 C ATOM 698 CD1 ILE A 86 13.814 -14.657 7.572 1.00 12.95 C ATOM 0 H ILE A 86 10.144 -13.386 5.234 1.00 11.52 H new ATOM 0 HA ILE A 86 12.534 -12.851 6.186 1.00 12.03 H new ATOM 0 HB ILE A 86 11.467 -15.065 6.275 1.00 10.67 H new ATOM 0 HG12 ILE A 86 13.557 -16.260 6.249 1.00 9.40 H new ATOM 0 HG13 ILE A 86 14.229 -15.036 5.555 1.00 9.40 H new ATOM 0 HG21 ILE A 86 11.832 -16.579 4.512 1.00 8.51 H new ATOM 0 HG22 ILE A 86 10.914 -15.378 4.039 1.00 8.51 H new ATOM 0 HG23 ILE A 86 12.447 -15.408 3.641 1.00 8.51 H new ATOM 0 HD11 ILE A 86 14.681 -14.951 7.892 1.00 12.95 H new ATOM 0 HD12 ILE A 86 13.810 -13.690 7.494 1.00 12.95 H new ATOM 0 HD13 ILE A 86 13.127 -14.933 8.199 1.00 12.95 H new ATOM 699 N GLN A 87 12.435 -12.735 3.027 1.00 12.87 N ATOM 700 CA GLN A 87 13.212 -12.279 1.888 1.00 14.58 C ATOM 701 C GLN A 87 13.564 -10.792 2.021 1.00 14.94 C ATOM 702 O GLN A 87 14.681 -10.377 1.693 1.00 13.12 O ATOM 703 CB GLN A 87 12.456 -12.572 0.573 1.00 16.15 C ATOM 704 CG GLN A 87 12.546 -14.090 0.281 1.00 22.56 C ATOM 705 CD GLN A 87 11.760 -14.528 -0.944 1.00 26.15 C ATOM 706 OE1 GLN A 87 12.136 -14.218 -2.081 1.00 28.64 O ATOM 707 NE2 GLN A 87 10.663 -15.248 -0.720 1.00 26.29 N ATOM 0 H GLN A 87 11.614 -12.926 2.855 1.00 12.87 H new ATOM 0 HA GLN A 87 14.049 -12.769 1.867 1.00 14.58 H new ATOM 0 HB2 GLN A 87 11.529 -12.298 0.649 1.00 16.15 H new ATOM 0 HB3 GLN A 87 12.842 -12.065 -0.158 1.00 16.15 H new ATOM 0 HG2 GLN A 87 13.477 -14.333 0.161 1.00 22.56 H new ATOM 0 HG3 GLN A 87 12.223 -14.579 1.054 1.00 22.56 H new ATOM 0 HE21 GLN A 87 10.434 -15.444 0.086 1.00 26.29 H new ATOM 0 HE22 GLN A 87 10.183 -15.518 -1.381 1.00 26.29 H new ATOM 708 N ALA A 88 12.632 -9.975 2.514 1.00 13.82 N ATOM 709 CA ALA A 88 12.957 -8.579 2.727 1.00 14.78 C ATOM 710 C ALA A 88 13.988 -8.432 3.864 1.00 13.92 C ATOM 711 O ALA A 88 14.893 -7.576 3.764 1.00 13.38 O ATOM 712 CB ALA A 88 11.677 -7.730 3.064 1.00 12.53 C ATOM 0 H ALA A 88 11.831 -10.206 2.724 1.00 13.82 H new ATOM 0 HA ALA A 88 13.337 -8.242 1.900 1.00 14.78 H new ATOM 0 HB1 ALA A 88 11.930 -6.803 3.200 1.00 12.53 H new ATOM 0 HB2 ALA A 88 11.047 -7.788 2.329 1.00 12.53 H new ATOM 0 HB3 ALA A 88 11.264 -8.074 3.871 1.00 12.53 H new ATOM 713 N LEU A 89 13.893 -9.259 4.931 1.00 11.18 N ATOM 714 CA LEU A 89 14.870 -9.146 6.019 1.00 14.07 C ATOM 715 C LEU A 89 16.235 -9.556 5.492 1.00 13.86 C ATOM 716 O LEU A 89 17.247 -8.992 5.901 1.00 13.83 O ATOM 717 CB LEU A 89 14.600 -10.086 7.225 1.00 14.66 C ATOM 718 CG LEU A 89 13.424 -9.784 8.145 1.00 20.72 C ATOM 719 CD1 LEU A 89 13.552 -10.659 9.415 1.00 23.20 C ATOM 720 CD2 LEU A 89 13.429 -8.353 8.544 1.00 23.46 C ATOM 0 H LEU A 89 13.292 -9.866 5.035 1.00 11.18 H new ATOM 0 HA LEU A 89 14.814 -8.226 6.320 1.00 14.07 H new ATOM 0 HB2 LEU A 89 14.477 -10.983 6.876 1.00 14.66 H new ATOM 0 HB3 LEU A 89 15.402 -10.102 7.770 1.00 14.66 H new ATOM 0 HG LEU A 89 12.596 -9.976 7.677 1.00 20.72 H new ATOM 0 HD11 LEU A 89 12.808 -10.476 10.010 1.00 23.20 H new ATOM 0 HD12 LEU A 89 13.543 -11.596 9.165 1.00 23.20 H new ATOM 0 HD13 LEU A 89 14.385 -10.454 9.867 1.00 23.20 H new ATOM 0 HD21 LEU A 89 12.675 -8.177 9.129 1.00 23.46 H new ATOM 0 HD22 LEU A 89 14.254 -8.150 9.011 1.00 23.46 H new ATOM 0 HD23 LEU A 89 13.361 -7.796 7.753 1.00 23.46 H new ATOM 721 N SER A 90 16.236 -10.556 4.611 1.00 13.73 N ATOM 722 CA SER A 90 17.466 -11.054 4.031 1.00 12.08 C ATOM 723 C SER A 90 18.213 -9.975 3.265 1.00 11.86 C ATOM 724 O SER A 90 19.416 -9.764 3.505 1.00 11.42 O ATOM 725 CB SER A 90 17.189 -12.238 3.115 1.00 12.13 C ATOM 726 OG SER A 90 18.400 -12.668 2.493 1.00 11.57 O ATOM 0 H SER A 90 15.526 -10.958 4.339 1.00 13.73 H new ATOM 0 HA SER A 90 18.029 -11.342 4.767 1.00 12.08 H new ATOM 0 HB2 SER A 90 16.802 -12.967 3.624 1.00 12.13 H new ATOM 0 HB3 SER A 90 16.540 -11.988 2.439 1.00 12.13 H new ATOM 0 HG SER A 90 18.243 -12.891 1.699 1.00 11.57 H new ATOM 727 N VAL A 91 17.555 -9.341 2.301 1.00 11.11 N ATOM 728 CA VAL A 91 18.225 -8.317 1.521 1.00 11.19 C ATOM 729 C VAL A 91 18.606 -7.116 2.390 1.00 10.59 C ATOM 730 O VAL A 91 19.744 -6.648 2.363 1.00 9.97 O ATOM 731 CB VAL A 91 17.356 -7.802 0.329 1.00 13.19 C ATOM 732 CG1AVAL A 91 18.143 -6.768 -0.487 0.50 7.66 C ATOM 733 CG1BVAL A 91 17.257 -8.881 -0.730 0.50 15.62 C ATOM 734 CG2AVAL A 91 16.845 -8.967 -0.504 0.50 14.86 C ATOM 735 CG2BVAL A 91 15.962 -7.440 0.787 0.50 9.87 C ATOM 0 H VAL A 91 16.735 -9.487 2.087 1.00 11.11 H new ATOM 0 HA VAL A 91 19.022 -8.741 1.166 1.00 11.19 H new ATOM 0 HB AVAL A 91 16.569 -7.349 0.669 0.50 13.19 H new ATOM 0 HB BVAL A 91 17.782 -7.010 -0.033 0.50 13.19 H new ATOM 0 HG11AVAL A 91 17.597 -6.454 -1.224 0.50 15.62 H new ATOM 0 HG11BVAL A 91 16.717 -8.560 -1.469 0.50 15.62 H new ATOM 0 HG12AVAL A 91 18.380 -6.019 0.082 0.50 15.62 H new ATOM 0 HG12BVAL A 91 18.145 -9.102 -1.051 0.50 15.62 H new ATOM 0 HG13AVAL A 91 18.951 -7.177 -0.835 0.50 15.62 H new ATOM 0 HG13BVAL A 91 16.845 -9.672 -0.349 0.50 15.62 H new ATOM 0 HG21AVAL A 91 16.308 -8.629 -1.238 0.50 9.87 H new ATOM 0 HG21BVAL A 91 15.444 -7.124 0.030 0.50 9.87 H new ATOM 0 HG22AVAL A 91 17.597 -9.467 -0.857 0.50 9.87 H new ATOM 0 HG22BVAL A 91 15.533 -8.222 1.168 0.50 9.87 H new ATOM 0 HG23AVAL A 91 16.303 -9.549 0.051 0.50 9.87 H new ATOM 0 HG23BVAL A 91 16.013 -6.741 1.458 0.50 9.87 H new ATOM 736 N THR A 92 17.685 -6.624 3.200 1.00 10.16 N ATOM 737 CA THR A 92 18.002 -5.436 3.974 1.00 12.01 C ATOM 738 C THR A 92 19.047 -5.585 5.078 1.00 13.28 C ATOM 739 O THR A 92 19.724 -4.609 5.422 1.00 12.61 O ATOM 740 CB THR A 92 16.715 -4.748 4.626 1.00 11.82 C ATOM 741 OG1 THR A 92 16.104 -5.608 5.620 1.00 14.96 O ATOM 742 CG2 THR A 92 15.732 -4.372 3.531 1.00 14.33 C ATOM 0 H THR A 92 16.897 -6.948 3.316 1.00 10.16 H new ATOM 0 HA THR A 92 18.393 -4.877 3.284 1.00 12.01 H new ATOM 0 HB THR A 92 16.989 -3.940 5.087 1.00 11.82 H new ATOM 0 HG1 THR A 92 16.181 -5.257 6.379 1.00 14.96 H new ATOM 0 HG21 THR A 92 14.951 -3.954 3.926 1.00 14.33 H new ATOM 0 HG22 THR A 92 16.154 -3.751 2.916 1.00 14.33 H new ATOM 0 HG23 THR A 92 15.463 -5.170 3.050 1.00 14.33 H new ATOM 743 N SER A 93 19.168 -6.785 5.637 1.00 10.60 N ATOM 744 CA SER A 93 20.113 -7.010 6.712 1.00 11.45 C ATOM 745 C SER A 93 21.408 -7.676 6.255 1.00 12.57 C ATOM 746 O SER A 93 22.434 -7.489 6.910 1.00 12.01 O ATOM 747 CB SER A 93 19.423 -7.870 7.814 1.00 11.05 C ATOM 748 OG ASER A 93 19.516 -9.279 7.586 0.50 6.21 O ATOM 749 OG BSER A 93 20.282 -8.377 8.789 0.50 13.48 O ATOM 0 H SER A 93 18.712 -7.477 5.406 1.00 10.60 H new ATOM 0 HA SER A 93 20.370 -6.142 7.061 1.00 11.45 H new ATOM 0 HB2ASER A 93 19.823 -7.662 8.673 0.50 11.05 H new ATOM 0 HB2BSER A 93 18.744 -7.330 8.249 0.50 11.05 H new ATOM 0 HB3ASER A 93 18.487 -7.620 7.869 0.50 11.05 H new ATOM 0 HB3BSER A 93 18.966 -8.612 7.388 0.50 11.05 H new ATOM 0 HG ASER A 93 18.911 -9.517 7.054 0.50 13.48 H new ATOM 0 HG BSER A 93 20.700 -9.036 8.479 0.50 13.48 H new ATOM 750 N ARG A 94 21.369 -8.427 5.133 1.00 10.10 N ATOM 751 CA ARG A 94 22.556 -9.179 4.703 1.00 8.53 C ATOM 752 C ARG A 94 22.925 -9.087 3.221 1.00 10.73 C ATOM 753 O ARG A 94 23.897 -9.750 2.785 1.00 9.91 O ATOM 754 CB ARG A 94 22.358 -10.649 5.031 1.00 8.15 C ATOM 755 CG ARG A 94 22.292 -10.971 6.529 1.00 10.79 C ATOM 756 CD ARG A 94 22.178 -12.499 6.834 1.00 12.13 C ATOM 757 NE ARG A 94 22.289 -12.692 8.291 1.00 11.07 N ATOM 758 CZ ARG A 94 22.313 -13.868 8.879 1.00 9.31 C ATOM 759 NH1 ARG A 94 22.228 -14.967 8.143 1.00 8.00 N ATOM 760 NH2 ARG A 94 22.431 -13.931 10.213 1.00 8.37 N ATOM 0 H ARG A 94 20.681 -8.509 4.623 1.00 10.10 H new ATOM 0 HA ARG A 94 23.288 -8.764 5.186 1.00 8.53 H new ATOM 0 HB2 ARG A 94 21.538 -10.953 4.611 1.00 8.15 H new ATOM 0 HB3 ARG A 94 23.084 -11.156 4.636 1.00 8.15 H new ATOM 0 HG2 ARG A 94 23.085 -10.620 6.963 1.00 10.79 H new ATOM 0 HG3 ARG A 94 21.530 -10.513 6.918 1.00 10.79 H new ATOM 0 HD2 ARG A 94 21.331 -12.845 6.511 1.00 12.13 H new ATOM 0 HD3 ARG A 94 22.878 -12.988 6.374 1.00 12.13 H new ATOM 0 HE ARG A 94 22.341 -11.992 8.788 1.00 11.07 H new ATOM 0 HH11 ARG A 94 22.158 -14.908 7.288 1.00 8.00 H new ATOM 0 HH12 ARG A 94 22.243 -15.740 8.521 1.00 8.00 H new ATOM 0 HH21 ARG A 94 22.490 -13.207 10.674 1.00 8.37 H new ATOM 0 HH22 ARG A 94 22.448 -14.695 10.608 1.00 8.37 H new ATOM 761 N GLY A 95 22.159 -8.312 2.453 1.00 10.50 N ATOM 762 CA GLY A 95 22.458 -8.285 1.027 1.00 10.68 C ATOM 763 C GLY A 95 23.779 -7.583 0.712 1.00 9.26 C ATOM 764 O GLY A 95 24.338 -6.865 1.537 1.00 6.70 O ATOM 0 H GLY A 95 21.502 -7.824 2.717 1.00 10.50 H new ATOM 0 HA2 GLY A 95 22.491 -9.194 0.691 1.00 10.68 H new ATOM 0 HA3 GLY A 95 21.738 -7.835 0.558 1.00 10.68 H new ATOM 765 N THR A 96 24.243 -7.757 -0.513 1.00 10.00 N ATOM 766 CA THR A 96 25.439 -7.027 -0.938 1.00 14.15 C ATOM 767 C THR A 96 25.007 -5.561 -1.073 1.00 14.79 C ATOM 768 O THR A 96 23.806 -5.222 -0.999 1.00 12.45 O ATOM 769 CB THR A 96 25.907 -7.513 -2.321 1.00 14.72 C ATOM 770 OG1 THR A 96 24.814 -7.395 -3.249 1.00 14.06 O ATOM 771 CG2 THR A 96 26.352 -8.979 -2.246 1.00 11.88 C ATOM 0 H THR A 96 23.897 -8.277 -1.104 1.00 10.00 H new ATOM 0 HA THR A 96 26.162 -7.155 -0.304 1.00 14.15 H new ATOM 0 HB THR A 96 26.657 -6.972 -2.614 1.00 14.72 H new ATOM 0 HG1 THR A 96 25.010 -7.788 -3.965 1.00 14.06 H new ATOM 0 HG21 THR A 96 26.644 -9.274 -3.123 1.00 11.88 H new ATOM 0 HG22 THR A 96 27.085 -9.063 -1.616 1.00 11.88 H new ATOM 0 HG23 THR A 96 25.609 -9.528 -1.952 1.00 11.88 H new ATOM 772 N LEU A 97 25.982 -4.680 -1.242 1.00 12.30 N ATOM 773 CA LEU A 97 25.669 -3.283 -1.463 1.00 14.60 C ATOM 774 C LEU A 97 24.758 -3.093 -2.708 1.00 14.38 C ATOM 775 O LEU A 97 23.776 -2.324 -2.668 1.00 12.06 O ATOM 776 CB LEU A 97 27.000 -2.508 -1.630 1.00 15.27 C ATOM 777 CG LEU A 97 26.831 -1.044 -2.021 1.00 20.33 C ATOM 778 CD1 LEU A 97 25.980 -0.351 -1.014 1.00 19.34 C ATOM 779 CD2 LEU A 97 28.203 -0.374 -2.084 1.00 22.23 C ATOM 0 H LEU A 97 26.821 -4.869 -1.232 1.00 12.30 H new ATOM 0 HA LEU A 97 25.176 -2.939 -0.702 1.00 14.60 H new ATOM 0 HB2 LEU A 97 27.495 -2.554 -0.797 1.00 15.27 H new ATOM 0 HB3 LEU A 97 27.538 -2.952 -2.305 1.00 15.27 H new ATOM 0 HG LEU A 97 26.404 -0.989 -2.890 1.00 20.33 H new ATOM 0 HD11 LEU A 97 25.874 0.580 -1.265 1.00 19.34 H new ATOM 0 HD12 LEU A 97 25.109 -0.777 -0.978 1.00 19.34 H new ATOM 0 HD13 LEU A 97 26.402 -0.404 -0.142 1.00 19.34 H new ATOM 0 HD21 LEU A 97 28.097 0.558 -2.333 1.00 22.23 H new ATOM 0 HD22 LEU A 97 28.631 -0.430 -1.215 1.00 22.23 H new ATOM 0 HD23 LEU A 97 28.753 -0.824 -2.744 1.00 22.23 H new ATOM 780 N ASP A 98 25.080 -3.774 -3.816 1.00 15.22 N ATOM 781 CA ASP A 98 24.270 -3.633 -5.025 1.00 15.33 C ATOM 782 C ASP A 98 22.840 -4.138 -4.769 1.00 13.66 C ATOM 783 O ASP A 98 21.881 -3.601 -5.285 1.00 12.42 O ATOM 784 CB ASP A 98 24.830 -4.462 -6.193 1.00 19.27 C ATOM 785 CG ASP A 98 26.154 -3.922 -6.733 1.00 23.93 C ATOM 786 OD1 ASP A 98 26.451 -2.736 -6.468 1.00 21.95 O ATOM 787 OD2 ASP A 98 26.879 -4.704 -7.427 1.00 26.27 O ATOM 0 H ASP A 98 25.749 -4.310 -3.885 1.00 15.22 H new ATOM 0 HA ASP A 98 24.281 -2.690 -5.254 1.00 15.33 H new ATOM 0 HB2 ASP A 98 24.956 -5.378 -5.901 1.00 19.27 H new ATOM 0 HB3 ASP A 98 24.178 -4.481 -6.911 1.00 19.27 H new ATOM 788 N GLU A 99 22.711 -5.175 -3.955 1.00 12.04 N ATOM 789 CA GLU A 99 21.380 -5.714 -3.671 1.00 11.76 C ATOM 790 C GLU A 99 20.584 -4.760 -2.807 1.00 10.59 C ATOM 791 O GLU A 99 19.368 -4.583 -3.039 1.00 9.73 O ATOM 792 CB GLU A 99 21.494 -7.106 -3.016 1.00 13.73 C ATOM 793 CG GLU A 99 21.839 -8.171 -4.029 1.00 14.12 C ATOM 794 CD GLU A 99 22.306 -9.483 -3.413 1.00 17.66 C ATOM 795 OE1 GLU A 99 22.534 -10.407 -4.217 1.00 22.17 O ATOM 796 OE2 GLU A 99 22.454 -9.607 -2.160 1.00 13.88 O ATOM 0 H GLU A 99 23.362 -5.577 -3.562 1.00 12.04 H new ATOM 0 HA GLU A 99 20.902 -5.815 -4.509 1.00 11.76 H new ATOM 0 HB2 GLU A 99 22.174 -7.084 -2.324 1.00 13.73 H new ATOM 0 HB3 GLU A 99 20.656 -7.330 -2.583 1.00 13.73 H new ATOM 0 HG2 GLU A 99 21.061 -8.343 -4.582 1.00 14.12 H new ATOM 0 HG3 GLU A 99 22.534 -7.834 -4.615 1.00 14.12 H new ATOM 797 N LYS A 100 21.223 -4.201 -1.772 1.00 9.62 N ATOM 798 CA LYS A 100 20.523 -3.252 -0.921 1.00 9.78 C ATOM 799 C LYS A 100 20.170 -1.997 -1.717 1.00 11.59 C ATOM 800 O LYS A 100 19.139 -1.372 -1.471 1.00 10.75 O ATOM 801 CB LYS A 100 21.319 -2.892 0.322 1.00 8.42 C ATOM 802 CG LYS A 100 21.684 -4.099 1.202 1.00 6.44 C ATOM 803 CD LYS A 100 21.874 -3.582 2.629 1.00 12.98 C ATOM 804 CE LYS A 100 22.441 -4.685 3.597 1.00 12.11 C ATOM 805 NZ LYS A 100 23.896 -4.495 3.604 1.00 15.82 N ATOM 0 H LYS A 100 22.040 -4.357 -1.555 1.00 9.62 H new ATOM 0 HA LYS A 100 19.707 -3.680 -0.617 1.00 9.78 H new ATOM 0 HB2 LYS A 100 22.135 -2.441 0.053 1.00 8.42 H new ATOM 0 HB3 LYS A 100 20.807 -2.261 0.851 1.00 8.42 H new ATOM 0 HG2 LYS A 100 20.983 -4.769 1.172 1.00 6.44 H new ATOM 0 HG3 LYS A 100 22.495 -4.523 0.881 1.00 6.44 H new ATOM 0 HD2 LYS A 100 22.479 -2.824 2.618 1.00 12.98 H new ATOM 0 HD3 LYS A 100 21.024 -3.262 2.970 1.00 12.98 H new ATOM 0 HE2 LYS A 100 22.073 -4.589 4.489 1.00 12.11 H new ATOM 0 HE3 LYS A 100 22.207 -5.574 3.288 1.00 12.11 H new ATOM 0 HZ1 LYS A 100 24.208 -4.621 4.428 1.00 15.82 H new ATOM 0 HZ2 LYS A 100 24.275 -5.080 3.051 1.00 15.82 H new ATOM 0 HZ3 LYS A 100 24.089 -3.668 3.338 1.00 15.82 H new ATOM 806 N LEU A 101 21.006 -1.606 -2.676 1.00 11.06 N ATOM 807 CA LEU A 101 20.639 -0.429 -3.488 1.00 12.83 C ATOM 808 C LEU A 101 19.402 -0.678 -4.375 1.00 11.80 C ATOM 809 O LEU A 101 18.608 0.257 -4.634 1.00 11.15 O ATOM 810 CB LEU A 101 21.807 -0.005 -4.389 1.00 11.87 C ATOM 811 CG LEU A 101 22.909 0.683 -3.620 1.00 16.10 C ATOM 812 CD1 LEU A 101 24.221 0.721 -4.527 1.00 16.51 C ATOM 813 CD2 LEU A 101 22.453 2.089 -3.283 1.00 17.07 C ATOM 0 H LEU A 101 21.755 -1.981 -2.872 1.00 11.06 H new ATOM 0 HA LEU A 101 20.425 0.275 -2.856 1.00 12.83 H new ATOM 0 HB2 LEU A 101 22.168 -0.787 -4.836 1.00 11.87 H new ATOM 0 HB3 LEU A 101 21.479 0.591 -5.081 1.00 11.87 H new ATOM 0 HG LEU A 101 23.109 0.207 -2.799 1.00 16.10 H new ATOM 0 HD11 LEU A 101 24.937 1.161 -4.043 1.00 16.51 H new ATOM 0 HD12 LEU A 101 24.489 -0.185 -4.746 1.00 16.51 H new ATOM 0 HD13 LEU A 101 24.036 1.210 -5.344 1.00 16.51 H new ATOM 0 HD21 LEU A 101 23.151 2.546 -2.788 1.00 17.07 H new ATOM 0 HD22 LEU A 101 22.268 2.574 -4.102 1.00 17.07 H new ATOM 0 HD23 LEU A 101 21.648 2.048 -2.743 1.00 17.07 H new ATOM 814 N ARG A 102 19.263 -1.882 -4.906 1.00 12.27 N ATOM 815 CA ARG A 102 18.096 -2.155 -5.744 1.00 15.24 C ATOM 816 C ARG A 102 16.846 -2.154 -4.896 1.00 13.54 C ATOM 817 O ARG A 102 15.777 -1.765 -5.348 1.00 13.72 O ATOM 818 CB ARG A 102 18.246 -3.505 -6.473 1.00 20.09 C ATOM 819 CG ARG A 102 19.122 -3.317 -7.721 1.00 26.88 C ATOM 820 CD ARG A 102 19.171 -4.559 -8.560 1.00 31.73 C ATOM 821 NE ARG A 102 20.083 -5.542 -8.017 1.00 34.72 N ATOM 822 CZ ARG A 102 21.408 -5.490 -8.136 1.00 34.64 C ATOM 823 NH1 ARG A 102 22.008 -4.482 -8.794 1.00 32.89 N ATOM 824 NH2 ARG A 102 22.125 -6.464 -7.593 1.00 32.08 N ATOM 0 H ARG A 102 19.809 -2.538 -4.802 1.00 12.27 H new ATOM 0 HA ARG A 102 18.027 -1.457 -6.414 1.00 15.24 H new ATOM 0 HB2 ARG A 102 18.646 -4.161 -5.881 1.00 20.09 H new ATOM 0 HB3 ARG A 102 17.374 -3.846 -6.726 1.00 20.09 H new ATOM 0 HG2 ARG A 102 18.776 -2.582 -8.251 1.00 26.88 H new ATOM 0 HG3 ARG A 102 20.021 -3.073 -7.451 1.00 26.88 H new ATOM 0 HD2 ARG A 102 18.282 -4.942 -8.622 1.00 31.73 H new ATOM 0 HD3 ARG A 102 19.444 -4.329 -9.462 1.00 31.73 H new ATOM 0 HE ARG A 102 19.746 -6.206 -7.587 1.00 34.72 H new ATOM 0 HH11 ARG A 102 21.535 -3.857 -9.147 1.00 32.89 H new ATOM 0 HH12 ARG A 102 22.865 -4.463 -8.862 1.00 32.89 H new ATOM 0 HH21 ARG A 102 21.732 -7.107 -7.178 1.00 32.08 H new ATOM 0 HH22 ARG A 102 22.983 -6.453 -7.656 1.00 32.08 H new ATOM 825 N TRP A 103 16.979 -2.610 -3.654 1.00 11.01 N ATOM 826 CA TRP A 103 15.838 -2.614 -2.718 1.00 11.78 C ATOM 827 C TRP A 103 15.436 -1.167 -2.344 1.00 11.94 C ATOM 828 O TRP A 103 14.242 -0.805 -2.282 1.00 10.46 O ATOM 829 CB TRP A 103 16.235 -3.393 -1.430 1.00 14.97 C ATOM 830 CG TRP A 103 15.035 -3.769 -0.582 1.00 17.54 C ATOM 831 CD1 TRP A 103 14.262 -4.899 -0.696 1.00 17.00 C ATOM 832 CD2 TRP A 103 14.438 -2.979 0.452 1.00 18.59 C ATOM 833 NE1 TRP A 103 13.218 -4.851 0.206 1.00 18.71 N ATOM 834 CE2 TRP A 103 13.307 -3.683 0.918 1.00 18.91 C ATOM 835 CE3 TRP A 103 14.760 -1.753 1.035 1.00 20.61 C ATOM 836 CZ2 TRP A 103 12.489 -3.192 1.944 1.00 22.59 C ATOM 837 CZ3 TRP A 103 13.952 -1.263 2.054 1.00 25.24 C ATOM 838 CH2 TRP A 103 12.821 -1.988 2.498 1.00 23.07 C ATOM 0 H TRP A 103 17.712 -2.921 -3.328 1.00 11.01 H new ATOM 0 HA TRP A 103 15.081 -3.044 -3.146 1.00 11.78 H new ATOM 0 HB2 TRP A 103 16.716 -4.198 -1.678 1.00 14.97 H new ATOM 0 HB3 TRP A 103 16.842 -2.851 -0.903 1.00 14.97 H new ATOM 0 HD1 TRP A 103 14.419 -5.594 -1.293 1.00 17.00 H new ATOM 0 HE1 TRP A 103 12.612 -5.454 0.305 1.00 18.71 H new ATOM 0 HE3 TRP A 103 15.502 -1.272 0.747 1.00 20.61 H new ATOM 0 HZ2 TRP A 103 11.746 -3.669 2.238 1.00 22.59 H new ATOM 0 HZ3 TRP A 103 14.158 -0.447 2.450 1.00 25.24 H new ATOM 0 HH2 TRP A 103 12.294 -1.638 3.180 1.00 23.07 H new ATOM 839 N ALA A 104 16.440 -0.331 -2.071 1.00 10.94 N ATOM 840 CA ALA A 104 16.223 1.067 -1.704 1.00 11.29 C ATOM 841 C ALA A 104 15.582 1.786 -2.876 1.00 10.84 C ATOM 842 O ALA A 104 14.737 2.650 -2.695 1.00 9.60 O ATOM 843 CB ALA A 104 17.583 1.753 -1.357 1.00 10.96 C ATOM 0 H ALA A 104 17.268 -0.561 -2.094 1.00 10.94 H new ATOM 0 HA ALA A 104 15.644 1.109 -0.927 1.00 11.29 H new ATOM 0 HB1 ALA A 104 17.426 2.679 -1.115 1.00 10.96 H new ATOM 0 HB2 ALA A 104 17.998 1.291 -0.612 1.00 10.96 H new ATOM 0 HB3 ALA A 104 18.171 1.716 -2.128 1.00 10.96 H new ATOM 844 N PHE A 105 15.995 1.423 -4.084 1.00 9.08 N ATOM 845 CA PHE A 105 15.382 2.095 -5.259 1.00 13.11 C ATOM 846 C PHE A 105 13.881 1.783 -5.318 1.00 11.79 C ATOM 847 O PHE A 105 13.089 2.674 -5.622 1.00 12.97 O ATOM 848 CB PHE A 105 16.004 1.601 -6.548 1.00 13.42 C ATOM 849 CG PHE A 105 15.581 2.385 -7.770 1.00 14.94 C ATOM 850 CD1 PHE A 105 16.190 3.606 -8.084 1.00 13.18 C ATOM 851 CD2 PHE A 105 14.610 1.885 -8.619 1.00 15.95 C ATOM 852 CE1 PHE A 105 15.848 4.327 -9.235 1.00 14.92 C ATOM 853 CE2 PHE A 105 14.243 2.607 -9.799 1.00 15.91 C ATOM 854 CZ PHE A 105 14.874 3.828 -10.094 1.00 16.13 C ATOM 0 H PHE A 105 16.592 0.828 -4.255 1.00 9.08 H new ATOM 0 HA PHE A 105 15.533 3.048 -5.163 1.00 13.11 H new ATOM 0 HB2 PHE A 105 16.970 1.641 -6.467 1.00 13.42 H new ATOM 0 HB3 PHE A 105 15.768 0.669 -6.675 1.00 13.42 H new ATOM 0 HD1 PHE A 105 16.839 3.948 -7.513 1.00 13.18 H new ATOM 0 HD2 PHE A 105 14.194 1.077 -8.422 1.00 15.95 H new ATOM 0 HE1 PHE A 105 16.269 5.134 -9.424 1.00 14.92 H new ATOM 0 HE2 PHE A 105 13.590 2.270 -10.368 1.00 15.91 H new ATOM 0 HZ PHE A 105 14.641 4.300 -10.860 1.00 16.13 H new ATOM 855 N LYS A 106 13.531 0.530 -5.056 1.00 13.33 N ATOM 856 CA LYS A 106 12.143 0.083 -5.047 1.00 15.29 C ATOM 857 C LYS A 106 11.352 0.866 -4.003 1.00 15.81 C ATOM 858 O LYS A 106 10.198 1.210 -4.228 1.00 15.01 O ATOM 859 CB LYS A 106 12.047 -1.415 -4.746 1.00 16.71 C ATOM 860 CG LYS A 106 12.548 -2.312 -5.847 1.00 23.81 C ATOM 861 CD LYS A 106 12.039 -3.775 -5.701 1.00 26.85 C ATOM 862 CE LYS A 106 13.201 -4.822 -5.653 1.00 30.69 C ATOM 863 NZ LYS A 106 14.030 -4.987 -6.935 1.00 32.63 N ATOM 0 H LYS A 106 14.098 -0.091 -4.877 1.00 13.33 H new ATOM 0 HA LYS A 106 11.770 0.243 -5.928 1.00 15.29 H new ATOM 0 HB2 LYS A 106 12.550 -1.603 -3.938 1.00 16.71 H new ATOM 0 HB3 LYS A 106 11.121 -1.637 -4.561 1.00 16.71 H new ATOM 0 HG2 LYS A 106 12.263 -1.958 -6.704 1.00 23.81 H new ATOM 0 HG3 LYS A 106 13.518 -2.309 -5.847 1.00 23.81 H new ATOM 0 HD2 LYS A 106 11.509 -3.849 -4.892 1.00 26.85 H new ATOM 0 HD3 LYS A 106 11.452 -3.984 -6.444 1.00 26.85 H new ATOM 0 HE2 LYS A 106 13.802 -4.575 -4.933 1.00 30.69 H new ATOM 0 HE3 LYS A 106 12.822 -5.685 -5.423 1.00 30.69 H new ATOM 0 HZ1 LYS A 106 14.551 -5.705 -6.861 1.00 32.63 H new ATOM 0 HZ2 LYS A 106 13.484 -5.087 -7.631 1.00 32.63 H new ATOM 0 HZ3 LYS A 106 14.536 -4.265 -7.057 1.00 32.63 H new ATOM 864 N LEU A 107 11.986 1.151 -2.869 1.00 14.49 N ATOM 865 CA LEU A 107 11.366 1.939 -1.800 1.00 14.78 C ATOM 866 C LEU A 107 11.055 3.374 -2.268 1.00 15.95 C ATOM 867 O LEU A 107 9.954 3.888 -2.046 1.00 15.44 O ATOM 868 CB LEU A 107 12.299 1.993 -0.560 1.00 14.57 C ATOM 869 CG LEU A 107 11.796 2.892 0.599 1.00 16.37 C ATOM 870 CD1 LEU A 107 10.470 2.289 1.190 1.00 17.06 C ATOM 871 CD2 LEU A 107 12.809 2.979 1.731 1.00 17.22 C ATOM 0 H LEU A 107 12.788 0.894 -2.695 1.00 14.49 H new ATOM 0 HA LEU A 107 10.532 1.505 -1.562 1.00 14.78 H new ATOM 0 HB2 LEU A 107 12.420 1.091 -0.223 1.00 14.57 H new ATOM 0 HB3 LEU A 107 13.171 2.310 -0.842 1.00 14.57 H new ATOM 0 HG LEU A 107 11.652 3.779 0.234 1.00 16.37 H new ATOM 0 HD11 LEU A 107 10.154 2.850 1.915 1.00 17.06 H new ATOM 0 HD12 LEU A 107 9.795 2.249 0.495 1.00 17.06 H new ATOM 0 HD13 LEU A 107 10.642 1.395 1.525 1.00 17.06 H new ATOM 0 HD21 LEU A 107 12.460 3.548 2.435 1.00 17.22 H new ATOM 0 HD22 LEU A 107 12.975 2.092 2.086 1.00 17.22 H new ATOM 0 HD23 LEU A 107 13.639 3.353 1.395 1.00 17.22 H new ATOM 872 N TYR A 108 12.033 4.029 -2.896 1.00 13.99 N ATOM 873 CA TYR A 108 11.854 5.402 -3.347 1.00 15.88 C ATOM 874 C TYR A 108 11.005 5.582 -4.601 1.00 14.75 C ATOM 875 O TYR A 108 10.406 6.645 -4.759 1.00 14.47 O ATOM 876 CB TYR A 108 13.210 6.084 -3.579 1.00 14.78 C ATOM 877 CG TYR A 108 13.920 6.448 -2.290 1.00 16.53 C ATOM 878 CD1 TYR A 108 14.898 5.627 -1.745 1.00 19.97 C ATOM 879 CD2 TYR A 108 13.583 7.627 -1.600 1.00 20.05 C ATOM 880 CE1 TYR A 108 15.534 5.969 -0.534 1.00 18.13 C ATOM 881 CE2 TYR A 108 14.206 7.986 -0.383 1.00 18.87 C ATOM 882 CZ TYR A 108 15.174 7.157 0.145 1.00 21.31 C ATOM 883 OH TYR A 108 15.746 7.491 1.387 1.00 22.10 O ATOM 0 H TYR A 108 12.806 3.693 -3.069 1.00 13.99 H new ATOM 0 HA TYR A 108 11.363 5.818 -2.621 1.00 15.88 H new ATOM 0 HB2 TYR A 108 13.778 5.494 -4.099 1.00 14.78 H new ATOM 0 HB3 TYR A 108 13.076 6.887 -4.106 1.00 14.78 H new ATOM 0 HD1 TYR A 108 15.136 4.842 -2.184 1.00 19.97 H new ATOM 0 HD2 TYR A 108 12.931 8.187 -1.955 1.00 20.05 H new ATOM 0 HE1 TYR A 108 16.191 5.413 -0.181 1.00 18.13 H new ATOM 0 HE2 TYR A 108 13.967 8.770 0.056 1.00 18.87 H new ATOM 0 HH TYR A 108 16.461 7.062 1.491 1.00 22.10 H new ATOM 884 N ASP A 109 10.998 4.574 -5.483 1.00 14.59 N ATOM 885 CA ASP A 109 10.243 4.671 -6.735 1.00 15.16 C ATOM 886 C ASP A 109 8.803 4.273 -6.411 1.00 15.12 C ATOM 887 O ASP A 109 8.353 3.150 -6.739 1.00 15.28 O ATOM 888 CB ASP A 109 10.810 3.719 -7.771 1.00 14.99 C ATOM 889 CG ASP A 109 10.056 3.784 -9.074 1.00 15.85 C ATOM 890 OD1 ASP A 109 9.194 4.676 -9.249 1.00 18.34 O ATOM 891 OD2 ASP A 109 10.323 2.962 -9.940 1.00 17.08 O ATOM 0 H ASP A 109 11.421 3.833 -5.375 1.00 14.59 H new ATOM 0 HA ASP A 109 10.293 5.570 -7.096 1.00 15.16 H new ATOM 0 HB2 ASP A 109 11.743 3.932 -7.928 1.00 14.99 H new ATOM 0 HB3 ASP A 109 10.780 2.813 -7.426 1.00 14.99 H new ATOM 892 N LEU A 110 8.094 5.216 -5.804 1.00 14.61 N ATOM 893 CA LEU A 110 6.714 5.004 -5.363 1.00 17.19 C ATOM 894 C LEU A 110 5.763 4.390 -6.397 1.00 17.07 C ATOM 895 O LEU A 110 5.051 3.419 -6.106 1.00 16.87 O ATOM 896 CB LEU A 110 6.141 6.320 -4.834 1.00 16.31 C ATOM 897 CG LEU A 110 6.903 6.912 -3.623 1.00 18.21 C ATOM 898 CD1 LEU A 110 6.061 8.065 -3.048 1.00 19.70 C ATOM 899 CD2 LEU A 110 7.114 5.870 -2.567 1.00 17.91 C ATOM 0 H LEU A 110 8.398 6.002 -5.634 1.00 14.61 H new ATOM 0 HA LEU A 110 6.772 4.333 -4.665 1.00 17.19 H new ATOM 0 HB2 LEU A 110 6.142 6.972 -5.552 1.00 16.31 H new ATOM 0 HB3 LEU A 110 5.215 6.178 -4.581 1.00 16.31 H new ATOM 0 HG LEU A 110 7.773 7.230 -3.910 1.00 18.21 H new ATOM 0 HD11 LEU A 110 6.520 8.452 -2.286 1.00 19.70 H new ATOM 0 HD12 LEU A 110 5.935 8.745 -3.729 1.00 19.70 H new ATOM 0 HD13 LEU A 110 5.197 7.726 -2.766 1.00 19.70 H new ATOM 0 HD21 LEU A 110 7.592 6.260 -1.818 1.00 17.91 H new ATOM 0 HD22 LEU A 110 6.255 5.538 -2.264 1.00 17.91 H new ATOM 0 HD23 LEU A 110 7.632 5.137 -2.934 1.00 17.91 H new ATOM 900 N ASP A 111 5.769 4.894 -7.616 1.00 18.67 N ATOM 901 CA ASP A 111 4.857 4.311 -8.587 1.00 20.45 C ATOM 902 C ASP A 111 5.433 3.198 -9.454 1.00 21.22 C ATOM 903 O ASP A 111 4.798 2.820 -10.434 1.00 21.35 O ATOM 904 CB ASP A 111 4.260 5.397 -9.478 1.00 20.99 C ATOM 905 CG ASP A 111 5.283 6.056 -10.336 1.00 23.24 C ATOM 906 OD1 ASP A 111 4.903 6.937 -11.144 1.00 23.90 O ATOM 907 OD2 ASP A 111 6.469 5.681 -10.205 1.00 19.59 O ATOM 0 H ASP A 111 6.264 5.539 -7.895 1.00 18.67 H new ATOM 0 HA ASP A 111 4.173 3.885 -8.047 1.00 20.45 H new ATOM 0 HB2 ASP A 111 3.572 5.008 -10.041 1.00 20.99 H new ATOM 0 HB3 ASP A 111 3.828 6.065 -8.923 1.00 20.99 H new ATOM 908 N ASN A 112 6.635 2.700 -9.122 1.00 19.78 N ATOM 909 CA ASN A 112 7.285 1.594 -9.845 1.00 19.96 C ATOM 910 C ASN A 112 7.448 1.816 -11.355 1.00 19.45 C ATOM 911 O ASN A 112 7.306 0.893 -12.160 1.00 19.80 O ATOM 912 CB ASN A 112 6.531 0.262 -9.565 1.00 21.76 C ATOM 913 CG ASN A 112 7.389 -1.004 -9.859 1.00 24.45 C ATOM 914 OD1 ASN A 112 8.611 -1.048 -9.623 1.00 25.73 O ATOM 915 ND2 ASN A 112 6.743 -2.023 -10.366 1.00 23.83 N ATOM 0 H ASN A 112 7.100 2.999 -8.463 1.00 19.78 H new ATOM 0 HA ASN A 112 8.190 1.550 -9.500 1.00 19.96 H new ATOM 0 HB2 ASN A 112 6.249 0.246 -8.637 1.00 21.76 H new ATOM 0 HB3 ASN A 112 5.727 0.233 -10.106 1.00 21.76 H new ATOM 0 HD21 ASN A 112 7.163 -2.752 -10.547 1.00 23.83 H new ATOM 0 HD22 ASN A 112 5.899 -1.964 -10.519 1.00 23.83 H new ATOM 916 N ASP A 113 7.757 3.035 -11.748 1.00 17.59 N ATOM 917 CA ASP A 113 7.918 3.322 -13.175 1.00 17.01 C ATOM 918 C ASP A 113 9.384 3.333 -13.642 1.00 17.96 C ATOM 919 O ASP A 113 9.673 3.581 -14.825 1.00 16.16 O ATOM 920 CB ASP A 113 7.208 4.651 -13.506 1.00 18.23 C ATOM 921 CG ASP A 113 8.002 5.911 -13.092 1.00 19.92 C ATOM 922 OD1 ASP A 113 8.780 5.930 -12.092 1.00 17.34 O ATOM 923 OD2 ASP A 113 7.787 6.935 -13.774 1.00 17.34 O ATOM 0 H ASP A 113 7.878 3.705 -11.223 1.00 17.59 H new ATOM 0 HA ASP A 113 7.505 2.596 -13.668 1.00 17.01 H new ATOM 0 HB2 ASP A 113 7.038 4.687 -14.460 1.00 18.23 H new ATOM 0 HB3 ASP A 113 6.345 4.664 -13.063 1.00 18.23 H new ATOM 924 N GLY A 114 10.304 3.077 -12.699 1.00 14.42 N ATOM 925 CA GLY A 114 11.722 3.050 -13.021 1.00 15.34 C ATOM 926 C GLY A 114 12.470 4.360 -12.843 1.00 14.80 C ATOM 927 O GLY A 114 13.624 4.458 -13.256 1.00 16.47 O ATOM 0 H GLY A 114 10.120 2.918 -11.874 1.00 14.42 H new ATOM 0 HA2 GLY A 114 12.148 2.377 -12.468 1.00 15.34 H new ATOM 0 HA3 GLY A 114 11.821 2.764 -13.943 1.00 15.34 H new ATOM 928 N TYR A 115 11.830 5.378 -12.289 1.00 15.23 N ATOM 929 CA TYR A 115 12.524 6.650 -12.051 1.00 13.79 C ATOM 930 C TYR A 115 12.102 7.126 -10.686 1.00 15.80 C ATOM 931 O TYR A 115 10.947 6.928 -10.288 1.00 13.05 O ATOM 932 CB TYR A 115 12.083 7.747 -13.035 1.00 14.16 C ATOM 933 CG TYR A 115 12.363 7.459 -14.495 1.00 15.94 C ATOM 934 CD1 TYR A 115 13.619 7.666 -15.025 1.00 15.89 C ATOM 935 CD2 TYR A 115 11.364 6.961 -15.336 1.00 15.70 C ATOM 936 CE1 TYR A 115 13.897 7.390 -16.362 1.00 19.10 C ATOM 937 CE2 TYR A 115 11.626 6.681 -16.688 1.00 16.32 C ATOM 938 CZ TYR A 115 12.892 6.900 -17.189 1.00 19.30 C ATOM 939 OH TYR A 115 13.199 6.626 -18.497 1.00 20.67 O ATOM 0 H TYR A 115 11.006 5.362 -12.044 1.00 15.23 H new ATOM 0 HA TYR A 115 13.478 6.500 -12.147 1.00 13.79 H new ATOM 0 HB2 TYR A 115 11.130 7.894 -12.927 1.00 14.16 H new ATOM 0 HB3 TYR A 115 12.527 8.575 -12.793 1.00 14.16 H new ATOM 0 HD1 TYR A 115 14.295 7.997 -14.478 1.00 15.89 H new ATOM 0 HD2 TYR A 115 10.512 6.812 -14.995 1.00 15.70 H new ATOM 0 HE1 TYR A 115 14.751 7.533 -16.700 1.00 19.10 H new ATOM 0 HE2 TYR A 115 10.953 6.352 -17.239 1.00 16.32 H new ATOM 0 HH TYR A 115 12.516 6.337 -18.891 1.00 20.67 H new ATOM 940 N ILE A 116 13.016 7.738 -9.952 1.00 12.31 N ATOM 941 CA ILE A 116 12.621 8.340 -8.689 1.00 11.73 C ATOM 942 C ILE A 116 12.533 9.852 -9.000 1.00 13.01 C ATOM 943 O ILE A 116 13.546 10.506 -9.301 1.00 11.16 O ATOM 944 CB ILE A 116 13.669 8.177 -7.555 1.00 10.75 C ATOM 945 CG1 ILE A 116 13.874 6.709 -7.184 1.00 13.38 C ATOM 946 CG2 ILE A 116 13.156 8.927 -6.291 1.00 9.03 C ATOM 947 CD1 ILE A 116 15.220 6.467 -6.424 1.00 12.33 C ATOM 0 H ILE A 116 13.847 7.816 -10.157 1.00 12.31 H new ATOM 0 HA ILE A 116 11.805 7.919 -8.377 1.00 11.73 H new ATOM 0 HB ILE A 116 14.512 8.539 -7.869 1.00 10.75 H new ATOM 0 HG12 ILE A 116 13.135 6.412 -6.630 1.00 13.38 H new ATOM 0 HG13 ILE A 116 13.859 6.169 -7.990 1.00 13.38 H new ATOM 0 HG21 ILE A 116 13.802 8.833 -5.574 1.00 9.03 H new ATOM 0 HG22 ILE A 116 13.038 9.867 -6.498 1.00 9.03 H new ATOM 0 HG23 ILE A 116 12.307 8.549 -6.012 1.00 9.03 H new ATOM 0 HD11 ILE A 116 15.306 5.525 -6.210 1.00 12.33 H new ATOM 0 HD12 ILE A 116 15.962 6.740 -6.985 1.00 12.33 H new ATOM 0 HD13 ILE A 116 15.227 6.986 -5.605 1.00 12.33 H new ATOM 948 N THR A 117 11.341 10.426 -8.920 1.00 11.85 N ATOM 949 CA THR A 117 11.195 11.862 -9.158 1.00 12.37 C ATOM 950 C THR A 117 11.513 12.590 -7.859 1.00 12.44 C ATOM 951 O THR A 117 11.525 11.999 -6.766 1.00 13.69 O ATOM 952 CB THR A 117 9.713 12.261 -9.499 1.00 13.37 C ATOM 953 OG1 THR A 117 8.881 11.905 -8.402 1.00 14.02 O ATOM 954 CG2 THR A 117 9.225 11.578 -10.759 1.00 16.08 C ATOM 0 H THR A 117 10.611 10.012 -8.732 1.00 11.85 H new ATOM 0 HA THR A 117 11.781 12.093 -9.896 1.00 12.37 H new ATOM 0 HB THR A 117 9.678 13.218 -9.655 1.00 13.37 H new ATOM 0 HG1 THR A 117 8.075 11.965 -8.630 1.00 14.02 H new ATOM 0 HG21 THR A 117 8.310 11.846 -10.939 1.00 16.08 H new ATOM 0 HG22 THR A 117 9.789 11.834 -11.505 1.00 16.08 H new ATOM 0 HG23 THR A 117 9.262 10.616 -10.641 1.00 16.08 H new ATOM 955 N ARG A 118 11.794 13.878 -7.975 1.00 15.35 N ATOM 956 CA ARG A 118 12.047 14.701 -6.796 1.00 17.12 C ATOM 957 C ARG A 118 10.908 14.575 -5.790 1.00 16.20 C ATOM 958 O ARG A 118 11.134 14.458 -4.578 1.00 16.89 O ATOM 959 CB ARG A 118 12.214 16.181 -7.213 1.00 19.60 C ATOM 960 CG ARG A 118 12.526 17.110 -6.036 1.00 25.14 C ATOM 961 CD ARG A 118 12.844 18.580 -6.471 1.00 26.03 C ATOM 962 NE AARG A 118 13.472 19.341 -5.401 0.50 26.45 N ATOM 963 NE BARG A 118 14.107 18.676 -7.192 0.50 27.65 N ATOM 964 CZ AARG A 118 12.907 19.568 -4.222 0.50 27.42 C ATOM 965 CZ BARG A 118 14.234 18.490 -8.498 0.50 27.47 C ATOM 966 NH1AARG A 118 11.697 19.092 -3.967 0.50 26.85 N ATOM 967 NH1BARG A 118 13.155 18.212 -9.227 0.50 27.77 N ATOM 968 NH2AARG A 118 13.558 20.260 -3.293 0.50 26.73 N ATOM 969 NH2BARG A 118 15.441 18.548 -9.063 0.50 26.35 N ATOM 0 H ARG A 118 11.844 14.298 -8.724 1.00 15.35 H new ATOM 0 HA ARG A 118 12.864 14.389 -6.376 1.00 17.12 H new ATOM 0 HB2 ARG A 118 12.927 16.248 -7.867 1.00 19.60 H new ATOM 0 HB3 ARG A 118 11.401 16.482 -7.648 1.00 19.60 H new ATOM 0 HG2 ARG A 118 11.770 17.116 -5.428 1.00 25.14 H new ATOM 0 HG3 ARG A 118 13.283 16.755 -5.544 1.00 25.14 H new ATOM 0 HD2AARG A 118 13.429 18.568 -7.245 0.50 26.03 H new ATOM 0 HD2BARG A 118 12.126 18.913 -7.032 0.50 26.03 H new ATOM 0 HD3AARG A 118 12.024 19.021 -6.742 0.50 26.03 H new ATOM 0 HD3BARG A 118 12.877 19.149 -5.686 0.50 26.03 H new ATOM 0 HE AARG A 118 14.257 19.663 -5.541 0.50 27.65 H new ATOM 0 HE BARG A 118 14.815 18.865 -6.741 0.50 27.65 H new ATOM 0 HH11AARG A 118 11.279 18.637 -4.565 0.50 27.77 H new ATOM 0 HH11BARG A 118 12.384 18.155 -8.850 0.50 27.77 H new ATOM 0 HH12AARG A 118 11.330 19.238 -3.203 0.50 27.77 H new ATOM 0 HH12BARG A 118 13.229 18.090 -10.075 0.50 27.77 H new ATOM 0 HH21AARG A 118 14.347 20.562 -3.455 0.50 26.35 H new ATOM 0 HH21BARG A 118 16.135 18.706 -8.580 0.50 26.35 H new ATOM 0 HH22AARG A 118 13.190 20.406 -2.529 0.50 26.35 H new ATOM 0 HH22BARG A 118 15.525 18.428 -9.910 0.50 26.35 H new ATOM 970 N ASN A 119 9.658 14.615 -6.261 1.00 17.18 N ATOM 971 CA ASN A 119 8.527 14.525 -5.319 1.00 17.55 C ATOM 972 C ASN A 119 8.410 13.171 -4.613 1.00 15.72 C ATOM 973 O ASN A 119 8.015 13.117 -3.459 1.00 15.15 O ATOM 974 CB ASN A 119 7.192 14.841 -6.014 1.00 22.45 C ATOM 975 CG ASN A 119 6.961 16.348 -6.158 1.00 25.03 C ATOM 976 OD1 ASN A 119 7.393 17.141 -5.305 1.00 31.02 O ATOM 977 ND2 ASN A 119 6.280 16.738 -7.211 1.00 29.38 N ATOM 0 H ASN A 119 9.444 14.691 -7.090 1.00 17.18 H new ATOM 0 HA ASN A 119 8.718 15.191 -4.640 1.00 17.55 H new ATOM 0 HB2 ASN A 119 7.180 14.428 -6.891 1.00 22.45 H new ATOM 0 HB3 ASN A 119 6.464 14.450 -5.506 1.00 22.45 H new ATOM 0 HD21 ASN A 119 6.116 17.574 -7.332 1.00 29.38 H new ATOM 0 HD22 ASN A 119 5.998 16.158 -7.780 1.00 29.38 H new ATOM 978 N GLU A 120 8.708 12.083 -5.316 1.00 15.12 N ATOM 979 CA GLU A 120 8.698 10.763 -4.659 1.00 14.97 C ATOM 980 C GLU A 120 9.799 10.772 -3.589 1.00 15.43 C ATOM 981 O GLU A 120 9.599 10.324 -2.467 1.00 14.34 O ATOM 982 CB GLU A 120 8.964 9.628 -5.659 1.00 14.50 C ATOM 983 CG GLU A 120 7.756 9.303 -6.584 1.00 15.08 C ATOM 984 CD GLU A 120 8.049 8.278 -7.646 1.00 17.18 C ATOM 985 OE1 GLU A 120 9.172 8.261 -8.168 1.00 17.22 O ATOM 986 OE2 GLU A 120 7.146 7.473 -8.011 1.00 19.02 O ATOM 0 H GLU A 120 8.914 12.077 -6.151 1.00 15.12 H new ATOM 0 HA GLU A 120 7.824 10.605 -4.269 1.00 14.97 H new ATOM 0 HB2 GLU A 120 9.726 9.867 -6.210 1.00 14.50 H new ATOM 0 HB3 GLU A 120 9.208 8.828 -5.168 1.00 14.50 H new ATOM 0 HG2 GLU A 120 7.020 8.986 -6.038 1.00 15.08 H new ATOM 0 HG3 GLU A 120 7.460 10.122 -7.012 1.00 15.08 H new ATOM 987 N MET A 121 10.970 11.305 -3.920 1.00 14.46 N ATOM 988 CA MET A 121 11.986 11.287 -2.893 1.00 15.12 C ATOM 989 C MET A 121 11.575 12.163 -1.700 1.00 16.16 C ATOM 990 O MET A 121 11.819 11.801 -0.549 1.00 15.34 O ATOM 991 CB MET A 121 13.321 11.768 -3.417 1.00 14.76 C ATOM 992 CG MET A 121 14.364 11.482 -2.354 1.00 18.79 C ATOM 993 SD MET A 121 16.023 11.688 -2.907 1.00 24.50 S ATOM 994 CE MET A 121 16.060 10.094 -3.837 1.00 21.82 C ATOM 0 H MET A 121 11.182 11.656 -4.676 1.00 14.46 H new ATOM 0 HA MET A 121 12.076 10.365 -2.606 1.00 15.12 H new ATOM 0 HB2 MET A 121 13.545 11.314 -4.245 1.00 14.76 H new ATOM 0 HB3 MET A 121 13.287 12.717 -3.614 1.00 14.76 H new ATOM 0 HG2 MET A 121 14.210 12.068 -1.597 1.00 18.79 H new ATOM 0 HG3 MET A 121 14.249 10.573 -2.037 1.00 18.79 H new ATOM 0 HE1 MET A 121 16.728 9.508 -3.448 1.00 21.82 H new ATOM 0 HE2 MET A 121 15.189 9.670 -3.787 1.00 21.82 H new ATOM 0 HE3 MET A 121 16.282 10.266 -4.765 1.00 21.82 H new ATOM 995 N LEU A 122 10.949 13.307 -1.992 1.00 16.19 N ATOM 996 CA LEU A 122 10.513 14.209 -0.934 1.00 17.27 C ATOM 997 C LEU A 122 9.489 13.507 -0.028 1.00 18.32 C ATOM 998 O LEU A 122 9.527 13.629 1.209 1.00 16.82 O ATOM 999 CB LEU A 122 9.940 15.488 -1.541 1.00 17.95 C ATOM 1000 CG LEU A 122 9.448 16.505 -0.496 1.00 23.54 C ATOM 1001 CD1 LEU A 122 10.654 17.030 0.314 1.00 22.33 C ATOM 1002 CD2 LEU A 122 8.740 17.650 -1.185 1.00 23.40 C ATOM 0 H LEU A 122 10.771 13.573 -2.790 1.00 16.19 H new ATOM 0 HA LEU A 122 11.275 14.454 -0.386 1.00 17.27 H new ATOM 0 HB2 LEU A 122 10.619 15.907 -2.093 1.00 17.95 H new ATOM 0 HB3 LEU A 122 9.202 15.256 -2.126 1.00 17.95 H new ATOM 0 HG LEU A 122 8.823 16.074 0.107 1.00 23.54 H new ATOM 0 HD11 LEU A 122 10.347 17.671 0.974 1.00 22.33 H new ATOM 0 HD12 LEU A 122 11.090 16.289 0.763 1.00 22.33 H new ATOM 0 HD13 LEU A 122 11.284 17.460 -0.285 1.00 22.33 H new ATOM 0 HD21 LEU A 122 8.433 18.287 -0.521 1.00 23.40 H new ATOM 0 HD22 LEU A 122 9.353 18.090 -1.795 1.00 23.40 H new ATOM 0 HD23 LEU A 122 7.980 17.309 -1.681 1.00 23.40 H new ATOM 1003 N ASP A 123 8.567 12.753 -0.630 1.00 18.18 N ATOM 1004 CA ASP A 123 7.628 12.025 0.207 1.00 19.10 C ATOM 1005 C ASP A 123 8.302 11.097 1.195 1.00 18.15 C ATOM 1006 O ASP A 123 7.924 11.052 2.368 1.00 16.56 O ATOM 1007 CB ASP A 123 6.657 11.209 -0.621 1.00 23.73 C ATOM 1008 CG ASP A 123 5.643 12.058 -1.300 1.00 28.61 C ATOM 1009 OD1 ASP A 123 5.387 13.175 -0.788 1.00 30.94 O ATOM 1010 OD2 ASP A 123 5.106 11.617 -2.333 1.00 30.24 O ATOM 0 H ASP A 123 8.473 12.655 -1.479 1.00 18.18 H new ATOM 0 HA ASP A 123 7.153 12.711 0.702 1.00 19.10 H new ATOM 0 HB2 ASP A 123 7.149 10.702 -1.286 1.00 23.73 H new ATOM 0 HB3 ASP A 123 6.208 10.567 -0.049 1.00 23.73 H new ATOM 1011 N ILE A 124 9.284 10.327 0.734 1.00 17.25 N ATOM 1012 CA ILE A 124 9.973 9.415 1.621 1.00 16.63 C ATOM 1013 C ILE A 124 10.792 10.182 2.692 1.00 16.47 C ATOM 1014 O ILE A 124 10.691 9.882 3.884 1.00 16.82 O ATOM 1015 CB ILE A 124 10.993 8.492 0.871 1.00 18.34 C ATOM 1016 CG1 ILE A 124 10.306 7.618 -0.199 1.00 19.27 C ATOM 1017 CG2 ILE A 124 11.707 7.571 1.918 1.00 19.88 C ATOM 1018 CD1 ILE A 124 9.318 6.576 0.386 1.00 21.76 C ATOM 0 H ILE A 124 9.560 10.321 -0.081 1.00 17.25 H new ATOM 0 HA ILE A 124 9.271 8.880 2.022 1.00 16.63 H new ATOM 0 HB ILE A 124 11.635 9.059 0.416 1.00 18.34 H new ATOM 0 HG12 ILE A 124 9.828 8.193 -0.817 1.00 19.27 H new ATOM 0 HG13 ILE A 124 10.986 7.154 -0.712 1.00 19.27 H new ATOM 0 HG21 ILE A 124 12.341 6.995 1.463 1.00 19.88 H new ATOM 0 HG22 ILE A 124 12.176 8.120 2.566 1.00 19.88 H new ATOM 0 HG23 ILE A 124 11.046 7.027 2.374 1.00 19.88 H new ATOM 0 HD11 ILE A 124 8.923 6.063 -0.336 1.00 21.76 H new ATOM 0 HD12 ILE A 124 9.794 5.979 0.984 1.00 21.76 H new ATOM 0 HD13 ILE A 124 8.618 7.034 0.877 1.00 21.76 H new ATOM 1019 N VAL A 125 11.592 11.161 2.262 1.00 17.41 N ATOM 1020 CA VAL A 125 12.442 11.908 3.206 1.00 18.61 C ATOM 1021 C VAL A 125 11.575 12.641 4.265 1.00 19.02 C ATOM 1022 O VAL A 125 11.897 12.641 5.470 1.00 18.51 O ATOM 1023 CB VAL A 125 13.388 12.870 2.402 1.00 18.51 C ATOM 1024 CG1 VAL A 125 14.203 13.803 3.346 1.00 16.64 C ATOM 1025 CG2 VAL A 125 14.363 12.005 1.572 1.00 17.02 C ATOM 0 H VAL A 125 11.660 11.408 1.441 1.00 17.41 H new ATOM 0 HA VAL A 125 13.006 11.296 3.704 1.00 18.61 H new ATOM 0 HB VAL A 125 12.845 13.434 1.830 1.00 18.51 H new ATOM 0 HG11 VAL A 125 14.774 14.381 2.816 1.00 16.64 H new ATOM 0 HG12 VAL A 125 13.593 14.345 3.871 1.00 16.64 H new ATOM 0 HG13 VAL A 125 14.750 13.265 3.940 1.00 16.64 H new ATOM 0 HG21 VAL A 125 14.957 12.581 1.067 1.00 17.02 H new ATOM 0 HG22 VAL A 125 14.885 11.444 2.167 1.00 17.02 H new ATOM 0 HG23 VAL A 125 13.859 11.445 0.961 1.00 17.02 H new ATOM 1026 N ASP A 126 10.478 13.251 3.819 1.00 20.08 N ATOM 1027 CA ASP A 126 9.589 13.910 4.772 1.00 23.02 C ATOM 1028 C ASP A 126 9.069 12.866 5.792 1.00 22.02 C ATOM 1029 O ASP A 126 8.999 13.142 7.000 1.00 21.97 O ATOM 1030 CB ASP A 126 8.431 14.571 4.039 1.00 25.58 C ATOM 1031 CG ASP A 126 7.441 15.196 5.006 1.00 32.22 C ATOM 1032 OD1 ASP A 126 7.851 16.067 5.811 1.00 35.26 O ATOM 1033 OD2 ASP A 126 6.266 14.795 4.978 1.00 35.32 O ATOM 0 H ASP A 126 10.236 13.295 2.995 1.00 20.08 H new ATOM 0 HA ASP A 126 10.077 14.600 5.248 1.00 23.02 H new ATOM 0 HB2 ASP A 126 8.773 15.253 3.440 1.00 25.58 H new ATOM 0 HB3 ASP A 126 7.977 13.913 3.490 1.00 25.58 H new ATOM 1034 N ALA A 127 8.740 11.662 5.314 1.00 22.43 N ATOM 1035 CA ALA A 127 8.281 10.595 6.197 1.00 24.17 C ATOM 1036 C ALA A 127 9.365 10.262 7.216 1.00 24.95 C ATOM 1037 O ALA A 127 9.082 10.084 8.415 1.00 23.69 O ATOM 1038 CB ALA A 127 7.898 9.346 5.380 1.00 23.87 C ATOM 0 H ALA A 127 8.777 11.447 4.482 1.00 22.43 H new ATOM 0 HA ALA A 127 7.491 10.898 6.672 1.00 24.17 H new ATOM 0 HB1 ALA A 127 7.595 8.647 5.980 1.00 23.87 H new ATOM 0 HB2 ALA A 127 7.186 9.570 4.760 1.00 23.87 H new ATOM 0 HB3 ALA A 127 8.671 9.034 4.884 1.00 23.87 H new ATOM 1039 N ILE A 128 10.615 10.184 6.744 1.00 25.17 N ATOM 1040 CA ILE A 128 11.752 9.899 7.614 1.00 25.61 C ATOM 1041 C ILE A 128 11.924 11.006 8.662 1.00 27.96 C ATOM 1042 O ILE A 128 12.192 10.707 9.830 1.00 27.48 O ATOM 1043 CB ILE A 128 13.081 9.743 6.815 1.00 24.72 C ATOM 1044 CG1 ILE A 128 13.016 8.468 5.964 1.00 25.08 C ATOM 1045 CG2 ILE A 128 14.276 9.719 7.752 1.00 24.18 C ATOM 1046 CD1 ILE A 128 14.202 8.283 4.997 1.00 26.82 C ATOM 0 H ILE A 128 10.822 10.295 5.917 1.00 25.17 H new ATOM 0 HA ILE A 128 11.560 9.056 8.053 1.00 25.61 H new ATOM 0 HB ILE A 128 13.192 10.507 6.227 1.00 24.72 H new ATOM 0 HG12 ILE A 128 12.973 7.700 6.555 1.00 25.08 H new ATOM 0 HG13 ILE A 128 12.193 8.477 5.450 1.00 25.08 H new ATOM 0 HG21 ILE A 128 15.091 9.621 7.235 1.00 24.18 H new ATOM 0 HG22 ILE A 128 14.310 10.548 8.255 1.00 24.18 H new ATOM 0 HG23 ILE A 128 14.191 8.972 8.365 1.00 24.18 H new ATOM 0 HD11 ILE A 128 14.088 7.459 4.498 1.00 26.82 H new ATOM 0 HD12 ILE A 128 14.237 9.031 4.381 1.00 26.82 H new ATOM 0 HD13 ILE A 128 15.029 8.242 5.503 1.00 26.82 H new ATOM 1047 N TYR A 129 11.783 12.272 8.259 1.00 29.28 N ATOM 1048 CA TYR A 129 11.926 13.371 9.234 1.00 31.19 C ATOM 1049 C TYR A 129 10.753 13.286 10.244 1.00 34.19 C ATOM 1050 O TYR A 129 10.967 13.425 11.440 1.00 35.02 O ATOM 1051 CB TYR A 129 11.958 14.741 8.519 1.00 27.27 C ATOM 1052 CG TYR A 129 13.331 15.170 7.979 1.00 26.22 C ATOM 1053 CD1 TYR A 129 14.099 14.315 7.181 1.00 23.33 C ATOM 1054 CD2 TYR A 129 13.854 16.449 8.262 1.00 25.06 C ATOM 1055 CE1 TYR A 129 15.341 14.696 6.682 1.00 23.51 C ATOM 1056 CE2 TYR A 129 15.095 16.847 7.759 1.00 22.94 C ATOM 1057 CZ TYR A 129 15.838 15.962 6.964 1.00 25.51 C ATOM 1058 OH TYR A 129 17.060 16.345 6.427 1.00 23.31 O ATOM 0 H TYR A 129 11.610 12.516 7.453 1.00 29.28 H new ATOM 0 HA TYR A 129 12.767 13.283 9.710 1.00 31.19 H new ATOM 0 HB2 TYR A 129 11.330 14.718 7.780 1.00 27.27 H new ATOM 0 HB3 TYR A 129 11.644 15.419 9.138 1.00 27.27 H new ATOM 0 HD1 TYR A 129 13.770 13.469 6.978 1.00 23.33 H new ATOM 0 HD2 TYR A 129 13.365 17.037 8.792 1.00 25.06 H new ATOM 0 HE1 TYR A 129 15.836 14.105 6.162 1.00 23.51 H new ATOM 0 HE2 TYR A 129 15.427 17.694 7.950 1.00 22.94 H new ATOM 0 HH TYR A 129 17.353 17.013 6.844 1.00 23.31 H new ATOM 1059 N GLN A 130 9.533 13.051 9.756 1.00 37.67 N ATOM 1060 CA GLN A 130 8.356 12.930 10.631 1.00 41.40 C ATOM 1061 C GLN A 130 8.545 11.792 11.615 1.00 42.82 C ATOM 1062 O GLN A 130 8.180 11.894 12.782 1.00 43.91 O ATOM 1063 CB GLN A 130 7.096 12.673 9.816 1.00 43.19 C ATOM 1064 CG GLN A 130 6.500 13.914 9.174 1.00 46.94 C ATOM 1065 CD GLN A 130 5.272 13.590 8.340 1.00 49.56 C ATOM 1066 OE1 GLN A 130 5.364 13.370 7.124 1.00 52.00 O ATOM 1067 NE2 GLN A 130 4.110 13.537 8.993 1.00 51.21 N ATOM 0 H GLN A 130 9.362 12.958 8.918 1.00 37.67 H new ATOM 0 HA GLN A 130 8.259 13.767 11.112 1.00 41.40 H new ATOM 0 HB2 GLN A 130 7.300 12.028 9.120 1.00 43.19 H new ATOM 0 HB3 GLN A 130 6.429 12.268 10.392 1.00 43.19 H new ATOM 0 HG2 GLN A 130 6.262 14.552 9.865 1.00 46.94 H new ATOM 0 HG3 GLN A 130 7.168 14.339 8.613 1.00 46.94 H new ATOM 0 HE21 GLN A 130 4.084 13.696 9.838 1.00 51.21 H new ATOM 0 HE22 GLN A 130 3.387 13.344 8.569 1.00 51.21 H new ATOM 1068 N MET A 131 9.134 10.703 11.145 1.00 44.46 N ATOM 1069 CA MET A 131 9.374 9.541 11.992 1.00 46.35 C ATOM 1070 C MET A 131 10.377 9.805 13.116 1.00 47.30 C ATOM 1071 O MET A 131 10.139 9.452 14.276 1.00 47.92 O ATOM 1072 CB MET A 131 9.877 8.375 11.134 1.00 46.80 C ATOM 1073 CG MET A 131 10.639 7.316 11.908 1.00 47.46 C ATOM 1074 SD MET A 131 10.699 5.734 11.029 1.00 47.78 S ATOM 1075 CE MET A 131 12.271 5.834 10.236 1.00 46.55 C ATOM 0 H MET A 131 9.405 10.614 10.334 1.00 44.46 H new ATOM 0 HA MET A 131 8.527 9.325 12.412 1.00 46.35 H new ATOM 0 HB2 MET A 131 9.118 7.958 10.696 1.00 46.80 H new ATOM 0 HB3 MET A 131 10.451 8.725 10.435 1.00 46.80 H new ATOM 0 HG2 MET A 131 11.543 7.627 12.073 1.00 47.46 H new ATOM 0 HG3 MET A 131 10.221 7.187 12.774 1.00 47.46 H new ATOM 0 HE1 MET A 131 12.510 4.964 9.880 1.00 46.55 H new ATOM 0 HE2 MET A 131 12.228 6.478 9.512 1.00 46.55 H new ATOM 0 HE3 MET A 131 12.941 6.115 10.879 1.00 46.55 H new ATOM 1076 N VAL A 132 11.512 10.393 12.755 1.00 47.80 N ATOM 1077 CA VAL A 132 12.566 10.696 13.713 1.00 48.46 C ATOM 1078 C VAL A 132 12.083 11.519 14.914 1.00 48.26 C ATOM 1079 O VAL A 132 11.624 12.648 14.770 1.00 47.62 O ATOM 1080 CB VAL A 132 13.727 11.420 13.001 1.00 49.20 C ATOM 1081 CG1 VAL A 132 14.549 12.231 13.992 1.00 49.50 C ATOM 1082 CG2 VAL A 132 14.607 10.384 12.306 1.00 49.06 C ATOM 0 H VAL A 132 11.692 10.627 11.947 1.00 47.80 H new ATOM 0 HA VAL A 132 12.870 9.847 14.071 1.00 48.46 H new ATOM 0 HB VAL A 132 13.364 12.034 12.344 1.00 49.20 H new ATOM 0 HG11 VAL A 132 15.272 12.677 13.524 1.00 49.50 H new ATOM 0 HG12 VAL A 132 13.982 12.893 14.417 1.00 49.50 H new ATOM 0 HG13 VAL A 132 14.917 11.640 14.667 1.00 49.50 H new ATOM 0 HG21 VAL A 132 15.340 10.832 11.855 1.00 49.06 H new ATOM 0 HG22 VAL A 132 14.962 9.766 12.965 1.00 49.06 H new ATOM 0 HG23 VAL A 132 14.079 9.895 11.656 1.00 49.06 H new ATOM 1083 N LEU A 138 18.889 19.510 13.815 1.00 37.69 N ATOM 1084 CA LEU A 138 19.887 19.118 12.809 1.00 34.75 C ATOM 1085 C LEU A 138 20.645 20.335 12.291 1.00 32.61 C ATOM 1086 O LEU A 138 20.202 21.477 12.472 1.00 31.77 O ATOM 1087 CB LEU A 138 19.188 18.439 11.617 1.00 36.69 C ATOM 1088 CG LEU A 138 18.662 16.998 11.711 1.00 37.90 C ATOM 1089 CD1 LEU A 138 17.793 16.803 12.941 1.00 38.95 C ATOM 1090 CD2 LEU A 138 17.842 16.705 10.464 1.00 37.95 C ATOM 0 HA LEU A 138 20.510 18.506 13.231 1.00 34.75 H new ATOM 0 HB2 LEU A 138 18.434 18.999 11.375 1.00 36.69 H new ATOM 0 HB3 LEU A 138 19.810 18.464 10.873 1.00 36.69 H new ATOM 0 HG LEU A 138 19.417 16.393 11.781 1.00 37.90 H new ATOM 0 HD11 LEU A 138 17.477 15.886 12.972 1.00 38.95 H new ATOM 0 HD12 LEU A 138 18.312 16.993 13.738 1.00 38.95 H new ATOM 0 HD13 LEU A 138 17.034 17.405 12.900 1.00 38.95 H new ATOM 0 HD21 LEU A 138 17.501 15.798 10.506 1.00 37.95 H new ATOM 0 HD22 LEU A 138 17.099 17.327 10.411 1.00 37.95 H new ATOM 0 HD23 LEU A 138 18.402 16.803 9.678 1.00 37.95 H new ATOM 1091 N PRO A 139 21.785 20.106 11.612 1.00 30.02 N ATOM 1092 CA PRO A 139 22.541 21.236 11.080 1.00 27.57 C ATOM 1093 C PRO A 139 21.627 21.980 10.107 1.00 23.71 C ATOM 1094 O PRO A 139 20.852 21.362 9.382 1.00 22.25 O ATOM 1095 CB PRO A 139 23.709 20.570 10.346 1.00 30.54 C ATOM 1096 CG PRO A 139 23.871 19.238 11.045 1.00 30.71 C ATOM 1097 CD PRO A 139 22.424 18.829 11.248 1.00 30.62 C ATOM 0 HA PRO A 139 22.853 21.872 11.742 1.00 27.57 H new ATOM 0 HB2 PRO A 139 23.516 20.455 9.402 1.00 30.54 H new ATOM 0 HB3 PRO A 139 24.517 21.103 10.407 1.00 30.54 H new ATOM 0 HG2 PRO A 139 24.359 18.598 10.504 1.00 30.71 H new ATOM 0 HG3 PRO A 139 24.349 19.322 11.885 1.00 30.71 H new ATOM 0 HD2 PRO A 139 22.039 18.448 10.443 1.00 30.62 H new ATOM 0 HD3 PRO A 139 22.331 18.165 11.949 1.00 30.62 H new ATOM 1098 N GLU A 140 21.739 23.300 10.090 1.00 20.22 N ATOM 1099 CA GLU A 140 20.908 24.124 9.237 1.00 19.21 C ATOM 1100 C GLU A 140 20.830 23.682 7.793 1.00 17.37 C ATOM 1101 O GLU A 140 19.752 23.668 7.243 1.00 16.76 O ATOM 1102 CB GLU A 140 21.368 25.575 9.282 1.00 20.53 C ATOM 1103 CG GLU A 140 20.373 26.527 8.564 1.00 18.64 C ATOM 1104 CD GLU A 140 20.784 27.984 8.710 1.00 22.71 C ATOM 1105 OE1 GLU A 140 21.488 28.517 7.817 1.00 23.75 O ATOM 1106 OE2 GLU A 140 20.424 28.584 9.745 1.00 22.10 O ATOM 0 H GLU A 140 22.298 23.740 10.573 1.00 20.22 H new ATOM 0 HA GLU A 140 20.015 24.025 9.602 1.00 19.21 H new ATOM 0 HB2 GLU A 140 21.469 25.852 10.206 1.00 20.53 H new ATOM 0 HB3 GLU A 140 22.241 25.649 8.866 1.00 20.53 H new ATOM 0 HG2 GLU A 140 20.326 26.296 7.623 1.00 18.64 H new ATOM 0 HG3 GLU A 140 19.484 26.403 8.931 1.00 18.64 H new ATOM 1107 N GLU A 141 21.963 23.302 7.190 1.00 17.09 N ATOM 1108 CA GLU A 141 21.971 22.924 5.774 1.00 19.61 C ATOM 1109 C GLU A 141 21.186 21.625 5.457 1.00 20.41 C ATOM 1110 O GLU A 141 20.971 21.298 4.274 1.00 17.86 O ATOM 1111 CB GLU A 141 23.425 22.849 5.225 1.00 20.16 C ATOM 1112 CG GLU A 141 24.219 21.652 5.654 1.00 24.18 C ATOM 1113 CD GLU A 141 25.640 21.615 5.014 1.00 27.37 C ATOM 1114 OE1 GLU A 141 26.332 20.586 5.179 1.00 28.40 O ATOM 1115 OE2 GLU A 141 26.055 22.609 4.362 1.00 24.99 O ATOM 0 H GLU A 141 22.728 23.257 7.579 1.00 17.09 H new ATOM 0 HA GLU A 141 21.494 23.632 5.313 1.00 19.61 H new ATOM 0 HB2 GLU A 141 23.389 22.862 4.256 1.00 20.16 H new ATOM 0 HB3 GLU A 141 23.900 23.648 5.502 1.00 20.16 H new ATOM 0 HG2 GLU A 141 24.303 21.653 6.620 1.00 24.18 H new ATOM 0 HG3 GLU A 141 23.738 20.845 5.412 1.00 24.18 H new ATOM 1116 N GLU A 142 20.753 20.894 6.496 1.00 20.41 N ATOM 1117 CA GLU A 142 19.933 19.701 6.249 1.00 24.58 C ATOM 1118 C GLU A 142 18.699 19.658 7.151 1.00 24.24 C ATOM 1119 O GLU A 142 18.113 18.590 7.371 1.00 23.29 O ATOM 1120 CB GLU A 142 20.776 18.427 6.428 1.00 26.87 C ATOM 1121 CG GLU A 142 21.429 18.308 7.785 1.00 32.79 C ATOM 1122 CD GLU A 142 22.648 17.369 7.784 1.00 37.12 C ATOM 1123 OE1 GLU A 142 22.527 16.228 8.265 1.00 37.73 O ATOM 1124 OE2 GLU A 142 23.737 17.775 7.303 1.00 39.37 O ATOM 0 H GLU A 142 20.917 21.065 7.323 1.00 20.41 H new ATOM 0 HA GLU A 142 19.619 19.747 5.332 1.00 24.58 H new ATOM 0 HB2 GLU A 142 20.210 17.653 6.283 1.00 26.87 H new ATOM 0 HB3 GLU A 142 21.465 18.407 5.745 1.00 26.87 H new ATOM 0 HG2 GLU A 142 21.705 19.188 8.084 1.00 32.79 H new ATOM 0 HG3 GLU A 142 20.777 17.983 8.425 1.00 32.79 H new ATOM 1125 N ASN A 143 18.279 20.823 7.633 1.00 22.26 N ATOM 1126 CA ASN A 143 17.160 20.862 8.558 1.00 23.12 C ATOM 1127 C ASN A 143 15.743 20.729 8.020 1.00 23.95 C ATOM 1128 O ASN A 143 14.775 20.860 8.779 1.00 22.38 O ATOM 1129 CB ASN A 143 17.301 22.094 9.500 1.00 22.49 C ATOM 1130 CG ASN A 143 16.965 23.414 8.832 1.00 21.89 C ATOM 1131 OD1 ASN A 143 16.714 23.470 7.651 1.00 18.28 O ATOM 1132 ND2 ASN A 143 16.954 24.502 9.624 1.00 22.61 N ATOM 0 H ASN A 143 18.622 21.587 7.440 1.00 22.26 H new ATOM 0 HA ASN A 143 17.247 20.023 9.036 1.00 23.12 H new ATOM 0 HB2 ASN A 143 16.721 21.972 10.268 1.00 22.49 H new ATOM 0 HB3 ASN A 143 18.210 22.132 9.835 1.00 22.49 H new ATOM 0 HD21 ASN A 143 16.763 25.273 9.293 1.00 22.61 H new ATOM 0 HD22 ASN A 143 17.138 24.427 10.461 1.00 22.61 H new ATOM 1133 N THR A 144 15.618 20.499 6.713 1.00 22.49 N ATOM 1134 CA THR A 144 14.302 20.292 6.128 1.00 21.54 C ATOM 1135 C THR A 144 14.463 19.213 5.071 1.00 20.99 C ATOM 1136 O THR A 144 15.550 19.034 4.484 1.00 16.98 O ATOM 1137 CB THR A 144 13.694 21.521 5.413 1.00 21.51 C ATOM 1138 OG1 THR A 144 14.430 21.819 4.220 1.00 19.64 O ATOM 1139 CG2 THR A 144 13.660 22.720 6.349 1.00 22.49 C ATOM 0 H THR A 144 16.274 20.460 6.158 1.00 22.49 H new ATOM 0 HA THR A 144 13.704 20.073 6.860 1.00 21.54 H new ATOM 0 HB THR A 144 12.781 21.313 5.160 1.00 21.51 H new ATOM 0 HG1 THR A 144 14.090 22.487 3.840 1.00 19.64 H new ATOM 0 HG21 THR A 144 13.277 23.481 5.886 1.00 22.49 H new ATOM 0 HG22 THR A 144 13.119 22.509 7.126 1.00 22.49 H new ATOM 0 HG23 THR A 144 14.562 22.935 6.632 1.00 22.49 H new ATOM 1140 N PRO A 145 13.387 18.458 4.853 1.00 20.48 N ATOM 1141 CA PRO A 145 13.338 17.380 3.871 1.00 19.44 C ATOM 1142 C PRO A 145 13.653 17.934 2.497 1.00 17.27 C ATOM 1143 O PRO A 145 14.345 17.256 1.732 1.00 16.53 O ATOM 1144 CB PRO A 145 11.890 16.817 4.016 1.00 21.93 C ATOM 1145 CG PRO A 145 11.182 17.762 4.952 1.00 21.96 C ATOM 1146 CD PRO A 145 12.275 18.343 5.818 1.00 21.15 C ATOM 0 HA PRO A 145 13.990 16.674 4.005 1.00 19.44 H new ATOM 0 HB2 PRO A 145 11.443 16.777 3.156 1.00 21.93 H new ATOM 0 HB3 PRO A 145 11.900 15.915 4.372 1.00 21.93 H new ATOM 0 HG2 PRO A 145 10.714 18.457 4.463 1.00 21.96 H new ATOM 0 HG3 PRO A 145 10.520 17.297 5.487 1.00 21.96 H new ATOM 0 HD2 PRO A 145 12.026 19.203 6.192 1.00 21.15 H new ATOM 0 HD3 PRO A 145 12.497 17.763 6.563 1.00 21.15 H new ATOM 1147 N GLU A 146 13.150 19.138 2.173 1.00 15.42 N ATOM 1148 CA GLU A 146 13.458 19.779 0.891 1.00 16.15 C ATOM 1149 C GLU A 146 15.001 20.007 0.701 1.00 13.92 C ATOM 1150 O GLU A 146 15.533 19.817 -0.390 1.00 12.36 O ATOM 1151 CB GLU A 146 12.739 21.138 0.775 1.00 21.33 C ATOM 1152 CG GLU A 146 11.179 21.063 0.777 1.00 27.39 C ATOM 1153 CD GLU A 146 10.537 20.796 2.172 1.00 29.28 C ATOM 1154 OE1 GLU A 146 11.228 20.639 3.195 1.00 28.29 O ATOM 1155 OE2 GLU A 146 9.292 20.746 2.238 1.00 34.71 O ATOM 0 H GLU A 146 12.630 19.595 2.684 1.00 15.42 H new ATOM 0 HA GLU A 146 13.146 19.177 0.198 1.00 16.15 H new ATOM 0 HB2 GLU A 146 13.023 21.703 1.511 1.00 21.33 H new ATOM 0 HB3 GLU A 146 13.027 21.572 -0.043 1.00 21.33 H new ATOM 0 HG2 GLU A 146 10.828 21.897 0.428 1.00 27.39 H new ATOM 0 HG3 GLU A 146 10.901 20.361 0.168 1.00 27.39 H new ATOM 1156 N LYS A 147 15.698 20.439 1.749 1.00 10.59 N ATOM 1157 CA LYS A 147 17.157 20.660 1.610 1.00 12.66 C ATOM 1158 C LYS A 147 17.904 19.339 1.389 1.00 12.54 C ATOM 1159 O LYS A 147 18.900 19.289 0.677 1.00 12.02 O ATOM 1160 CB LYS A 147 17.736 21.347 2.859 1.00 14.13 C ATOM 1161 CG LYS A 147 17.255 22.782 3.057 1.00 12.92 C ATOM 1162 CD LYS A 147 17.729 23.318 4.425 1.00 13.19 C ATOM 1163 CE LYS A 147 17.290 24.801 4.595 1.00 9.84 C ATOM 1164 NZ LYS A 147 17.722 25.215 5.946 1.00 14.31 N ATOM 0 H LYS A 147 15.370 20.608 2.526 1.00 10.59 H new ATOM 0 HA LYS A 147 17.280 21.233 0.837 1.00 12.66 H new ATOM 0 HB2 LYS A 147 17.500 20.826 3.642 1.00 14.13 H new ATOM 0 HB3 LYS A 147 18.704 21.346 2.798 1.00 14.13 H new ATOM 0 HG2 LYS A 147 17.596 23.346 2.345 1.00 12.92 H new ATOM 0 HG3 LYS A 147 16.287 22.816 3.006 1.00 12.92 H new ATOM 0 HD2 LYS A 147 17.356 22.778 5.139 1.00 13.19 H new ATOM 0 HD3 LYS A 147 18.694 23.249 4.491 1.00 13.19 H new ATOM 0 HE2 LYS A 147 17.697 25.361 3.916 1.00 9.84 H new ATOM 0 HE3 LYS A 147 16.329 24.890 4.498 1.00 9.84 H new ATOM 0 HZ1 LYS A 147 17.677 26.101 6.014 1.00 14.31 H new ATOM 0 HZ2 LYS A 147 17.190 24.844 6.555 1.00 14.31 H new ATOM 0 HZ3 LYS A 147 18.560 24.950 6.084 1.00 14.31 H new ATOM 1165 N ARG A 148 17.464 18.282 2.065 1.00 13.26 N ATOM 1166 CA ARG A 148 18.096 16.980 1.927 1.00 14.92 C ATOM 1167 C ARG A 148 17.859 16.502 0.480 1.00 14.68 C ATOM 1168 O ARG A 148 18.783 16.059 -0.191 1.00 9.95 O ATOM 1169 CB ARG A 148 17.513 15.995 2.950 1.00 15.91 C ATOM 1170 CG ARG A 148 18.066 14.568 2.867 1.00 19.28 C ATOM 1171 CD ARG A 148 19.595 14.551 2.969 1.00 22.91 C ATOM 1172 NE ARG A 148 20.061 13.167 2.904 1.00 28.49 N ATOM 1173 CZ ARG A 148 21.287 12.791 2.556 1.00 28.13 C ATOM 1174 NH1 ARG A 148 22.192 13.707 2.224 1.00 28.10 N ATOM 1175 NH2 ARG A 148 21.604 11.496 2.558 1.00 29.09 N ATOM 0 H ARG A 148 16.799 18.301 2.610 1.00 13.26 H new ATOM 0 HA ARG A 148 19.049 17.035 2.101 1.00 14.92 H new ATOM 0 HB2 ARG A 148 17.679 16.340 3.841 1.00 15.91 H new ATOM 0 HB3 ARG A 148 16.551 15.961 2.834 1.00 15.91 H new ATOM 0 HG2 ARG A 148 17.687 14.031 3.580 1.00 19.28 H new ATOM 0 HG3 ARG A 148 17.792 14.162 2.030 1.00 19.28 H new ATOM 0 HD2 ARG A 148 19.985 15.070 2.248 1.00 22.91 H new ATOM 0 HD3 ARG A 148 19.880 14.962 3.800 1.00 22.91 H new ATOM 0 HE ARG A 148 19.499 12.549 3.107 1.00 28.49 H new ATOM 0 HH11 ARG A 148 21.983 14.541 2.235 1.00 28.10 H new ATOM 0 HH12 ARG A 148 22.986 13.465 1.999 1.00 28.10 H new ATOM 0 HH21 ARG A 148 21.017 10.910 2.784 1.00 29.09 H new ATOM 0 HH22 ARG A 148 22.396 11.247 2.334 1.00 29.09 H new ATOM 1176 N VAL A 149 16.617 16.595 0.003 1.00 12.75 N ATOM 1177 CA VAL A 149 16.332 16.193 -1.370 1.00 13.60 C ATOM 1178 C VAL A 149 17.094 17.003 -2.421 1.00 14.66 C ATOM 1179 O VAL A 149 17.529 16.454 -3.433 1.00 12.96 O ATOM 1180 CB VAL A 149 14.798 16.261 -1.675 1.00 13.77 C ATOM 1181 CG1 VAL A 149 14.550 15.937 -3.195 1.00 15.34 C ATOM 1182 CG2 VAL A 149 14.082 15.201 -0.784 1.00 13.24 C ATOM 0 H VAL A 149 15.940 16.882 0.449 1.00 12.75 H new ATOM 0 HA VAL A 149 16.642 15.276 -1.434 1.00 13.60 H new ATOM 0 HB VAL A 149 14.452 17.147 -1.485 1.00 13.77 H new ATOM 0 HG11 VAL A 149 13.600 15.979 -3.384 1.00 15.34 H new ATOM 0 HG12 VAL A 149 15.018 16.585 -3.745 1.00 15.34 H new ATOM 0 HG13 VAL A 149 14.880 15.047 -3.394 1.00 15.34 H new ATOM 0 HG21 VAL A 149 13.128 15.225 -0.956 1.00 13.24 H new ATOM 0 HG22 VAL A 149 14.426 14.318 -0.992 1.00 13.24 H new ATOM 0 HG23 VAL A 149 14.246 15.400 0.151 1.00 13.24 H new ATOM 1183 N ASP A 150 17.253 18.308 -2.212 1.00 14.33 N ATOM 1184 CA ASP A 150 17.972 19.102 -3.188 1.00 16.24 C ATOM 1185 C ASP A 150 19.446 18.647 -3.271 1.00 14.69 C ATOM 1186 O ASP A 150 20.034 18.587 -4.355 1.00 13.83 O ATOM 1187 CB ASP A 150 17.959 20.590 -2.789 1.00 22.29 C ATOM 1188 CG ASP A 150 16.705 21.326 -3.262 1.00 30.07 C ATOM 1189 OD1 ASP A 150 15.780 20.677 -3.839 1.00 31.30 O ATOM 1190 OD2 ASP A 150 16.659 22.574 -3.038 1.00 34.60 O ATOM 0 H ASP A 150 16.959 18.739 -1.528 1.00 14.33 H new ATOM 0 HA ASP A 150 17.534 18.982 -4.045 1.00 16.24 H new ATOM 0 HB2 ASP A 150 18.025 20.661 -1.824 1.00 22.29 H new ATOM 0 HB3 ASP A 150 18.742 21.026 -3.160 1.00 22.29 H new ATOM 1191 N ARG A 151 20.040 18.354 -2.120 1.00 13.31 N ATOM 1192 CA ARG A 151 21.455 17.932 -2.101 1.00 13.98 C ATOM 1193 C ARG A 151 21.597 16.587 -2.838 1.00 14.22 C ATOM 1194 O ARG A 151 22.523 16.399 -3.623 1.00 14.19 O ATOM 1195 CB ARG A 151 21.946 17.823 -0.646 1.00 14.02 C ATOM 1196 CG ARG A 151 23.307 17.077 -0.512 1.00 13.04 C ATOM 1197 CD ARG A 151 24.459 17.817 -1.204 1.00 13.88 C ATOM 1198 NE ARG A 151 25.755 17.139 -0.951 1.00 13.78 N ATOM 1199 CZ ARG A 151 26.920 17.471 -1.515 1.00 15.45 C ATOM 1200 NH1 ARG A 151 26.977 18.462 -2.373 1.00 13.11 N ATOM 1201 NH2 ARG A 151 28.041 16.821 -1.176 1.00 13.17 N ATOM 0 H ARG A 151 19.659 18.389 -1.350 1.00 13.31 H new ATOM 0 HA ARG A 151 22.003 18.591 -2.555 1.00 13.98 H new ATOM 0 HB2 ARG A 151 22.034 18.714 -0.273 1.00 14.02 H new ATOM 0 HB3 ARG A 151 21.277 17.360 -0.119 1.00 14.02 H new ATOM 0 HG2 ARG A 151 23.518 16.964 0.428 1.00 13.04 H new ATOM 0 HG3 ARG A 151 23.223 16.189 -0.893 1.00 13.04 H new ATOM 0 HD2 ARG A 151 24.293 17.859 -2.159 1.00 13.88 H new ATOM 0 HD3 ARG A 151 24.500 18.731 -0.882 1.00 13.88 H new ATOM 0 HE ARG A 151 25.756 16.481 -0.398 1.00 13.78 H new ATOM 0 HH11 ARG A 151 26.264 18.899 -2.573 1.00 13.11 H new ATOM 0 HH12 ARG A 151 27.727 18.675 -2.735 1.00 13.11 H new ATOM 0 HH21 ARG A 151 28.012 16.188 -0.594 1.00 13.17 H new ATOM 0 HH22 ARG A 151 28.790 17.036 -1.540 1.00 13.17 H new ATOM 1202 N ILE A 152 20.676 15.657 -2.576 1.00 11.19 N ATOM 1203 CA ILE A 152 20.705 14.367 -3.216 1.00 11.45 C ATOM 1204 C ILE A 152 20.593 14.506 -4.724 1.00 10.95 C ATOM 1205 O ILE A 152 21.359 13.868 -5.460 1.00 10.81 O ATOM 1206 CB ILE A 152 19.559 13.425 -2.710 1.00 12.70 C ATOM 1207 CG1 ILE A 152 19.828 12.975 -1.259 1.00 12.22 C ATOM 1208 CG2 ILE A 152 19.434 12.204 -3.653 1.00 11.39 C ATOM 1209 CD1 ILE A 152 21.192 12.256 -1.040 1.00 19.43 C ATOM 0 H ILE A 152 20.026 15.766 -2.024 1.00 11.19 H new ATOM 0 HA ILE A 152 21.558 13.968 -2.983 1.00 11.45 H new ATOM 0 HB ILE A 152 18.720 13.913 -2.719 1.00 12.70 H new ATOM 0 HG12 ILE A 152 19.790 13.753 -0.680 1.00 12.22 H new ATOM 0 HG13 ILE A 152 19.115 12.380 -0.981 1.00 12.22 H new ATOM 0 HG21 ILE A 152 18.724 11.623 -3.338 1.00 11.39 H new ATOM 0 HG22 ILE A 152 19.228 12.508 -4.551 1.00 11.39 H new ATOM 0 HG23 ILE A 152 20.272 11.715 -3.662 1.00 11.39 H new ATOM 0 HD11 ILE A 152 21.281 12.008 -0.107 1.00 19.43 H new ATOM 0 HD12 ILE A 152 21.230 11.459 -1.591 1.00 19.43 H new ATOM 0 HD13 ILE A 152 21.916 12.853 -1.286 1.00 19.43 H new ATOM 1210 N PHE A 153 19.663 15.341 -5.197 1.00 9.95 N ATOM 1211 CA PHE A 153 19.544 15.504 -6.634 1.00 11.48 C ATOM 1212 C PHE A 153 20.723 16.248 -7.196 1.00 12.97 C ATOM 1213 O PHE A 153 21.157 15.941 -8.303 1.00 13.90 O ATOM 1214 CB PHE A 153 18.200 16.167 -7.058 1.00 12.34 C ATOM 1215 CG PHE A 153 17.065 15.179 -7.192 1.00 12.61 C ATOM 1216 CD1 PHE A 153 16.512 14.582 -6.051 1.00 13.27 C ATOM 1217 CD2 PHE A 153 16.635 14.762 -8.464 1.00 13.23 C ATOM 1218 CE1 PHE A 153 15.559 13.565 -6.189 1.00 14.76 C ATOM 1219 CE2 PHE A 153 15.680 13.742 -8.627 1.00 12.73 C ATOM 1220 CZ PHE A 153 15.144 13.137 -7.487 1.00 12.77 C ATOM 0 H PHE A 153 19.115 15.802 -4.720 1.00 9.95 H new ATOM 0 HA PHE A 153 19.540 14.612 -7.014 1.00 11.48 H new ATOM 0 HB2 PHE A 153 17.958 16.841 -6.404 1.00 12.34 H new ATOM 0 HB3 PHE A 153 18.325 16.624 -7.904 1.00 12.34 H new ATOM 0 HD1 PHE A 153 16.777 14.860 -5.204 1.00 13.27 H new ATOM 0 HD2 PHE A 153 16.992 15.172 -9.219 1.00 13.23 H new ATOM 0 HE1 PHE A 153 15.195 13.166 -5.432 1.00 14.76 H new ATOM 0 HE2 PHE A 153 15.411 13.476 -9.476 1.00 12.73 H new ATOM 0 HZ PHE A 153 14.517 12.456 -7.573 1.00 12.77 H new ATOM 1221 N ALA A 154 21.252 17.240 -6.477 1.00 14.29 N ATOM 1222 CA ALA A 154 22.456 17.935 -6.971 1.00 13.76 C ATOM 1223 C ALA A 154 23.544 16.877 -7.209 1.00 15.50 C ATOM 1224 O ALA A 154 24.292 16.950 -8.198 1.00 17.07 O ATOM 1225 CB ALA A 154 22.976 18.975 -5.918 1.00 13.67 C ATOM 0 H ALA A 154 20.945 17.522 -5.725 1.00 14.29 H new ATOM 0 HA ALA A 154 22.241 18.412 -7.788 1.00 13.76 H new ATOM 0 HB1 ALA A 154 23.766 19.418 -6.264 1.00 13.67 H new ATOM 0 HB2 ALA A 154 22.285 19.634 -5.745 1.00 13.67 H new ATOM 0 HB3 ALA A 154 23.198 18.517 -5.093 1.00 13.67 H new ATOM 1226 N MET A 155 23.660 15.890 -6.297 1.00 14.74 N ATOM 1227 CA MET A 155 24.720 14.876 -6.416 1.00 16.84 C ATOM 1228 C MET A 155 24.489 13.725 -7.360 1.00 16.04 C ATOM 1229 O MET A 155 25.436 13.134 -7.890 1.00 16.85 O ATOM 1230 CB MET A 155 25.014 14.231 -5.058 1.00 16.37 C ATOM 1231 CG MET A 155 25.277 15.203 -3.944 1.00 22.16 C ATOM 1232 SD MET A 155 25.152 14.284 -2.352 1.00 27.26 S ATOM 1233 CE MET A 155 26.721 13.443 -2.471 1.00 23.16 C ATOM 0 H MET A 155 23.143 15.794 -5.616 1.00 14.74 H new ATOM 0 HA MET A 155 25.447 15.405 -6.779 1.00 16.84 H new ATOM 0 HB2 MET A 155 24.262 13.670 -4.811 1.00 16.37 H new ATOM 0 HB3 MET A 155 25.784 13.648 -5.151 1.00 16.37 H new ATOM 0 HG2 MET A 155 26.157 15.599 -4.039 1.00 22.16 H new ATOM 0 HG3 MET A 155 24.635 15.930 -3.968 1.00 22.16 H new ATOM 0 HE1 MET A 155 26.571 12.500 -2.641 1.00 23.16 H new ATOM 0 HE2 MET A 155 27.238 13.824 -3.198 1.00 23.16 H new ATOM 0 HE3 MET A 155 27.208 13.547 -1.639 1.00 23.16 H new ATOM 1234 N MET A 156 23.229 13.390 -7.580 1.00 13.44 N ATOM 1235 CA MET A 156 22.938 12.215 -8.380 1.00 12.89 C ATOM 1236 C MET A 156 22.277 12.350 -9.743 1.00 13.06 C ATOM 1237 O MET A 156 22.381 11.439 -10.554 1.00 12.12 O ATOM 1238 CB MET A 156 22.067 11.266 -7.569 1.00 12.33 C ATOM 1239 CG MET A 156 22.689 10.773 -6.229 1.00 14.87 C ATOM 1240 SD MET A 156 21.786 9.371 -5.502 1.00 13.82 S ATOM 1241 CE MET A 156 22.486 9.405 -3.799 1.00 10.27 C ATOM 0 H MET A 156 22.544 13.817 -7.284 1.00 13.44 H new ATOM 0 HA MET A 156 23.834 11.909 -8.589 1.00 12.89 H new ATOM 0 HB2 MET A 156 21.226 11.709 -7.375 1.00 12.33 H new ATOM 0 HB3 MET A 156 21.860 10.492 -8.117 1.00 12.33 H new ATOM 0 HG2 MET A 156 23.611 10.513 -6.382 1.00 14.87 H new ATOM 0 HG3 MET A 156 22.702 11.507 -5.595 1.00 14.87 H new ATOM 0 HE1 MET A 156 22.045 8.735 -3.254 1.00 10.27 H new ATOM 0 HE2 MET A 156 23.437 9.216 -3.836 1.00 10.27 H new ATOM 0 HE3 MET A 156 22.346 10.282 -3.409 1.00 10.27 H new ATOM 1242 N ASP A 157 21.538 13.429 -9.953 1.00 16.05 N ATOM 1243 CA ASP A 157 20.827 13.619 -11.214 1.00 17.47 C ATOM 1244 C ASP A 157 21.844 14.160 -12.210 1.00 22.60 C ATOM 1245 O ASP A 157 22.170 15.345 -12.199 1.00 22.91 O ATOM 1246 CB ASP A 157 19.662 14.568 -10.989 1.00 17.57 C ATOM 1247 CG ASP A 157 18.707 14.644 -12.188 1.00 15.14 C ATOM 1248 OD1 ASP A 157 18.817 13.806 -13.113 1.00 15.37 O ATOM 1249 OD2 ASP A 157 17.850 15.554 -12.198 1.00 13.38 O ATOM 0 H ASP A 157 21.433 14.063 -9.382 1.00 16.05 H new ATOM 0 HA ASP A 157 20.451 12.795 -11.561 1.00 17.47 H new ATOM 0 HB2 ASP A 157 19.166 14.283 -10.205 1.00 17.57 H new ATOM 0 HB3 ASP A 157 20.006 15.455 -10.800 1.00 17.57 H new ATOM 1250 N LYS A 158 22.371 13.258 -13.029 1.00 25.63 N ATOM 1251 CA LYS A 158 23.442 13.592 -13.968 1.00 29.61 C ATOM 1252 C LYS A 158 23.007 14.247 -15.257 1.00 31.36 C ATOM 1253 O LYS A 158 23.755 15.036 -15.845 1.00 33.26 O ATOM 1254 CB LYS A 158 24.283 12.335 -14.264 1.00 29.77 C ATOM 1255 CG LYS A 158 25.705 12.435 -13.766 1.00 33.94 C ATOM 1256 CD LYS A 158 25.768 12.358 -12.243 1.00 36.86 C ATOM 1257 CE LYS A 158 27.097 12.877 -11.724 1.00 39.75 C ATOM 1258 NZ LYS A 158 28.224 12.255 -12.479 1.00 39.28 N ATOM 0 H LYS A 158 22.120 12.436 -13.058 1.00 25.63 H new ATOM 0 HA LYS A 158 23.970 14.271 -13.519 1.00 29.61 H new ATOM 0 HB2 LYS A 158 23.857 11.565 -13.855 1.00 29.77 H new ATOM 0 HB3 LYS A 158 24.293 12.178 -15.221 1.00 29.77 H new ATOM 0 HG2 LYS A 158 26.235 11.719 -14.150 1.00 33.94 H new ATOM 0 HG3 LYS A 158 26.097 13.270 -14.066 1.00 33.94 H new ATOM 0 HD2 LYS A 158 25.043 12.876 -11.860 1.00 36.86 H new ATOM 0 HD3 LYS A 158 25.642 11.440 -11.957 1.00 36.86 H new ATOM 0 HE2 LYS A 158 27.132 13.842 -11.814 1.00 39.75 H new ATOM 0 HE3 LYS A 158 27.183 12.677 -10.779 1.00 39.75 H new ATOM 0 HZ1 LYS A 158 28.984 12.376 -12.032 1.00 39.28 H new ATOM 0 HZ2 LYS A 158 28.072 11.383 -12.575 1.00 39.28 H new ATOM 0 HZ3 LYS A 158 28.289 12.634 -13.281 1.00 39.28 H new ATOM 1259 N ASN A 159 21.791 13.973 -15.699 1.00 30.51 N ATOM 1260 CA ASN A 159 21.352 14.598 -16.927 1.00 31.16 C ATOM 1261 C ASN A 159 20.430 15.726 -16.561 1.00 30.46 C ATOM 1262 O ASN A 159 19.738 16.310 -17.394 1.00 32.02 O ATOM 1263 CB ASN A 159 20.672 13.576 -17.848 1.00 29.42 C ATOM 1264 CG ASN A 159 19.301 13.135 -17.343 1.00 28.85 C ATOM 1265 OD1 ASN A 159 18.990 13.251 -16.158 1.00 24.88 O ATOM 1266 ND2 ASN A 159 18.490 12.605 -18.244 1.00 26.77 N ATOM 0 H ASN A 159 21.225 13.449 -15.319 1.00 30.51 H new ATOM 0 HA ASN A 159 22.109 14.947 -17.422 1.00 31.16 H new ATOM 0 HB2 ASN A 159 20.576 13.960 -18.734 1.00 29.42 H new ATOM 0 HB3 ASN A 159 21.244 12.798 -17.937 1.00 29.42 H new ATOM 0 HD21 ASN A 159 17.711 12.325 -18.010 1.00 26.77 H new ATOM 0 HD22 ASN A 159 18.742 12.540 -19.064 1.00 26.77 H new ATOM 1267 N ALA A 160 20.439 16.034 -15.275 1.00 30.81 N ATOM 1268 CA ALA A 160 19.645 17.114 -14.710 1.00 28.50 C ATOM 1269 C ALA A 160 18.216 17.208 -15.210 1.00 28.66 C ATOM 1270 O ALA A 160 17.747 18.296 -15.565 1.00 29.09 O ATOM 1271 CB ALA A 160 20.384 18.451 -14.934 1.00 30.76 C ATOM 0 H ALA A 160 20.915 15.615 -14.694 1.00 30.81 H new ATOM 0 HA ALA A 160 19.555 16.911 -13.766 1.00 28.50 H new ATOM 0 HB1 ALA A 160 19.861 19.177 -14.560 1.00 30.76 H new ATOM 0 HB2 ALA A 160 21.250 18.419 -14.498 1.00 30.76 H new ATOM 0 HB3 ALA A 160 20.506 18.598 -15.885 1.00 30.76 H new ATOM 1272 N ASP A 161 17.490 16.088 -15.240 1.00 27.43 N ATOM 1273 CA ASP A 161 16.104 16.161 -15.693 1.00 24.46 C ATOM 1274 C ASP A 161 15.060 16.049 -14.588 1.00 24.35 C ATOM 1275 O ASP A 161 13.875 15.943 -14.869 1.00 24.62 O ATOM 1276 CB ASP A 161 15.841 15.096 -16.744 1.00 25.56 C ATOM 1277 CG ASP A 161 15.890 13.677 -16.169 1.00 25.80 C ATOM 1278 OD1 ASP A 161 16.333 13.491 -15.000 1.00 23.46 O ATOM 1279 OD2 ASP A 161 15.484 12.751 -16.902 1.00 22.90 O ATOM 0 H ASP A 161 17.768 15.307 -15.012 1.00 27.43 H new ATOM 0 HA ASP A 161 16.005 17.052 -16.064 1.00 24.46 H new ATOM 0 HB2 ASP A 161 14.971 15.249 -17.144 1.00 25.56 H new ATOM 0 HB3 ASP A 161 16.498 15.177 -17.453 1.00 25.56 H new ATOM 1280 N GLY A 162 15.488 16.059 -13.328 1.00 22.76 N ATOM 1281 CA GLY A 162 14.544 15.973 -12.231 1.00 19.98 C ATOM 1282 C GLY A 162 14.083 14.583 -11.802 1.00 18.45 C ATOM 1283 O GLY A 162 13.148 14.467 -10.991 1.00 17.17 O ATOM 0 H GLY A 162 16.314 16.115 -13.093 1.00 22.76 H new ATOM 0 HA2 GLY A 162 14.941 16.407 -11.460 1.00 19.98 H new ATOM 0 HA3 GLY A 162 13.758 16.487 -12.472 1.00 19.98 H new ATOM 1284 N LYS A 163 14.699 13.547 -12.363 1.00 17.39 N ATOM 1285 CA LYS A 163 14.357 12.147 -12.025 1.00 17.95 C ATOM 1286 C LYS A 163 15.637 11.351 -11.933 1.00 15.27 C ATOM 1287 O LYS A 163 16.596 11.643 -12.641 1.00 15.39 O ATOM 1288 CB LYS A 163 13.557 11.455 -13.152 1.00 19.93 C ATOM 1289 CG LYS A 163 12.218 12.004 -13.473 1.00 23.71 C ATOM 1290 CD LYS A 163 11.592 11.231 -14.667 1.00 25.37 C ATOM 1291 CE LYS A 163 12.595 10.996 -15.798 1.00 27.15 C ATOM 1292 NZ LYS A 163 11.924 10.368 -16.985 1.00 31.98 N ATOM 0 H LYS A 163 15.325 13.625 -12.948 1.00 17.39 H new ATOM 0 HA LYS A 163 13.843 12.174 -11.203 1.00 17.95 H new ATOM 0 HB2 LYS A 163 14.093 11.481 -13.960 1.00 19.93 H new ATOM 0 HB3 LYS A 163 13.449 10.521 -12.913 1.00 19.93 H new ATOM 0 HG2 LYS A 163 11.640 11.937 -12.697 1.00 23.71 H new ATOM 0 HG3 LYS A 163 12.292 12.946 -13.692 1.00 23.71 H new ATOM 0 HD2 LYS A 163 11.254 10.377 -14.355 1.00 25.37 H new ATOM 0 HD3 LYS A 163 10.833 11.729 -15.009 1.00 25.37 H new ATOM 0 HE2 LYS A 163 12.999 11.839 -16.058 1.00 27.15 H new ATOM 0 HE3 LYS A 163 13.312 10.422 -15.486 1.00 27.15 H new ATOM 0 HZ1 LYS A 163 12.155 9.510 -17.037 1.00 31.98 H new ATOM 0 HZ2 LYS A 163 11.041 10.432 -16.896 1.00 31.98 H new ATOM 0 HZ3 LYS A 163 12.178 10.789 -17.727 1.00 31.98 H new ATOM 1293 N LEU A 164 15.644 10.321 -11.105 1.00 13.47 N ATOM 1294 CA LEU A 164 16.821 9.449 -11.045 1.00 12.87 C ATOM 1295 C LEU A 164 16.472 8.092 -11.651 1.00 13.09 C ATOM 1296 O LEU A 164 15.454 7.467 -11.270 1.00 12.53 O ATOM 1297 CB LEU A 164 17.290 9.199 -9.586 1.00 10.59 C ATOM 1298 CG LEU A 164 17.504 10.489 -8.804 1.00 11.06 C ATOM 1299 CD1 LEU A 164 17.980 10.103 -7.383 1.00 12.66 C ATOM 1300 CD2 LEU A 164 18.485 11.383 -9.457 1.00 9.19 C ATOM 0 H LEU A 164 14.999 10.106 -10.579 1.00 13.47 H new ATOM 0 HA LEU A 164 17.532 9.892 -11.534 1.00 12.87 H new ATOM 0 HB2 LEU A 164 16.631 8.654 -9.128 1.00 10.59 H new ATOM 0 HB3 LEU A 164 18.117 8.693 -9.599 1.00 10.59 H new ATOM 0 HG LEU A 164 16.670 10.983 -8.767 1.00 11.06 H new ATOM 0 HD11 LEU A 164 18.125 10.907 -6.860 1.00 12.66 H new ATOM 0 HD12 LEU A 164 17.305 9.556 -6.953 1.00 12.66 H new ATOM 0 HD13 LEU A 164 18.809 9.604 -7.444 1.00 12.66 H new ATOM 0 HD21 LEU A 164 18.591 12.189 -8.928 1.00 9.19 H new ATOM 0 HD22 LEU A 164 19.339 10.929 -9.528 1.00 9.19 H new ATOM 0 HD23 LEU A 164 18.169 11.618 -10.344 1.00 9.19 H new ATOM 1301 N THR A 165 17.290 7.655 -12.607 1.00 12.46 N ATOM 1302 CA THR A 165 17.162 6.324 -13.179 1.00 11.11 C ATOM 1303 C THR A 165 17.849 5.421 -12.138 1.00 11.99 C ATOM 1304 O THR A 165 18.544 5.919 -11.229 1.00 10.29 O ATOM 1305 CB THR A 165 17.946 6.212 -14.500 1.00 13.46 C ATOM 1306 OG1 THR A 165 19.331 6.604 -14.273 1.00 11.57 O ATOM 1307 CG2 THR A 165 17.329 7.109 -15.591 1.00 12.29 C ATOM 0 H THR A 165 17.931 8.122 -12.939 1.00 12.46 H new ATOM 0 HA THR A 165 16.238 6.097 -13.367 1.00 11.11 H new ATOM 0 HB THR A 165 17.905 5.292 -14.804 1.00 13.46 H new ATOM 0 HG1 THR A 165 19.779 6.466 -14.970 1.00 11.57 H new ATOM 0 HG21 THR A 165 17.840 7.020 -16.411 1.00 12.29 H new ATOM 0 HG22 THR A 165 16.411 6.839 -15.752 1.00 12.29 H new ATOM 0 HG23 THR A 165 17.347 8.034 -15.298 1.00 12.29 H new ATOM 1308 N LEU A 166 17.655 4.112 -12.246 1.00 11.39 N ATOM 1309 CA LEU A 166 18.325 3.177 -11.328 1.00 11.69 C ATOM 1310 C LEU A 166 19.858 3.371 -11.439 1.00 13.27 C ATOM 1311 O LEU A 166 20.559 3.358 -10.437 1.00 10.20 O ATOM 1312 CB LEU A 166 17.942 1.721 -11.683 1.00 11.66 C ATOM 1313 CG LEU A 166 18.649 0.611 -10.900 1.00 12.63 C ATOM 1314 CD1 LEU A 166 18.325 0.759 -9.436 1.00 11.01 C ATOM 1315 CD2 LEU A 166 18.212 -0.792 -11.350 1.00 12.30 C ATOM 0 H LEU A 166 17.148 3.742 -12.833 1.00 11.39 H new ATOM 0 HA LEU A 166 18.043 3.355 -10.417 1.00 11.69 H new ATOM 0 HB2 LEU A 166 16.986 1.620 -11.554 1.00 11.66 H new ATOM 0 HB3 LEU A 166 18.117 1.584 -12.627 1.00 11.66 H new ATOM 0 HG LEU A 166 19.601 0.700 -11.066 1.00 12.63 H new ATOM 0 HD11 LEU A 166 18.770 0.059 -8.934 1.00 11.01 H new ATOM 0 HD12 LEU A 166 18.630 1.625 -9.123 1.00 11.01 H new ATOM 0 HD13 LEU A 166 17.366 0.689 -9.308 1.00 11.01 H new ATOM 0 HD21 LEU A 166 18.684 -1.461 -10.829 1.00 12.30 H new ATOM 0 HD22 LEU A 166 17.257 -0.892 -11.215 1.00 12.30 H new ATOM 0 HD23 LEU A 166 18.420 -0.910 -12.290 1.00 12.30 H new ATOM 1316 N GLN A 167 20.377 3.568 -12.652 1.00 12.36 N ATOM 1317 CA GLN A 167 21.831 3.799 -12.793 1.00 15.71 C ATOM 1318 C GLN A 167 22.324 5.057 -12.075 1.00 13.97 C ATOM 1319 O GLN A 167 23.383 5.007 -11.435 1.00 13.16 O ATOM 1320 CB GLN A 167 22.226 3.944 -14.264 1.00 19.98 C ATOM 1321 CG GLN A 167 22.573 2.654 -14.935 1.00 27.44 C ATOM 1322 CD GLN A 167 23.006 2.909 -16.362 1.00 32.86 C ATOM 1323 OE1 GLN A 167 22.196 3.319 -17.197 1.00 34.97 O ATOM 1324 NE2 GLN A 167 24.298 2.715 -16.642 1.00 35.14 N ATOM 0 H GLN A 167 19.929 3.573 -13.386 1.00 12.36 H new ATOM 0 HA GLN A 167 22.243 3.020 -12.387 1.00 15.71 H new ATOM 0 HB2 GLN A 167 21.494 4.361 -14.745 1.00 19.98 H new ATOM 0 HB3 GLN A 167 22.985 4.544 -14.327 1.00 19.98 H new ATOM 0 HG2 GLN A 167 23.285 2.209 -14.448 1.00 27.44 H new ATOM 0 HG3 GLN A 167 21.807 2.059 -14.924 1.00 27.44 H new ATOM 0 HE21 GLN A 167 24.832 2.428 -16.032 1.00 35.14 H new ATOM 0 HE22 GLN A 167 24.596 2.877 -17.432 1.00 35.14 H new ATOM 1325 N GLU A 168 21.584 6.175 -12.167 1.00 11.21 N ATOM 1326 CA GLU A 168 21.980 7.431 -11.501 1.00 9.66 C ATOM 1327 C GLU A 168 21.943 7.231 -9.960 1.00 11.92 C ATOM 1328 O GLU A 168 22.799 7.727 -9.223 1.00 9.83 O ATOM 1329 CB GLU A 168 21.046 8.610 -11.870 1.00 8.96 C ATOM 1330 CG GLU A 168 21.224 9.186 -13.337 1.00 14.82 C ATOM 1331 CD GLU A 168 20.207 10.235 -13.712 1.00 16.42 C ATOM 1332 OE1 GLU A 168 19.024 10.061 -13.370 1.00 16.35 O ATOM 1333 OE2 GLU A 168 20.552 11.226 -14.394 1.00 18.67 O ATOM 0 H GLU A 168 20.849 6.227 -12.611 1.00 11.21 H new ATOM 0 HA GLU A 168 22.876 7.650 -11.803 1.00 9.66 H new ATOM 0 HB2 GLU A 168 20.127 8.320 -11.762 1.00 8.96 H new ATOM 0 HB3 GLU A 168 21.193 9.330 -11.236 1.00 8.96 H new ATOM 0 HG2 GLU A 168 22.113 9.566 -13.420 1.00 14.82 H new ATOM 0 HG3 GLU A 168 21.169 8.454 -13.971 1.00 14.82 H new ATOM 1334 N PHE A 169 20.926 6.529 -9.494 1.00 8.85 N ATOM 1335 CA PHE A 169 20.798 6.254 -8.079 1.00 11.51 C ATOM 1336 C PHE A 169 21.939 5.356 -7.528 1.00 10.43 C ATOM 1337 O PHE A 169 22.483 5.616 -6.455 1.00 9.68 O ATOM 1338 CB PHE A 169 19.432 5.599 -7.852 1.00 11.66 C ATOM 1339 CG PHE A 169 19.150 5.276 -6.433 1.00 13.42 C ATOM 1340 CD1 PHE A 169 18.735 6.264 -5.559 1.00 14.84 C ATOM 1341 CD2 PHE A 169 19.285 3.960 -5.969 1.00 13.31 C ATOM 1342 CE1 PHE A 169 18.448 5.946 -4.201 1.00 15.94 C ATOM 1343 CE2 PHE A 169 18.997 3.631 -4.608 1.00 14.46 C ATOM 1344 CZ PHE A 169 18.579 4.639 -3.742 1.00 14.84 C ATOM 0 H PHE A 169 20.298 6.202 -9.982 1.00 8.85 H new ATOM 0 HA PHE A 169 20.868 7.090 -7.592 1.00 11.51 H new ATOM 0 HB2 PHE A 169 18.740 6.192 -8.183 1.00 11.66 H new ATOM 0 HB3 PHE A 169 19.383 4.784 -8.376 1.00 11.66 H new ATOM 0 HD1 PHE A 169 18.643 7.139 -5.859 1.00 14.84 H new ATOM 0 HD2 PHE A 169 19.565 3.293 -6.554 1.00 13.31 H new ATOM 0 HE1 PHE A 169 18.172 6.615 -3.618 1.00 15.94 H new ATOM 0 HE2 PHE A 169 19.087 2.756 -4.305 1.00 14.46 H new ATOM 0 HZ PHE A 169 18.387 4.438 -2.855 1.00 14.84 H new ATOM 1345 N GLN A 170 22.295 4.319 -8.273 1.00 11.17 N ATOM 1346 CA GLN A 170 23.337 3.370 -7.841 1.00 13.09 C ATOM 1347 C GLN A 170 24.712 4.084 -7.816 1.00 14.16 C ATOM 1348 O GLN A 170 25.454 3.986 -6.841 1.00 12.54 O ATOM 1349 CB GLN A 170 23.441 2.181 -8.822 1.00 15.24 C ATOM 1350 CG GLN A 170 22.317 1.138 -8.764 1.00 16.77 C ATOM 1351 CD GLN A 170 22.281 0.204 -10.001 1.00 18.75 C ATOM 1352 OE1 GLN A 170 21.922 -0.983 -9.886 1.00 22.36 O ATOM 1353 NE2 GLN A 170 22.601 0.744 -11.173 1.00 15.63 N ATOM 0 H GLN A 170 21.948 4.138 -9.039 1.00 11.17 H new ATOM 0 HA GLN A 170 23.097 3.046 -6.959 1.00 13.09 H new ATOM 0 HB2 GLN A 170 23.479 2.535 -9.724 1.00 15.24 H new ATOM 0 HB3 GLN A 170 24.283 1.728 -8.660 1.00 15.24 H new ATOM 0 HG2 GLN A 170 22.425 0.600 -7.964 1.00 16.77 H new ATOM 0 HG3 GLN A 170 21.465 1.595 -8.687 1.00 16.77 H new ATOM 0 HE21 GLN A 170 22.845 1.568 -11.215 1.00 15.63 H new ATOM 0 HE22 GLN A 170 22.564 0.270 -11.889 1.00 15.63 H new ATOM 1354 N GLU A 171 25.015 4.770 -8.909 1.00 13.30 N ATOM 1355 CA GLU A 171 26.306 5.480 -9.044 1.00 15.32 C ATOM 1356 C GLU A 171 26.389 6.643 -8.078 1.00 14.09 C ATOM 1357 O GLU A 171 27.442 6.908 -7.452 1.00 11.51 O ATOM 1358 CB GLU A 171 26.473 6.002 -10.477 1.00 18.00 C ATOM 1359 CG GLU A 171 26.845 4.904 -11.472 1.00 23.21 C ATOM 1360 CD GLU A 171 26.999 5.414 -12.928 1.00 27.15 C ATOM 1361 OE1 GLU A 171 27.106 6.649 -13.187 1.00 28.39 O ATOM 1362 OE2 GLU A 171 27.020 4.560 -13.833 1.00 31.02 O ATOM 0 H GLU A 171 24.495 4.844 -9.590 1.00 13.30 H new ATOM 0 HA GLU A 171 27.015 4.851 -8.839 1.00 15.32 H new ATOM 0 HB2 GLU A 171 25.646 6.423 -10.761 1.00 18.00 H new ATOM 0 HB3 GLU A 171 27.159 6.688 -10.488 1.00 18.00 H new ATOM 0 HG2 GLU A 171 27.677 4.492 -11.192 1.00 23.21 H new ATOM 0 HG3 GLU A 171 26.165 4.213 -11.449 1.00 23.21 H new ATOM 1363 N GLY A 172 25.254 7.346 -7.931 1.00 10.68 N ATOM 1364 CA GLY A 172 25.255 8.462 -7.036 1.00 10.36 C ATOM 1365 C GLY A 172 25.428 8.015 -5.601 1.00 9.03 C ATOM 1366 O GLY A 172 26.102 8.705 -4.839 1.00 10.97 O ATOM 0 H GLY A 172 24.510 7.186 -8.332 1.00 10.68 H new ATOM 0 HA2 GLY A 172 25.971 9.071 -7.276 1.00 10.36 H new ATOM 0 HA3 GLY A 172 24.423 8.952 -7.126 1.00 10.36 H new ATOM 1367 N SER A 173 24.829 6.878 -5.241 1.00 6.55 N ATOM 1368 CA SER A 173 24.937 6.346 -3.887 1.00 8.85 C ATOM 1369 C SER A 173 26.354 5.857 -3.613 1.00 10.33 C ATOM 1370 O SER A 173 26.860 6.070 -2.529 1.00 9.09 O ATOM 1371 CB SER A 173 23.990 5.183 -3.698 1.00 9.06 C ATOM 1372 OG SER A 173 22.635 5.688 -3.723 1.00 9.53 O ATOM 0 H SER A 173 24.353 6.399 -5.773 1.00 6.55 H new ATOM 0 HA SER A 173 24.711 7.061 -3.272 1.00 8.85 H new ATOM 0 HB2 SER A 173 24.118 4.526 -4.400 1.00 9.06 H new ATOM 0 HB3 SER A 173 24.168 4.736 -2.856 1.00 9.06 H new ATOM 0 HG SER A 173 22.373 5.750 -4.519 1.00 9.53 H new ATOM 1373 N LYS A 174 26.955 5.191 -4.604 1.00 8.68 N ATOM 1374 CA LYS A 174 28.335 4.676 -4.421 1.00 9.91 C ATOM 1375 C LYS A 174 29.386 5.779 -4.331 1.00 10.14 C ATOM 1376 O LYS A 174 30.488 5.561 -3.825 1.00 13.02 O ATOM 1377 CB LYS A 174 28.681 3.701 -5.525 1.00 10.69 C ATOM 1378 CG LYS A 174 27.926 2.340 -5.428 1.00 13.64 C ATOM 1379 CD LYS A 174 28.306 1.445 -6.623 1.00 15.91 C ATOM 1380 CE LYS A 174 27.723 0.028 -6.451 1.00 22.38 C ATOM 1381 NZ LYS A 174 28.483 -1.069 -7.177 1.00 21.92 N ATOM 0 H LYS A 174 26.601 5.026 -5.370 1.00 8.68 H new ATOM 0 HA LYS A 174 28.348 4.218 -3.566 1.00 9.91 H new ATOM 0 HB2 LYS A 174 28.481 4.111 -6.381 1.00 10.69 H new ATOM 0 HB3 LYS A 174 29.636 3.533 -5.508 1.00 10.69 H new ATOM 0 HG2 LYS A 174 28.150 1.895 -4.596 1.00 13.64 H new ATOM 0 HG3 LYS A 174 26.968 2.492 -5.419 1.00 13.64 H new ATOM 0 HD2 LYS A 174 27.975 1.838 -7.446 1.00 15.91 H new ATOM 0 HD3 LYS A 174 29.272 1.395 -6.701 1.00 15.91 H new ATOM 0 HE2 LYS A 174 27.699 -0.185 -5.505 1.00 22.38 H new ATOM 0 HE3 LYS A 174 26.805 0.030 -6.765 1.00 22.38 H new ATOM 0 HZ1 LYS A 174 28.032 -1.834 -7.114 1.00 21.92 H new ATOM 0 HZ2 LYS A 174 28.576 -0.849 -8.034 1.00 21.92 H new ATOM 0 HZ3 LYS A 174 29.287 -1.168 -6.808 1.00 21.92 H new ATOM 1382 N ALA A 175 29.078 6.957 -4.869 1.00 8.41 N ATOM 1383 CA ALA A 175 29.983 8.108 -4.801 1.00 10.00 C ATOM 1384 C ALA A 175 29.997 8.764 -3.416 1.00 11.08 C ATOM 1385 O ALA A 175 30.967 9.414 -3.050 1.00 9.75 O ATOM 1386 CB ALA A 175 29.606 9.130 -5.861 1.00 6.56 C ATOM 0 H ALA A 175 28.341 7.113 -5.283 1.00 8.41 H new ATOM 0 HA ALA A 175 30.880 7.778 -4.968 1.00 10.00 H new ATOM 0 HB1 ALA A 175 30.209 9.888 -5.809 1.00 6.56 H new ATOM 0 HB2 ALA A 175 29.672 8.724 -6.740 1.00 6.56 H new ATOM 0 HB3 ALA A 175 28.696 9.431 -5.712 1.00 6.56 H new ATOM 1387 N ASP A 176 28.965 8.515 -2.604 1.00 10.93 N ATOM 1388 CA ASP A 176 28.836 9.179 -1.296 1.00 11.81 C ATOM 1389 C ASP A 176 29.280 8.203 -0.196 1.00 13.01 C ATOM 1390 O ASP A 176 28.637 7.179 0.033 1.00 10.16 O ATOM 1391 CB ASP A 176 27.355 9.569 -1.165 1.00 16.50 C ATOM 1392 CG ASP A 176 27.054 10.346 0.106 1.00 20.43 C ATOM 1393 OD1 ASP A 176 27.569 9.982 1.173 1.00 22.55 O ATOM 1394 OD2 ASP A 176 26.260 11.305 0.029 1.00 27.39 O ATOM 0 H ASP A 176 28.329 7.967 -2.789 1.00 10.93 H new ATOM 0 HA ASP A 176 29.393 9.969 -1.214 1.00 11.81 H new ATOM 0 HB2 ASP A 176 27.097 10.103 -1.933 1.00 16.50 H new ATOM 0 HB3 ASP A 176 26.812 8.766 -1.183 1.00 16.50 H new ATOM 1395 N PRO A 177 30.356 8.532 0.531 1.00 13.52 N ATOM 1396 CA PRO A 177 30.803 7.599 1.564 1.00 14.70 C ATOM 1397 C PRO A 177 29.805 7.230 2.651 1.00 15.15 C ATOM 1398 O PRO A 177 29.802 6.100 3.118 1.00 13.49 O ATOM 1399 CB PRO A 177 32.068 8.273 2.130 1.00 17.63 C ATOM 1400 CG PRO A 177 32.573 9.112 0.909 1.00 17.28 C ATOM 1401 CD PRO A 177 31.304 9.651 0.334 1.00 14.65 C ATOM 0 HA PRO A 177 30.951 6.725 1.170 1.00 14.70 H new ATOM 0 HB2 PRO A 177 31.868 8.833 2.896 1.00 17.63 H new ATOM 0 HB3 PRO A 177 32.726 7.622 2.419 1.00 17.63 H new ATOM 0 HG2 PRO A 177 33.174 9.822 1.184 1.00 17.28 H new ATOM 0 HG3 PRO A 177 33.054 8.564 0.269 1.00 17.28 H new ATOM 0 HD2 PRO A 177 31.013 10.455 0.793 1.00 14.65 H new ATOM 0 HD3 PRO A 177 31.402 9.880 -0.604 1.00 14.65 H new ATOM 1402 N SER A 178 28.986 8.181 3.085 1.00 16.42 N ATOM 1403 CA SER A 178 28.026 7.871 4.147 1.00 18.04 C ATOM 1404 C SER A 178 26.931 6.911 3.674 1.00 15.89 C ATOM 1405 O SER A 178 26.453 6.091 4.438 1.00 14.35 O ATOM 1406 CB SER A 178 27.395 9.147 4.715 1.00 21.17 C ATOM 1407 OG SER A 178 26.674 9.790 3.693 1.00 26.38 O ATOM 0 H SER A 178 28.966 8.989 2.791 1.00 16.42 H new ATOM 0 HA SER A 178 28.526 7.428 4.851 1.00 18.04 H new ATOM 0 HB2 SER A 178 26.807 8.930 5.455 1.00 21.17 H new ATOM 0 HB3 SER A 178 28.083 9.736 5.062 1.00 21.17 H new ATOM 0 HG SER A 178 27.069 9.681 2.960 1.00 26.38 H new ATOM 1408 N ILE A 179 26.564 6.980 2.399 1.00 14.23 N ATOM 1409 CA ILE A 179 25.569 6.082 1.874 1.00 13.61 C ATOM 1410 C ILE A 179 26.176 4.708 1.720 1.00 14.64 C ATOM 1411 O ILE A 179 25.539 3.697 2.057 1.00 12.02 O ATOM 1412 CB ILE A 179 25.000 6.574 0.522 1.00 15.42 C ATOM 1413 CG1 ILE A 179 24.185 7.871 0.748 1.00 14.59 C ATOM 1414 CG2 ILE A 179 24.103 5.497 -0.079 1.00 15.24 C ATOM 1415 CD1 ILE A 179 23.741 8.606 -0.590 1.00 15.04 C ATOM 0 H ILE A 179 26.883 7.541 1.830 1.00 14.23 H new ATOM 0 HA ILE A 179 24.828 6.049 2.499 1.00 13.61 H new ATOM 0 HB ILE A 179 25.730 6.756 -0.090 1.00 15.42 H new ATOM 0 HG12 ILE A 179 23.393 7.657 1.265 1.00 14.59 H new ATOM 0 HG13 ILE A 179 24.714 8.484 1.281 1.00 14.59 H new ATOM 0 HG21 ILE A 179 23.747 5.808 -0.926 1.00 15.24 H new ATOM 0 HG22 ILE A 179 24.619 4.688 -0.222 1.00 15.24 H new ATOM 0 HG23 ILE A 179 23.371 5.309 0.529 1.00 15.24 H new ATOM 0 HD11 ILE A 179 23.238 9.405 -0.369 1.00 15.04 H new ATOM 0 HD12 ILE A 179 24.528 8.851 -1.101 1.00 15.04 H new ATOM 0 HD13 ILE A 179 23.186 8.011 -1.118 1.00 15.04 H new ATOM 1416 N VAL A 180 27.410 4.650 1.202 1.00 12.71 N ATOM 1417 CA VAL A 180 28.085 3.390 1.048 1.00 13.27 C ATOM 1418 C VAL A 180 28.177 2.726 2.411 1.00 14.08 C ATOM 1419 O VAL A 180 27.880 1.537 2.523 1.00 14.30 O ATOM 1420 CB VAL A 180 29.539 3.562 0.493 1.00 13.01 C ATOM 1421 CG1 VAL A 180 30.357 2.228 0.727 1.00 13.92 C ATOM 1422 CG2 VAL A 180 29.477 3.895 -1.039 1.00 12.78 C ATOM 0 H VAL A 180 27.859 5.335 0.939 1.00 12.71 H new ATOM 0 HA VAL A 180 27.579 2.856 0.416 1.00 13.27 H new ATOM 0 HB VAL A 180 29.982 4.289 0.958 1.00 13.01 H new ATOM 0 HG11 VAL A 180 31.257 2.336 0.383 1.00 13.92 H new ATOM 0 HG12 VAL A 180 30.395 2.034 1.677 1.00 13.92 H new ATOM 0 HG13 VAL A 180 29.920 1.495 0.265 1.00 13.92 H new ATOM 0 HG21 VAL A 180 30.377 4.002 -1.384 1.00 12.78 H new ATOM 0 HG22 VAL A 180 29.035 3.172 -1.510 1.00 12.78 H new ATOM 0 HG23 VAL A 180 28.981 4.718 -1.172 1.00 12.78 H new ATOM 1423 N GLN A 181 28.546 3.480 3.449 1.00 11.96 N ATOM 1424 CA GLN A 181 28.669 2.863 4.760 1.00 14.52 C ATOM 1425 C GLN A 181 27.339 2.311 5.274 1.00 15.85 C ATOM 1426 O GLN A 181 27.279 1.187 5.788 1.00 17.90 O ATOM 1427 CB GLN A 181 29.220 3.868 5.760 1.00 15.76 C ATOM 1428 CG GLN A 181 29.681 3.221 7.052 1.00 22.25 C ATOM 1429 CD GLN A 181 28.544 3.091 8.052 1.00 28.96 C ATOM 1430 OE1 GLN A 181 28.702 2.499 9.145 1.00 33.90 O ATOM 1431 NE2 GLN A 181 27.389 3.661 7.703 1.00 30.13 N ATOM 0 H GLN A 181 28.723 4.321 3.415 1.00 11.96 H new ATOM 0 HA GLN A 181 29.280 2.116 4.665 1.00 14.52 H new ATOM 0 HB2 GLN A 181 29.964 4.343 5.358 1.00 15.76 H new ATOM 0 HB3 GLN A 181 28.537 4.527 5.959 1.00 15.76 H new ATOM 0 HG2 GLN A 181 30.047 2.343 6.862 1.00 22.25 H new ATOM 0 HG3 GLN A 181 30.396 3.748 7.441 1.00 22.25 H new ATOM 0 HE21 GLN A 181 27.318 4.059 6.944 1.00 30.13 H new ATOM 0 HE22 GLN A 181 26.716 3.631 8.237 1.00 30.13 H new ATOM 1432 N ALA A 182 26.275 3.073 5.086 1.00 15.53 N ATOM 1433 CA ALA A 182 24.979 2.657 5.586 1.00 16.60 C ATOM 1434 C ALA A 182 24.417 1.426 4.916 1.00 17.07 C ATOM 1435 O ALA A 182 23.622 0.711 5.523 1.00 17.81 O ATOM 1436 CB ALA A 182 23.982 3.799 5.479 1.00 18.81 C ATOM 0 H ALA A 182 26.281 3.828 4.675 1.00 15.53 H new ATOM 0 HA ALA A 182 25.124 2.416 6.514 1.00 16.60 H new ATOM 0 HB1 ALA A 182 23.120 3.509 5.816 1.00 18.81 H new ATOM 0 HB2 ALA A 182 24.296 4.553 6.002 1.00 18.81 H new ATOM 0 HB3 ALA A 182 23.893 4.065 4.550 1.00 18.81 H new ATOM 1437 N LEU A 183 24.792 1.175 3.670 1.00 15.33 N ATOM 1438 CA LEU A 183 24.252 0.018 2.964 1.00 17.56 C ATOM 1439 C LEU A 183 25.220 -1.158 2.940 1.00 16.93 C ATOM 1440 O LEU A 183 24.950 -2.181 2.304 1.00 17.19 O ATOM 1441 CB LEU A 183 23.908 0.373 1.522 1.00 19.92 C ATOM 1442 CG LEU A 183 22.800 1.395 1.388 1.00 22.96 C ATOM 1443 CD1 LEU A 183 22.445 1.522 -0.058 1.00 23.98 C ATOM 1444 CD2 LEU A 183 21.583 0.985 2.194 1.00 25.52 C ATOM 0 H LEU A 183 25.348 1.652 3.220 1.00 15.33 H new ATOM 0 HA LEU A 183 23.455 -0.241 3.452 1.00 17.56 H new ATOM 0 HB2 LEU A 183 24.704 0.713 1.084 1.00 19.92 H new ATOM 0 HB3 LEU A 183 23.649 -0.435 1.053 1.00 19.92 H new ATOM 0 HG LEU A 183 23.106 2.249 1.733 1.00 22.96 H new ATOM 0 HD11 LEU A 183 21.735 2.175 -0.161 1.00 23.98 H new ATOM 0 HD12 LEU A 183 23.224 1.811 -0.559 1.00 23.98 H new ATOM 0 HD13 LEU A 183 22.145 0.663 -0.394 1.00 23.98 H new ATOM 0 HD21 LEU A 183 20.888 1.654 2.093 1.00 25.52 H new ATOM 0 HD22 LEU A 183 21.257 0.129 1.875 1.00 25.52 H new ATOM 0 HD23 LEU A 183 21.825 0.910 3.130 1.00 25.52 H new ATOM 1445 N SER A 184 26.339 -1.013 3.635 1.00 14.44 N ATOM 1446 CA SER A 184 27.307 -2.074 3.614 1.00 14.61 C ATOM 1447 C SER A 184 27.341 -2.921 4.893 1.00 16.10 C ATOM 1448 O SER A 184 28.317 -3.575 5.156 1.00 18.36 O ATOM 1449 CB SER A 184 28.682 -1.463 3.274 1.00 14.29 C ATOM 1450 OG ASER A 184 29.478 -1.183 4.420 0.50 18.06 O ATOM 1451 OG BSER A 184 28.655 -0.931 1.966 0.50 4.42 O ATOM 0 H SER A 184 26.546 -0.326 4.110 1.00 14.44 H new ATOM 0 HA SER A 184 27.046 -2.710 2.929 1.00 14.61 H new ATOM 0 HB2ASER A 184 29.165 -2.073 2.695 0.50 14.29 H new ATOM 0 HB2BSER A 184 28.903 -0.766 3.912 0.50 14.29 H new ATOM 0 HB3ASER A 184 28.549 -0.643 2.773 0.50 14.29 H new ATOM 0 HB3BSER A 184 29.373 -2.140 3.343 0.50 14.29 H new ATOM 0 HG ASER A 184 30.212 -0.855 4.178 0.50 4.42 H new ATOM 0 HG BSER A 184 28.469 -0.113 2.000 0.50 4.42 H new ATOM 1452 N LEU A 185 26.269 -2.904 5.687 1.00 14.73 N ATOM 1453 CA LEU A 185 26.249 -3.690 6.931 1.00 15.09 C ATOM 1454 C LEU A 185 25.697 -5.087 6.724 1.00 15.21 C ATOM 1455 O LEU A 185 24.929 -5.334 5.793 1.00 13.70 O ATOM 1456 CB LEU A 185 25.401 -2.985 7.994 1.00 16.58 C ATOM 1457 CG LEU A 185 25.679 -1.473 8.093 1.00 18.94 C ATOM 1458 CD1 LEU A 185 24.659 -0.833 9.022 1.00 18.82 C ATOM 1459 CD2 LEU A 185 27.102 -1.249 8.583 1.00 18.62 C ATOM 0 H LEU A 185 25.553 -2.454 5.531 1.00 14.73 H new ATOM 0 HA LEU A 185 27.171 -3.764 7.224 1.00 15.09 H new ATOM 0 HB2 LEU A 185 24.462 -3.122 7.793 1.00 16.58 H new ATOM 0 HB3 LEU A 185 25.569 -3.395 8.857 1.00 16.58 H new ATOM 0 HG LEU A 185 25.595 -1.058 7.220 1.00 18.94 H new ATOM 0 HD11 LEU A 185 24.832 0.119 9.086 1.00 18.82 H new ATOM 0 HD12 LEU A 185 23.766 -0.976 8.671 1.00 18.82 H new ATOM 0 HD13 LEU A 185 24.727 -1.233 9.903 1.00 18.82 H new ATOM 0 HD21 LEU A 185 27.277 -0.297 8.645 1.00 18.62 H new ATOM 0 HD22 LEU A 185 27.211 -1.655 9.457 1.00 18.62 H new ATOM 0 HD23 LEU A 185 27.726 -1.652 7.959 1.00 18.62 H new ATOM 1460 N TYR A 186 26.140 -5.984 7.596 1.00 14.92 N ATOM 1461 CA TYR A 186 25.692 -7.364 7.673 1.00 14.81 C ATOM 1462 C TYR A 186 25.349 -7.561 9.174 1.00 15.45 C ATOM 1463 O TYR A 186 26.214 -7.422 10.067 1.00 15.29 O ATOM 1464 CB TYR A 186 26.776 -8.319 7.222 1.00 12.10 C ATOM 1465 CG TYR A 186 26.311 -9.749 7.168 1.00 9.78 C ATOM 1466 CD1 TYR A 186 25.999 -10.360 5.964 1.00 11.29 C ATOM 1467 CD2 TYR A 186 26.232 -10.508 8.341 1.00 10.15 C ATOM 1468 CE1 TYR A 186 25.634 -11.717 5.916 1.00 12.92 C ATOM 1469 CE2 TYR A 186 25.851 -11.862 8.316 1.00 12.43 C ATOM 1470 CZ TYR A 186 25.560 -12.461 7.110 1.00 14.35 C ATOM 1471 OH TYR A 186 25.184 -13.793 7.081 1.00 19.29 O ATOM 0 H TYR A 186 26.737 -5.794 8.185 1.00 14.92 H new ATOM 0 HA TYR A 186 24.936 -7.545 7.093 1.00 14.81 H new ATOM 0 HB2 TYR A 186 27.091 -8.053 6.344 1.00 12.10 H new ATOM 0 HB3 TYR A 186 27.532 -8.252 7.826 1.00 12.10 H new ATOM 0 HD1 TYR A 186 26.031 -9.866 5.177 1.00 11.29 H new ATOM 0 HD2 TYR A 186 26.436 -10.108 9.156 1.00 10.15 H new ATOM 0 HE1 TYR A 186 25.443 -12.121 5.101 1.00 12.92 H new ATOM 0 HE2 TYR A 186 25.796 -12.348 9.107 1.00 12.43 H new ATOM 0 HH TYR A 186 25.475 -14.151 6.379 1.00 19.29 H new ATOM 1472 N ASP A 187 24.078 -7.834 9.424 1.00 17.12 N ATOM 1473 CA ASP A 187 23.518 -7.946 10.776 1.00 17.99 C ATOM 1474 C ASP A 187 23.931 -6.732 11.602 1.00 20.92 C ATOM 1475 O ASP A 187 24.395 -6.850 12.745 1.00 22.08 O ATOM 1476 CB ASP A 187 23.954 -9.232 11.467 1.00 17.64 C ATOM 1477 CG ASP A 187 23.258 -10.470 10.880 1.00 16.66 C ATOM 1478 OD1 ASP A 187 22.487 -10.335 9.886 1.00 16.55 O ATOM 1479 OD2 ASP A 187 23.517 -11.571 11.401 1.00 16.38 O ATOM 0 H ASP A 187 23.498 -7.964 8.802 1.00 17.12 H new ATOM 0 HA ASP A 187 22.551 -7.975 10.700 1.00 17.99 H new ATOM 0 HB2 ASP A 187 24.915 -9.333 11.383 1.00 17.64 H new ATOM 0 HB3 ASP A 187 23.757 -9.171 12.415 1.00 17.64 H new ATOM 1480 N GLY A 188 23.786 -5.566 10.997 1.00 20.66 N ATOM 1481 CA GLY A 188 24.088 -4.320 11.673 1.00 22.54 C ATOM 1482 C GLY A 188 25.523 -3.879 11.871 1.00 23.59 C ATOM 1483 O GLY A 188 25.733 -2.856 12.504 1.00 26.46 O ATOM 0 H GLY A 188 23.511 -5.475 10.187 1.00 20.66 H new ATOM 0 HA2 GLY A 188 23.636 -3.613 11.185 1.00 22.54 H new ATOM 0 HA3 GLY A 188 23.679 -4.365 12.551 1.00 22.54 H new ATOM 1484 N LEU A 189 26.483 -4.590 11.302 1.00 23.87 N ATOM 1485 CA LEU A 189 27.903 -4.283 11.466 1.00 28.06 C ATOM 1486 C LEU A 189 28.627 -4.373 10.141 1.00 29.42 C ATOM 1487 O LEU A 189 28.204 -5.082 9.250 1.00 27.78 O ATOM 1488 CB LEU A 189 28.545 -5.313 12.440 1.00 28.20 C ATOM 1489 CG LEU A 189 27.962 -5.288 13.868 1.00 30.44 C ATOM 1490 CD1 LEU A 189 28.389 -6.542 14.693 1.00 30.49 C ATOM 1491 CD2 LEU A 189 28.411 -3.999 14.544 1.00 30.19 C ATOM 0 H LEU A 189 26.331 -5.274 10.803 1.00 23.87 H new ATOM 0 HA LEU A 189 27.980 -3.382 11.817 1.00 28.06 H new ATOM 0 HB2 LEU A 189 28.433 -6.203 12.072 1.00 28.20 H new ATOM 0 HB3 LEU A 189 29.499 -5.145 12.489 1.00 28.20 H new ATOM 0 HG LEU A 189 26.994 -5.315 13.820 1.00 30.44 H new ATOM 0 HD11 LEU A 189 28.005 -6.491 15.582 1.00 30.49 H new ATOM 0 HD12 LEU A 189 28.072 -7.344 14.250 1.00 30.49 H new ATOM 0 HD13 LEU A 189 29.356 -6.571 14.761 1.00 30.49 H new ATOM 0 HD21 LEU A 189 28.054 -3.965 15.445 1.00 30.19 H new ATOM 0 HD22 LEU A 189 29.380 -3.973 14.580 1.00 30.19 H new ATOM 0 HD23 LEU A 189 28.086 -3.238 14.038 1.00 30.19 H new ATOM 1492 N VAL A 190 29.748 -3.680 10.007 1.00 34.33 N ATOM 1493 CA VAL A 190 30.496 -3.793 8.762 1.00 38.77 C ATOM 1494 C VAL A 190 30.828 -5.311 8.500 1.00 41.03 C ATOM 1495 O VAL A 190 30.119 -6.222 9.017 1.00 43.07 O ATOM 1496 CB VAL A 190 31.780 -2.920 8.844 1.00 41.11 C ATOM 1497 CG1 VAL A 190 32.524 -2.908 7.495 1.00 41.22 C ATOM 1498 CG2 VAL A 190 31.385 -1.471 9.252 1.00 42.91 C ATOM 1499 OXT VAL A 190 31.772 -5.617 7.750 1.00 42.26 O ATOM 0 H VAL A 190 30.085 -3.156 10.600 1.00 34.33 H new ATOM 0 HA VAL A 190 29.969 -3.466 8.016 1.00 38.77 H new ATOM 0 HB VAL A 190 32.376 -3.297 9.510 1.00 41.11 H new ATOM 0 HG11 VAL A 190 33.320 -2.359 7.569 1.00 41.22 H new ATOM 0 HG12 VAL A 190 32.778 -3.814 7.257 1.00 41.22 H new ATOM 0 HG13 VAL A 190 31.943 -2.544 6.808 1.00 41.22 H new ATOM 0 HG21 VAL A 190 32.182 -0.921 9.305 1.00 42.91 H new ATOM 0 HG22 VAL A 190 30.781 -1.101 8.589 1.00 42.91 H new ATOM 0 HG23 VAL A 190 30.945 -1.487 10.117 1.00 42.91 H new TER 1500 VAL A 190 ATOM 1501 N LYS B 3 38.413 -5.370 9.974 1.00 48.20 N ATOM 1502 CA LYS B 3 39.732 -4.762 10.331 1.00 49.16 C ATOM 1503 C LYS B 3 39.593 -3.391 11.010 1.00 49.22 C ATOM 1504 O LYS B 3 38.854 -2.517 10.533 1.00 51.16 O ATOM 1505 CB LYS B 3 40.598 -4.643 9.081 1.00 49.71 C ATOM 0 HA LYS B 3 40.155 -5.351 10.975 1.00 49.16 H new ATOM 1506 N SER B 4 40.313 -3.208 12.115 1.00 48.16 N ATOM 1507 CA SER B 4 40.293 -1.962 12.898 1.00 45.90 C ATOM 1508 C SER B 4 39.110 -1.891 13.862 1.00 44.31 C ATOM 1509 O SER B 4 39.098 -1.060 14.791 1.00 43.99 O ATOM 1510 CB SER B 4 40.290 -0.727 11.992 1.00 46.93 C ATOM 1511 OG SER B 4 40.272 0.462 12.777 1.00 47.52 O ATOM 0 H SER B 4 40.835 -3.809 12.439 1.00 48.16 H new ATOM 0 HA SER B 4 41.108 -1.969 13.424 1.00 45.90 H new ATOM 0 HB2 SER B 4 41.075 -0.734 11.422 1.00 46.93 H new ATOM 0 HB3 SER B 4 39.516 -0.748 11.408 1.00 46.93 H new ATOM 0 HG SER B 4 40.022 0.279 13.558 1.00 47.52 H new ATOM 1512 N ASN B 5 38.105 -2.746 13.642 1.00 41.89 N ATOM 1513 CA ASN B 5 36.955 -2.787 14.532 1.00 39.12 C ATOM 1514 C ASN B 5 36.634 -4.212 15.037 1.00 37.65 C ATOM 1515 O ASN B 5 35.538 -4.478 15.528 1.00 34.25 O ATOM 1516 CB ASN B 5 35.709 -2.149 13.878 1.00 40.19 C ATOM 1517 CG ASN B 5 35.321 -2.795 12.547 1.00 41.25 C ATOM 1518 OD1 ASN B 5 35.236 -4.018 12.424 1.00 40.38 O ATOM 1519 ND2 ASN B 5 35.052 -1.953 11.545 1.00 42.34 N ATOM 0 H ASN B 5 38.075 -3.303 12.988 1.00 41.89 H new ATOM 0 HA ASN B 5 37.200 -2.260 15.308 1.00 39.12 H new ATOM 0 HB2 ASN B 5 34.961 -2.215 14.492 1.00 40.19 H new ATOM 0 HB3 ASN B 5 35.876 -1.204 13.734 1.00 40.19 H new ATOM 0 HD21 ASN B 5 34.809 -2.260 10.779 1.00 42.34 H new ATOM 0 HD22 ASN B 5 35.122 -1.104 11.666 1.00 42.34 H new ATOM 1520 N SER B 6 37.606 -5.115 14.949 1.00 36.20 N ATOM 1521 CA SER B 6 37.376 -6.473 15.415 1.00 37.67 C ATOM 1522 C SER B 6 37.753 -6.675 16.904 1.00 36.67 C ATOM 1523 O SER B 6 38.314 -5.783 17.547 1.00 34.86 O ATOM 1524 CB SER B 6 38.143 -7.471 14.523 1.00 38.49 C ATOM 1525 OG SER B 6 38.087 -8.798 15.077 1.00 40.78 O ATOM 0 H SER B 6 38.390 -4.964 14.629 1.00 36.20 H new ATOM 0 HA SER B 6 36.423 -6.639 15.349 1.00 37.67 H new ATOM 0 HB2 SER B 6 37.763 -7.472 13.631 1.00 38.49 H new ATOM 0 HB3 SER B 6 39.068 -7.190 14.437 1.00 38.49 H new ATOM 0 HG SER B 6 38.508 -9.328 14.579 1.00 40.78 H new ATOM 1526 N LYS B 7 37.418 -7.845 17.434 1.00 36.63 N ATOM 1527 CA LYS B 7 37.737 -8.245 18.826 1.00 37.78 C ATOM 1528 C LYS B 7 39.268 -8.090 18.963 1.00 37.88 C ATOM 1529 O LYS B 7 40.012 -8.516 18.070 1.00 37.17 O ATOM 1530 CB LYS B 7 37.331 -9.730 19.013 1.00 37.87 C ATOM 1531 CG LYS B 7 37.651 -10.389 20.337 1.00 39.50 C ATOM 1532 CD LYS B 7 37.693 -11.923 20.147 1.00 40.47 C ATOM 1533 CE LYS B 7 37.913 -12.647 21.465 1.00 42.50 C ATOM 1534 NZ LYS B 7 38.253 -14.091 21.229 1.00 44.31 N ATOM 0 H LYS B 7 36.990 -8.449 16.996 1.00 36.63 H new ATOM 0 HA LYS B 7 37.270 -7.712 19.488 1.00 37.78 H new ATOM 0 HB2 LYS B 7 36.374 -9.797 18.871 1.00 37.87 H new ATOM 0 HB3 LYS B 7 37.759 -10.246 18.312 1.00 37.87 H new ATOM 0 HG2 LYS B 7 38.504 -10.070 20.671 1.00 39.50 H new ATOM 0 HG3 LYS B 7 36.982 -10.153 20.998 1.00 39.50 H new ATOM 0 HD2 LYS B 7 36.861 -12.223 19.748 1.00 40.47 H new ATOM 0 HD3 LYS B 7 38.404 -12.153 19.528 1.00 40.47 H new ATOM 0 HE2 LYS B 7 38.629 -12.218 21.959 1.00 42.50 H new ATOM 0 HE3 LYS B 7 37.114 -12.583 22.011 1.00 42.50 H new ATOM 0 HZ1 LYS B 7 38.378 -14.498 22.010 1.00 44.31 H new ATOM 0 HZ2 LYS B 7 37.585 -14.486 20.793 1.00 44.31 H new ATOM 0 HZ3 LYS B 7 38.997 -14.146 20.744 1.00 44.31 H new ATOM 1535 N LEU B 8 39.734 -7.488 20.063 1.00 36.93 N ATOM 1536 CA LEU B 8 41.167 -7.291 20.256 1.00 37.46 C ATOM 1537 C LEU B 8 41.865 -8.641 20.426 1.00 38.66 C ATOM 1538 O LEU B 8 41.451 -9.473 21.244 1.00 38.00 O ATOM 1539 CB LEU B 8 41.430 -6.418 21.498 1.00 35.40 C ATOM 1540 CG LEU B 8 40.644 -5.111 21.694 1.00 35.06 C ATOM 1541 CD1 LEU B 8 41.091 -4.493 23.032 1.00 34.09 C ATOM 1542 CD2 LEU B 8 40.896 -4.123 20.552 1.00 33.61 C ATOM 0 H LEU B 8 39.239 -7.191 20.701 1.00 36.93 H new ATOM 0 HA LEU B 8 41.521 -6.841 19.473 1.00 37.46 H new ATOM 0 HB2 LEU B 8 41.271 -6.971 22.279 1.00 35.40 H new ATOM 0 HB3 LEU B 8 42.373 -6.191 21.498 1.00 35.40 H new ATOM 0 HG LEU B 8 39.694 -5.304 21.699 1.00 35.06 H new ATOM 0 HD11 LEU B 8 40.610 -3.664 23.183 1.00 34.09 H new ATOM 0 HD12 LEU B 8 40.901 -5.112 23.754 1.00 34.09 H new ATOM 0 HD13 LEU B 8 42.044 -4.313 23.003 1.00 34.09 H new ATOM 0 HD21 LEU B 8 40.387 -3.312 20.707 1.00 33.61 H new ATOM 0 HD22 LEU B 8 41.841 -3.908 20.513 1.00 33.61 H new ATOM 0 HD23 LEU B 8 40.620 -4.522 19.712 1.00 33.61 H new ATOM 1543 N LYS B 9 42.922 -8.859 19.656 1.00 39.28 N ATOM 1544 CA LYS B 9 43.655 -10.116 19.761 1.00 40.02 C ATOM 1545 C LYS B 9 44.321 -10.187 21.131 1.00 39.64 C ATOM 1546 O LYS B 9 44.723 -9.165 21.693 1.00 38.90 O ATOM 1547 CB LYS B 9 44.711 -10.233 18.651 1.00 42.73 C ATOM 1548 CG LYS B 9 45.170 -11.683 18.435 1.00 46.70 C ATOM 1549 CD LYS B 9 45.888 -11.884 17.107 1.00 49.06 C ATOM 1550 CE LYS B 9 46.269 -13.362 16.903 1.00 50.41 C ATOM 1551 NZ LYS B 9 45.093 -14.265 16.612 1.00 51.76 N ATOM 0 H LYS B 9 43.229 -8.304 19.075 1.00 39.28 H new ATOM 0 HA LYS B 9 43.034 -10.854 19.657 1.00 40.02 H new ATOM 0 HB2 LYS B 9 44.347 -9.884 17.822 1.00 42.73 H new ATOM 0 HB3 LYS B 9 45.478 -9.683 18.877 1.00 42.73 H new ATOM 0 HG2 LYS B 9 45.761 -11.942 19.160 1.00 46.70 H new ATOM 0 HG3 LYS B 9 44.399 -12.271 18.473 1.00 46.70 H new ATOM 0 HD2 LYS B 9 45.318 -11.590 16.380 1.00 49.06 H new ATOM 0 HD3 LYS B 9 46.687 -11.334 17.081 1.00 49.06 H new ATOM 0 HE2 LYS B 9 46.902 -13.425 16.171 1.00 50.41 H new ATOM 0 HE3 LYS B 9 46.722 -13.682 17.699 1.00 50.41 H new ATOM 0 HZ1 LYS B 9 45.380 -15.101 16.505 1.00 51.76 H new ATOM 0 HZ2 LYS B 9 44.519 -14.233 17.291 1.00 51.76 H new ATOM 0 HZ3 LYS B 9 44.687 -13.994 15.868 1.00 51.76 H new ATOM 1552 N PRO B 10 44.429 -11.389 21.698 1.00 38.72 N ATOM 1553 CA PRO B 10 45.057 -11.481 23.008 1.00 39.64 C ATOM 1554 C PRO B 10 46.373 -10.739 23.178 1.00 39.37 C ATOM 1555 O PRO B 10 46.558 -10.082 24.202 1.00 38.76 O ATOM 1556 CB PRO B 10 45.196 -13.000 23.243 1.00 40.68 C ATOM 1557 CG PRO B 10 44.894 -13.649 21.874 1.00 40.91 C ATOM 1558 CD PRO B 10 43.892 -12.694 21.274 1.00 40.44 C ATOM 0 HA PRO B 10 44.511 -11.030 23.671 1.00 39.64 H new ATOM 0 HB2 PRO B 10 46.088 -13.227 23.550 1.00 40.68 H new ATOM 0 HB3 PRO B 10 44.575 -13.308 23.922 1.00 40.68 H new ATOM 0 HG2 PRO B 10 45.691 -13.726 21.327 1.00 40.91 H new ATOM 0 HG3 PRO B 10 44.529 -14.542 21.971 1.00 40.91 H new ATOM 0 HD2 PRO B 10 43.847 -12.773 20.308 1.00 40.44 H new ATOM 0 HD3 PRO B 10 42.996 -12.846 21.613 1.00 40.44 H new ATOM 1559 N GLU B 11 47.271 -10.823 22.191 1.00 38.62 N ATOM 1560 CA GLU B 11 48.585 -10.163 22.291 1.00 39.53 C ATOM 1561 C GLU B 11 48.439 -8.636 22.243 1.00 38.87 C ATOM 1562 O GLU B 11 49.359 -7.897 22.624 1.00 36.86 O ATOM 1563 CB GLU B 11 49.533 -10.629 21.167 1.00 41.52 C ATOM 1564 CG GLU B 11 49.141 -10.170 19.768 1.00 44.28 C ATOM 1565 CD GLU B 11 48.460 -11.265 18.944 1.00 47.33 C ATOM 1566 OE1 GLU B 11 47.591 -11.981 19.502 1.00 47.73 O ATOM 1567 OE2 GLU B 11 48.787 -11.397 17.735 1.00 46.71 O ATOM 0 H GLU B 11 47.143 -11.254 21.458 1.00 38.62 H new ATOM 0 HA GLU B 11 48.969 -10.416 23.145 1.00 39.53 H new ATOM 0 HB2 GLU B 11 50.427 -10.306 21.361 1.00 41.52 H new ATOM 0 HB3 GLU B 11 49.573 -11.598 21.176 1.00 41.52 H new ATOM 0 HG2 GLU B 11 48.545 -9.408 19.839 1.00 44.28 H new ATOM 0 HG3 GLU B 11 49.934 -9.866 19.299 1.00 44.28 H new ATOM 1568 N VAL B 12 47.273 -8.203 21.768 1.00 35.85 N ATOM 1569 CA VAL B 12 46.906 -6.803 21.658 1.00 37.11 C ATOM 1570 C VAL B 12 46.280 -6.372 22.988 1.00 36.20 C ATOM 1571 O VAL B 12 46.585 -5.300 23.474 1.00 35.92 O ATOM 1572 CB VAL B 12 45.885 -6.558 20.488 1.00 37.06 C ATOM 1573 CG1 VAL B 12 45.051 -5.268 20.733 1.00 37.09 C ATOM 1574 CG2 VAL B 12 46.664 -6.436 19.157 1.00 37.63 C ATOM 0 H VAL B 12 46.657 -8.737 21.493 1.00 35.85 H new ATOM 0 HA VAL B 12 47.701 -6.283 21.461 1.00 37.11 H new ATOM 0 HB VAL B 12 45.271 -7.307 20.447 1.00 37.06 H new ATOM 0 HG11 VAL B 12 44.430 -5.140 19.999 1.00 37.09 H new ATOM 0 HG12 VAL B 12 44.556 -5.355 21.563 1.00 37.09 H new ATOM 0 HG13 VAL B 12 45.646 -4.504 20.790 1.00 37.09 H new ATOM 0 HG21 VAL B 12 46.040 -6.285 18.430 1.00 37.63 H new ATOM 0 HG22 VAL B 12 47.284 -5.692 19.211 1.00 37.63 H new ATOM 0 HG23 VAL B 12 47.157 -7.255 18.994 1.00 37.63 H new ATOM 1575 N VAL B 13 45.412 -7.192 23.574 1.00 35.75 N ATOM 1576 CA VAL B 13 44.827 -6.817 24.865 1.00 35.51 C ATOM 1577 C VAL B 13 45.952 -6.802 25.877 1.00 35.38 C ATOM 1578 O VAL B 13 45.993 -5.956 26.778 1.00 34.06 O ATOM 1579 CB VAL B 13 43.729 -7.822 25.340 1.00 36.87 C ATOM 1580 CG1 VAL B 13 43.666 -7.866 26.869 1.00 36.69 C ATOM 1581 CG2 VAL B 13 42.388 -7.393 24.827 1.00 35.66 C ATOM 0 H VAL B 13 45.153 -7.948 23.256 1.00 35.75 H new ATOM 0 HA VAL B 13 44.399 -5.951 24.775 1.00 35.51 H new ATOM 0 HB VAL B 13 43.956 -8.700 24.996 1.00 36.87 H new ATOM 0 HG11 VAL B 13 42.981 -8.494 27.147 1.00 36.69 H new ATOM 0 HG12 VAL B 13 44.525 -8.149 27.220 1.00 36.69 H new ATOM 0 HG13 VAL B 13 43.453 -6.983 27.210 1.00 36.69 H new ATOM 0 HG21 VAL B 13 41.711 -8.021 25.125 1.00 35.66 H new ATOM 0 HG22 VAL B 13 42.180 -6.508 25.166 1.00 35.66 H new ATOM 0 HG23 VAL B 13 42.404 -7.372 23.857 1.00 35.66 H new ATOM 1582 N GLU B 14 46.866 -7.752 25.732 1.00 34.81 N ATOM 1583 CA GLU B 14 47.992 -7.854 26.636 1.00 35.98 C ATOM 1584 C GLU B 14 48.921 -6.669 26.435 1.00 34.04 C ATOM 1585 O GLU B 14 49.494 -6.153 27.392 1.00 32.30 O ATOM 1586 CB GLU B 14 48.751 -9.165 26.387 1.00 38.39 C ATOM 1587 CG GLU B 14 49.901 -9.465 27.376 1.00 41.89 C ATOM 1588 CD GLU B 14 51.158 -8.625 27.159 1.00 43.59 C ATOM 1589 OE1 GLU B 14 51.457 -8.257 25.992 1.00 46.11 O ATOM 1590 OE2 GLU B 14 51.865 -8.341 28.163 1.00 46.26 O ATOM 0 H GLU B 14 46.849 -8.348 25.112 1.00 34.81 H new ATOM 0 HA GLU B 14 47.666 -7.851 27.550 1.00 35.98 H new ATOM 0 HB2 GLU B 14 48.117 -9.899 26.420 1.00 38.39 H new ATOM 0 HB3 GLU B 14 49.115 -9.144 25.488 1.00 38.39 H new ATOM 0 HG2 GLU B 14 49.581 -9.320 28.280 1.00 41.89 H new ATOM 0 HG3 GLU B 14 50.137 -10.403 27.305 1.00 41.89 H new ATOM 1591 N GLU B 15 49.084 -6.240 25.185 1.00 33.08 N ATOM 1592 CA GLU B 15 49.979 -5.115 24.928 1.00 32.53 C ATOM 1593 C GLU B 15 49.363 -3.806 25.444 1.00 28.30 C ATOM 1594 O GLU B 15 50.052 -3.041 26.104 1.00 28.97 O ATOM 1595 CB GLU B 15 50.291 -5.005 23.421 1.00 35.91 C ATOM 1596 CG GLU B 15 51.337 -3.947 23.080 1.00 40.48 C ATOM 1597 CD GLU B 15 51.322 -3.541 21.591 1.00 44.02 C ATOM 1598 OE1 GLU B 15 51.780 -4.337 20.731 1.00 46.00 O ATOM 1599 OE2 GLU B 15 50.840 -2.426 21.284 1.00 45.06 O ATOM 0 H GLU B 15 48.699 -6.574 24.492 1.00 33.08 H new ATOM 0 HA GLU B 15 50.810 -5.272 25.404 1.00 32.53 H new ATOM 0 HB2 GLU B 15 50.599 -5.867 23.100 1.00 35.91 H new ATOM 0 HB3 GLU B 15 49.471 -4.802 22.944 1.00 35.91 H new ATOM 0 HG2 GLU B 15 51.184 -3.160 23.626 1.00 40.48 H new ATOM 0 HG3 GLU B 15 52.217 -4.284 23.309 1.00 40.48 H new ATOM 1600 N LEU B 16 48.070 -3.579 25.187 1.00 25.71 N ATOM 1601 CA LEU B 16 47.407 -2.341 25.616 1.00 24.16 C ATOM 1602 C LEU B 16 47.233 -2.268 27.138 1.00 24.17 C ATOM 1603 O LEU B 16 47.271 -1.184 27.710 1.00 21.66 O ATOM 1604 CB LEU B 16 46.051 -2.187 24.952 1.00 22.17 C ATOM 1605 CG LEU B 16 46.110 -1.947 23.429 1.00 21.53 C ATOM 1606 CD1 LEU B 16 44.691 -1.736 22.935 1.00 22.06 C ATOM 1607 CD2 LEU B 16 46.973 -0.703 23.141 1.00 20.76 C ATOM 0 H LEU B 16 47.560 -4.129 24.766 1.00 25.71 H new ATOM 0 HA LEU B 16 47.988 -1.615 25.341 1.00 24.16 H new ATOM 0 HB2 LEU B 16 45.527 -2.985 25.122 1.00 22.17 H new ATOM 0 HB3 LEU B 16 45.582 -1.446 25.367 1.00 22.17 H new ATOM 0 HG LEU B 16 46.507 -2.706 22.973 1.00 21.53 H new ATOM 0 HD11 LEU B 16 44.701 -1.583 21.977 1.00 22.06 H new ATOM 0 HD12 LEU B 16 44.160 -2.524 23.130 1.00 22.06 H new ATOM 0 HD13 LEU B 16 44.304 -0.967 23.381 1.00 22.06 H new ATOM 0 HD21 LEU B 16 47.012 -0.550 22.184 1.00 20.76 H new ATOM 0 HD22 LEU B 16 46.581 0.071 23.576 1.00 20.76 H new ATOM 0 HD23 LEU B 16 47.870 -0.845 23.482 1.00 20.76 H new ATOM 1608 N THR B 17 47.038 -3.417 27.777 1.00 22.24 N ATOM 1609 CA THR B 17 46.917 -3.425 29.215 1.00 22.52 C ATOM 1610 C THR B 17 48.308 -3.135 29.806 1.00 21.52 C ATOM 1611 O THR B 17 48.447 -2.395 30.762 1.00 21.78 O ATOM 1612 CB THR B 17 46.341 -4.790 29.709 1.00 23.40 C ATOM 1613 OG1 THR B 17 45.026 -4.980 29.162 1.00 20.23 O ATOM 1614 CG2 THR B 17 46.266 -4.820 31.254 1.00 19.56 C ATOM 0 H THR B 17 46.975 -4.187 27.398 1.00 22.24 H new ATOM 0 HA THR B 17 46.296 -2.742 29.512 1.00 22.52 H new ATOM 0 HB THR B 17 46.928 -5.503 29.411 1.00 23.40 H new ATOM 0 HG1 THR B 17 45.088 -5.291 28.384 1.00 20.23 H new ATOM 0 HG21 THR B 17 45.907 -5.673 31.544 1.00 19.56 H new ATOM 0 HG22 THR B 17 47.155 -4.701 31.624 1.00 19.56 H new ATOM 0 HG23 THR B 17 45.689 -4.104 31.564 1.00 19.56 H new ATOM 1615 N ARG B 18 49.353 -3.694 29.221 1.00 22.43 N ATOM 1616 CA ARG B 18 50.711 -3.457 29.687 1.00 24.73 C ATOM 1617 C ARG B 18 51.260 -2.046 29.350 1.00 25.21 C ATOM 1618 O ARG B 18 52.227 -1.573 29.939 1.00 23.61 O ATOM 1619 CB ARG B 18 51.636 -4.521 29.099 1.00 27.25 C ATOM 1620 CG ARG B 18 53.122 -4.295 29.368 1.00 32.45 C ATOM 1621 CD ARG B 18 53.914 -5.543 29.022 1.00 36.73 C ATOM 1622 NE ARG B 18 53.442 -6.140 27.769 1.00 41.02 N ATOM 1623 CZ ARG B 18 53.827 -5.756 26.552 1.00 42.38 C ATOM 1624 NH1 ARG B 18 54.715 -4.775 26.403 1.00 42.51 N ATOM 1625 NH2 ARG B 18 53.287 -6.335 25.479 1.00 42.56 N ATOM 0 H ARG B 18 49.298 -4.221 28.544 1.00 22.43 H new ATOM 0 HA ARG B 18 50.683 -3.510 30.655 1.00 24.73 H new ATOM 0 HB2 ARG B 18 51.383 -5.386 29.458 1.00 27.25 H new ATOM 0 HB3 ARG B 18 51.496 -4.560 28.140 1.00 27.25 H new ATOM 0 HG2 ARG B 18 53.442 -3.545 28.843 1.00 32.45 H new ATOM 0 HG3 ARG B 18 53.257 -4.066 30.301 1.00 32.45 H new ATOM 0 HD2 ARG B 18 54.855 -5.321 28.943 1.00 36.73 H new ATOM 0 HD3 ARG B 18 53.835 -6.189 29.741 1.00 36.73 H new ATOM 0 HE ARG B 18 52.876 -6.785 27.823 1.00 41.02 H new ATOM 0 HH11 ARG B 18 55.044 -4.384 27.095 1.00 42.51 H new ATOM 0 HH12 ARG B 18 54.959 -4.532 25.615 1.00 42.51 H new ATOM 0 HH21 ARG B 18 52.695 -6.951 25.575 1.00 42.56 H new ATOM 0 HH22 ARG B 18 53.531 -6.092 24.691 1.00 42.56 H new ATOM 1626 N LYS B 19 50.645 -1.356 28.404 1.00 25.23 N ATOM 1627 CA LYS B 19 51.139 -0.031 28.072 1.00 25.52 C ATOM 1628 C LYS B 19 50.318 1.101 28.696 1.00 24.37 C ATOM 1629 O LYS B 19 50.630 2.272 28.477 1.00 24.59 O ATOM 1630 CB LYS B 19 51.170 0.143 26.545 1.00 28.43 C ATOM 1631 CG LYS B 19 52.259 -0.638 25.848 1.00 31.97 C ATOM 1632 CD LYS B 19 52.161 -0.468 24.329 1.00 35.88 C ATOM 1633 CE LYS B 19 53.454 -0.951 23.636 1.00 37.54 C ATOM 1634 NZ LYS B 19 53.262 -1.157 22.145 1.00 40.65 N ATOM 0 H LYS B 19 49.962 -1.624 27.955 1.00 25.23 H new ATOM 0 HA LYS B 19 52.032 0.031 28.445 1.00 25.52 H new ATOM 0 HB2 LYS B 19 50.312 -0.127 26.183 1.00 28.43 H new ATOM 0 HB3 LYS B 19 51.281 1.085 26.340 1.00 28.43 H new ATOM 0 HG2 LYS B 19 53.128 -0.336 26.156 1.00 31.97 H new ATOM 0 HG3 LYS B 19 52.187 -1.578 26.078 1.00 31.97 H new ATOM 0 HD2 LYS B 19 51.402 -0.969 23.992 1.00 35.88 H new ATOM 0 HD3 LYS B 19 52.003 0.465 24.114 1.00 35.88 H new ATOM 0 HE2 LYS B 19 54.160 -0.302 23.783 1.00 37.54 H new ATOM 0 HE3 LYS B 19 53.745 -1.783 24.041 1.00 37.54 H new ATOM 0 HZ1 LYS B 19 53.646 -1.921 21.899 1.00 40.65 H new ATOM 0 HZ2 LYS B 19 52.392 -1.189 21.959 1.00 40.65 H new ATOM 0 HZ3 LYS B 19 53.635 -0.482 21.701 1.00 40.65 H new ATOM 1635 N THR B 20 49.273 0.768 29.456 1.00 21.67 N ATOM 1636 CA THR B 20 48.436 1.795 30.074 1.00 18.60 C ATOM 1637 C THR B 20 48.165 1.498 31.572 1.00 20.30 C ATOM 1638 O THR B 20 48.549 0.404 32.092 1.00 18.02 O ATOM 1639 CB THR B 20 47.071 1.844 29.404 1.00 17.92 C ATOM 1640 OG1 THR B 20 46.426 0.589 29.630 1.00 17.99 O ATOM 1641 CG2 THR B 20 47.202 2.116 27.815 1.00 13.42 C ATOM 0 H THR B 20 49.034 -0.041 29.625 1.00 21.67 H new ATOM 0 HA THR B 20 48.920 2.630 29.975 1.00 18.60 H new ATOM 0 HB THR B 20 46.554 2.573 29.781 1.00 17.92 H new ATOM 0 HG1 THR B 20 46.686 0.033 29.056 1.00 17.99 H new ATOM 0 HG21 THR B 20 46.318 2.142 27.417 1.00 13.42 H new ATOM 0 HG22 THR B 20 47.647 2.965 27.667 1.00 13.42 H new ATOM 0 HG23 THR B 20 47.720 1.405 27.406 1.00 13.42 H new ATOM 1642 N TYR B 21 47.499 2.452 32.234 1.00 18.80 N ATOM 1643 CA TYR B 21 47.117 2.292 33.638 1.00 19.09 C ATOM 1644 C TYR B 21 45.764 1.626 33.765 1.00 18.19 C ATOM 1645 O TYR B 21 45.168 1.674 34.823 1.00 17.95 O ATOM 1646 CB TYR B 21 47.103 3.656 34.375 1.00 19.56 C ATOM 1647 CG TYR B 21 48.500 4.203 34.551 1.00 21.43 C ATOM 1648 CD1 TYR B 21 48.996 5.231 33.729 1.00 20.53 C ATOM 1649 CD2 TYR B 21 49.339 3.676 35.538 1.00 22.09 C ATOM 1650 CE1 TYR B 21 50.307 5.726 33.897 1.00 22.25 C ATOM 1651 CE2 TYR B 21 50.643 4.152 35.709 1.00 23.55 C ATOM 1652 CZ TYR B 21 51.117 5.172 34.894 1.00 24.24 C ATOM 1653 OH TYR B 21 52.396 5.623 35.093 1.00 24.95 O ATOM 0 H TYR B 21 47.260 3.200 31.884 1.00 18.80 H new ATOM 0 HA TYR B 21 47.783 1.722 34.053 1.00 19.09 H new ATOM 0 HB2 TYR B 21 46.566 4.290 33.874 1.00 19.56 H new ATOM 0 HB3 TYR B 21 46.683 3.552 35.243 1.00 19.56 H new ATOM 0 HD1 TYR B 21 48.452 5.590 33.065 1.00 20.53 H new ATOM 0 HD2 TYR B 21 49.024 2.997 36.090 1.00 22.09 H new ATOM 0 HE1 TYR B 21 50.627 6.409 33.354 1.00 22.25 H new ATOM 0 HE2 TYR B 21 51.191 3.787 36.366 1.00 23.55 H new ATOM 0 HH TYR B 21 52.414 6.459 35.014 1.00 24.95 H new ATOM 1654 N PHE B 22 45.285 0.991 32.685 1.00 16.90 N ATOM 1655 CA PHE B 22 44.006 0.293 32.698 1.00 16.34 C ATOM 1656 C PHE B 22 44.180 -1.212 32.906 1.00 16.11 C ATOM 1657 O PHE B 22 45.246 -1.744 32.637 1.00 14.38 O ATOM 1658 CB PHE B 22 43.284 0.488 31.360 1.00 19.54 C ATOM 1659 CG PHE B 22 42.943 1.911 31.062 1.00 20.26 C ATOM 1660 CD1 PHE B 22 41.944 2.555 31.770 1.00 19.63 C ATOM 1661 CD2 PHE B 22 43.641 2.608 30.094 1.00 19.85 C ATOM 1662 CE1 PHE B 22 41.630 3.909 31.515 1.00 21.80 C ATOM 1663 CE2 PHE B 22 43.334 3.963 29.829 1.00 22.90 C ATOM 1664 CZ PHE B 22 42.319 4.602 30.551 1.00 18.75 C ATOM 0 H PHE B 22 45.696 0.957 31.931 1.00 16.90 H new ATOM 0 HA PHE B 22 43.493 0.665 33.433 1.00 16.34 H new ATOM 0 HB2 PHE B 22 43.843 0.142 30.647 1.00 19.54 H new ATOM 0 HB3 PHE B 22 42.469 -0.038 31.362 1.00 19.54 H new ATOM 0 HD1 PHE B 22 41.472 2.090 32.423 1.00 19.63 H new ATOM 0 HD2 PHE B 22 44.316 2.184 29.615 1.00 19.85 H new ATOM 0 HE1 PHE B 22 40.957 4.330 32.000 1.00 21.80 H new ATOM 0 HE2 PHE B 22 43.805 4.429 29.176 1.00 22.90 H new ATOM 0 HZ PHE B 22 42.112 5.492 30.378 1.00 18.75 H new ATOM 1665 N THR B 23 43.139 -1.870 33.403 1.00 16.26 N ATOM 1666 CA THR B 23 43.143 -3.322 33.541 1.00 18.91 C ATOM 1667 C THR B 23 42.582 -3.847 32.210 1.00 19.37 C ATOM 1668 O THR B 23 42.056 -3.085 31.406 1.00 19.30 O ATOM 1669 CB THR B 23 42.167 -3.845 34.585 1.00 17.88 C ATOM 1670 OG1 THR B 23 40.874 -3.362 34.267 1.00 19.08 O ATOM 1671 CG2 THR B 23 42.563 -3.389 36.021 1.00 20.75 C ATOM 0 H THR B 23 42.414 -1.491 33.668 1.00 16.26 H new ATOM 0 HA THR B 23 44.040 -3.598 33.785 1.00 18.91 H new ATOM 0 HB THR B 23 42.184 -4.815 34.574 1.00 17.88 H new ATOM 0 HG1 THR B 23 40.405 -3.335 34.964 1.00 19.08 H new ATOM 0 HG21 THR B 23 41.922 -3.738 36.660 1.00 20.75 H new ATOM 0 HG22 THR B 23 43.448 -3.724 36.235 1.00 20.75 H new ATOM 0 HG23 THR B 23 42.566 -2.420 36.064 1.00 20.75 H new ATOM 1672 N GLU B 24 42.658 -5.158 32.000 1.00 21.61 N ATOM 1673 CA GLU B 24 42.111 -5.742 30.782 1.00 24.58 C ATOM 1674 C GLU B 24 40.604 -5.460 30.641 1.00 25.24 C ATOM 1675 O GLU B 24 40.126 -5.127 29.565 1.00 26.99 O ATOM 1676 CB GLU B 24 42.385 -7.248 30.773 1.00 26.36 C ATOM 1677 CG GLU B 24 41.794 -7.993 29.575 1.00 28.99 C ATOM 1678 CD GLU B 24 42.254 -9.489 29.505 1.00 32.86 C ATOM 1679 OE1 GLU B 24 43.373 -9.812 29.990 1.00 31.00 O ATOM 1680 OE2 GLU B 24 41.494 -10.328 28.956 1.00 32.55 O ATOM 0 H GLU B 24 43.018 -5.720 32.543 1.00 21.61 H new ATOM 0 HA GLU B 24 42.549 -5.330 30.021 1.00 24.58 H new ATOM 0 HB2 GLU B 24 43.344 -7.391 30.787 1.00 26.36 H new ATOM 0 HB3 GLU B 24 42.029 -7.635 31.588 1.00 26.36 H new ATOM 0 HG2 GLU B 24 40.826 -7.958 29.623 1.00 28.99 H new ATOM 0 HG3 GLU B 24 42.054 -7.540 28.757 1.00 28.99 H new ATOM 1681 N LYS B 25 39.848 -5.580 31.725 1.00 24.85 N ATOM 1682 CA LYS B 25 38.416 -5.334 31.649 1.00 26.29 C ATOM 1683 C LYS B 25 38.131 -3.875 31.288 1.00 24.20 C ATOM 1684 O LYS B 25 37.179 -3.585 30.550 1.00 23.17 O ATOM 1685 CB LYS B 25 37.769 -5.720 32.983 1.00 29.92 C ATOM 1686 CG LYS B 25 36.270 -6.023 32.917 1.00 34.92 C ATOM 1687 CD LYS B 25 35.685 -6.395 34.312 1.00 39.07 C ATOM 1688 CE LYS B 25 35.859 -7.883 34.700 1.00 40.62 C ATOM 1689 NZ LYS B 25 37.264 -8.326 34.956 1.00 42.35 N ATOM 0 H LYS B 25 40.140 -5.800 32.504 1.00 24.85 H new ATOM 0 HA LYS B 25 38.031 -5.880 30.945 1.00 26.29 H new ATOM 0 HB2 LYS B 25 38.227 -6.500 33.334 1.00 29.92 H new ATOM 0 HB3 LYS B 25 37.911 -4.999 33.616 1.00 29.92 H new ATOM 0 HG2 LYS B 25 35.800 -5.250 32.566 1.00 34.92 H new ATOM 0 HG3 LYS B 25 36.116 -6.754 32.298 1.00 34.92 H new ATOM 0 HD2 LYS B 25 36.111 -5.844 34.987 1.00 39.07 H new ATOM 0 HD3 LYS B 25 34.740 -6.177 34.323 1.00 39.07 H new ATOM 0 HE2 LYS B 25 35.333 -8.056 35.496 1.00 40.62 H new ATOM 0 HE3 LYS B 25 35.489 -8.431 33.990 1.00 40.62 H new ATOM 0 HZ1 LYS B 25 37.257 -9.066 35.451 1.00 42.35 H new ATOM 0 HZ2 LYS B 25 37.669 -8.492 34.181 1.00 42.35 H new ATOM 0 HZ3 LYS B 25 37.704 -7.685 35.389 1.00 42.35 H new ATOM 1690 N GLU B 26 38.964 -2.950 31.785 1.00 23.24 N ATOM 1691 CA GLU B 26 38.772 -1.533 31.472 1.00 22.62 C ATOM 1692 C GLU B 26 39.106 -1.271 30.008 1.00 21.53 C ATOM 1693 O GLU B 26 38.418 -0.496 29.361 1.00 19.99 O ATOM 1694 CB GLU B 26 39.648 -0.614 32.365 1.00 23.03 C ATOM 1695 CG GLU B 26 39.190 -0.628 33.839 1.00 25.09 C ATOM 1696 CD GLU B 26 40.040 0.217 34.790 1.00 22.60 C ATOM 1697 OE1 GLU B 26 41.288 0.177 34.719 1.00 22.24 O ATOM 1698 OE2 GLU B 26 39.432 0.907 35.629 1.00 21.14 O ATOM 0 H GLU B 26 39.634 -3.121 32.296 1.00 23.24 H new ATOM 0 HA GLU B 26 37.841 -1.325 31.646 1.00 22.62 H new ATOM 0 HB2 GLU B 26 40.573 -0.901 32.312 1.00 23.03 H new ATOM 0 HB3 GLU B 26 39.613 0.294 32.025 1.00 23.03 H new ATOM 0 HG2 GLU B 26 38.273 -0.314 33.881 1.00 25.09 H new ATOM 0 HG3 GLU B 26 39.191 -1.545 34.155 1.00 25.09 H new ATOM 1699 N VAL B 27 40.175 -1.897 29.514 1.00 19.19 N ATOM 1700 CA VAL B 27 40.556 -1.706 28.118 1.00 20.81 C ATOM 1701 C VAL B 27 39.388 -2.173 27.224 1.00 20.56 C ATOM 1702 O VAL B 27 38.975 -1.460 26.301 1.00 21.25 O ATOM 1703 CB VAL B 27 41.866 -2.493 27.795 1.00 19.19 C ATOM 1704 CG1 VAL B 27 42.141 -2.473 26.321 1.00 19.89 C ATOM 1705 CG2 VAL B 27 43.063 -1.841 28.509 1.00 19.90 C ATOM 0 H VAL B 27 40.683 -2.427 29.962 1.00 19.19 H new ATOM 0 HA VAL B 27 40.735 -0.768 27.948 1.00 20.81 H new ATOM 0 HB VAL B 27 41.747 -3.407 28.098 1.00 19.19 H new ATOM 0 HG11 VAL B 27 42.956 -2.965 26.137 1.00 19.89 H new ATOM 0 HG12 VAL B 27 41.401 -2.885 25.848 1.00 19.89 H new ATOM 0 HG13 VAL B 27 42.243 -1.556 26.023 1.00 19.89 H new ATOM 0 HG21 VAL B 27 43.872 -2.336 28.303 1.00 19.90 H new ATOM 0 HG22 VAL B 27 43.160 -0.924 28.207 1.00 19.90 H new ATOM 0 HG23 VAL B 27 42.913 -1.852 29.467 1.00 19.90 H new ATOM 1706 N GLN B 28 38.814 -3.330 27.559 1.00 19.58 N ATOM 1707 CA GLN B 28 37.726 -3.897 26.792 1.00 21.94 C ATOM 1708 C GLN B 28 36.495 -3.009 26.872 1.00 22.49 C ATOM 1709 O GLN B 28 35.774 -2.870 25.892 1.00 22.68 O ATOM 1710 CB GLN B 28 37.385 -5.312 27.290 1.00 23.86 C ATOM 1711 CG GLN B 28 38.502 -6.331 27.085 1.00 26.05 C ATOM 1712 CD GLN B 28 38.614 -6.790 25.643 1.00 28.37 C ATOM 1713 OE1 GLN B 28 38.211 -6.079 24.728 1.00 29.78 O ATOM 1714 NE2 GLN B 28 39.180 -7.968 25.434 1.00 29.13 N ATOM 0 H GLN B 28 39.050 -3.802 28.238 1.00 19.58 H new ATOM 0 HA GLN B 28 38.011 -3.954 25.867 1.00 21.94 H new ATOM 0 HB2 GLN B 28 37.169 -5.269 28.235 1.00 23.86 H new ATOM 0 HB3 GLN B 28 36.589 -5.623 26.831 1.00 23.86 H new ATOM 0 HG2 GLN B 28 39.346 -5.942 27.364 1.00 26.05 H new ATOM 0 HG3 GLN B 28 38.343 -7.100 27.654 1.00 26.05 H new ATOM 0 HE21 GLN B 28 39.451 -8.439 26.100 1.00 29.13 H new ATOM 0 HE22 GLN B 28 39.277 -8.262 24.632 1.00 29.13 H new ATOM 1715 N GLN B 29 36.251 -2.414 28.037 1.00 23.50 N ATOM 1716 CA GLN B 29 35.114 -1.504 28.210 1.00 25.09 C ATOM 1717 C GLN B 29 35.276 -0.269 27.341 1.00 24.57 C ATOM 1718 O GLN B 29 34.313 0.204 26.716 1.00 23.87 O ATOM 1719 CB GLN B 29 34.989 -1.009 29.656 1.00 28.93 C ATOM 1720 CG GLN B 29 34.271 -1.943 30.571 1.00 35.09 C ATOM 1721 CD GLN B 29 34.579 -1.667 32.030 1.00 39.80 C ATOM 1722 OE1 GLN B 29 34.439 -2.554 32.879 1.00 42.47 O ATOM 1723 NE2 GLN B 29 34.987 -0.429 32.336 1.00 41.96 N ATOM 0 H GLN B 29 36.731 -2.522 28.742 1.00 23.50 H new ATOM 0 HA GLN B 29 34.326 -2.012 27.961 1.00 25.09 H new ATOM 0 HB2 GLN B 29 35.878 -0.849 30.009 1.00 28.93 H new ATOM 0 HB3 GLN B 29 34.526 -0.156 29.655 1.00 28.93 H new ATOM 0 HG2 GLN B 29 33.315 -1.866 30.424 1.00 35.09 H new ATOM 0 HG3 GLN B 29 34.518 -2.856 30.357 1.00 35.09 H new ATOM 0 HE21 GLN B 29 35.072 0.161 31.716 1.00 41.96 H new ATOM 0 HE22 GLN B 29 35.164 -0.224 33.152 1.00 41.96 H new ATOM 1724 N TRP B 30 36.489 0.278 27.324 1.00 24.22 N ATOM 1725 CA TRP B 30 36.738 1.461 26.517 1.00 24.06 C ATOM 1726 C TRP B 30 36.603 1.145 25.018 1.00 24.48 C ATOM 1727 O TRP B 30 36.093 1.982 24.265 1.00 23.12 O ATOM 1728 CB TRP B 30 38.122 2.056 26.820 1.00 24.76 C ATOM 1729 CG TRP B 30 38.088 3.033 27.970 1.00 28.20 C ATOM 1730 CD1 TRP B 30 38.598 2.845 29.237 1.00 30.70 C ATOM 1731 CD2 TRP B 30 37.415 4.300 27.997 1.00 30.09 C ATOM 1732 NE1 TRP B 30 38.271 3.926 30.045 1.00 30.44 N ATOM 1733 CE2 TRP B 30 37.544 4.825 29.308 1.00 30.77 C ATOM 1734 CE3 TRP B 30 36.707 5.041 27.043 1.00 31.48 C ATOM 1735 CZ2 TRP B 30 36.986 6.061 29.684 1.00 32.07 C ATOM 1736 CZ3 TRP B 30 36.144 6.286 27.430 1.00 33.18 C ATOM 1737 CH2 TRP B 30 36.296 6.768 28.742 1.00 32.23 C ATOM 0 H TRP B 30 37.167 -0.015 27.764 1.00 24.22 H new ATOM 0 HA TRP B 30 36.067 2.122 26.749 1.00 24.06 H new ATOM 0 HB2 TRP B 30 38.742 1.339 27.026 1.00 24.76 H new ATOM 0 HB3 TRP B 30 38.459 2.504 26.028 1.00 24.76 H new ATOM 0 HD1 TRP B 30 39.089 2.104 29.510 1.00 30.70 H new ATOM 0 HE1 TRP B 30 38.489 4.017 30.872 1.00 30.44 H new ATOM 0 HE3 TRP B 30 36.608 4.725 26.174 1.00 31.48 H new ATOM 0 HZ2 TRP B 30 37.085 6.387 30.549 1.00 32.07 H new ATOM 0 HZ3 TRP B 30 35.669 6.789 26.808 1.00 33.18 H new ATOM 0 HH2 TRP B 30 35.918 7.586 28.973 1.00 32.23 H new ATOM 1738 N TYR B 31 37.058 -0.042 24.607 1.00 25.49 N ATOM 1739 CA TYR B 31 36.980 -0.438 23.203 1.00 25.43 C ATOM 1740 C TYR B 31 35.516 -0.581 22.753 1.00 26.03 C ATOM 1741 O TYR B 31 35.124 -0.172 21.639 1.00 25.73 O ATOM 1742 CB TYR B 31 37.706 -1.745 22.993 1.00 25.62 C ATOM 1743 CG TYR B 31 37.765 -2.101 21.534 1.00 27.13 C ATOM 1744 CD1 TYR B 31 38.476 -1.296 20.649 1.00 27.19 C ATOM 1745 CD2 TYR B 31 37.170 -3.273 21.047 1.00 29.04 C ATOM 1746 CE1 TYR B 31 38.626 -1.637 19.315 1.00 29.71 C ATOM 1747 CE2 TYR B 31 37.311 -3.631 19.702 1.00 30.52 C ATOM 1748 CZ TYR B 31 38.055 -2.808 18.843 1.00 29.63 C ATOM 1749 OH TYR B 31 38.315 -3.174 17.551 1.00 29.19 O ATOM 0 H TYR B 31 37.414 -0.629 25.125 1.00 25.49 H new ATOM 0 HA TYR B 31 37.401 0.255 22.670 1.00 25.43 H new ATOM 0 HB2 TYR B 31 38.606 -1.680 23.350 1.00 25.62 H new ATOM 0 HB3 TYR B 31 37.256 -2.451 23.484 1.00 25.62 H new ATOM 0 HD1 TYR B 31 38.860 -0.509 20.961 1.00 27.19 H new ATOM 0 HD2 TYR B 31 36.679 -3.815 21.621 1.00 29.04 H new ATOM 0 HE1 TYR B 31 39.106 -1.085 18.741 1.00 29.71 H new ATOM 0 HE2 TYR B 31 36.915 -4.408 19.380 1.00 30.52 H new ATOM 0 HH TYR B 31 38.166 -3.995 17.457 1.00 29.19 H new ATOM 1750 N LYS B 32 34.704 -1.180 23.614 1.00 26.47 N ATOM 1751 CA LYS B 32 33.278 -1.335 23.302 1.00 29.28 C ATOM 1752 C LYS B 32 32.656 0.033 23.003 1.00 29.74 C ATOM 1753 O LYS B 32 31.938 0.193 22.013 1.00 29.50 O ATOM 1754 CB LYS B 32 32.530 -1.974 24.474 1.00 30.78 C ATOM 1755 CG LYS B 32 31.009 -1.975 24.301 1.00 34.96 C ATOM 1756 CD LYS B 32 30.293 -2.904 25.273 1.00 38.77 C ATOM 1757 CE LYS B 32 28.827 -3.117 24.822 1.00 41.01 C ATOM 1758 NZ LYS B 32 28.069 -4.161 25.588 1.00 41.06 N ATOM 0 H LYS B 32 34.948 -1.501 24.374 1.00 26.47 H new ATOM 0 HA LYS B 32 33.202 -1.911 22.525 1.00 29.28 H new ATOM 0 HB2 LYS B 32 32.836 -2.888 24.584 1.00 30.78 H new ATOM 0 HB3 LYS B 32 32.755 -1.499 25.289 1.00 30.78 H new ATOM 0 HG2 LYS B 32 30.675 -1.072 24.421 1.00 34.96 H new ATOM 0 HG3 LYS B 32 30.793 -2.239 23.393 1.00 34.96 H new ATOM 0 HD2 LYS B 32 30.753 -3.757 25.315 1.00 38.77 H new ATOM 0 HD3 LYS B 32 30.313 -2.527 26.166 1.00 38.77 H new ATOM 0 HE2 LYS B 32 28.354 -2.273 24.898 1.00 41.01 H new ATOM 0 HE3 LYS B 32 28.824 -3.360 23.883 1.00 41.01 H new ATOM 0 HZ1 LYS B 32 27.241 -4.221 25.268 1.00 41.06 H new ATOM 0 HZ2 LYS B 32 28.477 -4.947 25.502 1.00 41.06 H new ATOM 0 HZ3 LYS B 32 28.039 -3.935 26.448 1.00 41.06 H new ATOM 1759 N GLY B 33 32.933 1.009 23.872 1.00 30.11 N ATOM 1760 CA GLY B 33 32.404 2.351 23.687 1.00 29.19 C ATOM 1761 C GLY B 33 32.987 3.023 22.465 1.00 29.38 C ATOM 1762 O GLY B 33 32.258 3.664 21.700 1.00 29.92 O ATOM 0 H GLY B 33 33.424 0.910 24.571 1.00 30.11 H new ATOM 0 HA2 GLY B 33 31.439 2.309 23.603 1.00 29.19 H new ATOM 0 HA3 GLY B 33 32.597 2.886 24.473 1.00 29.19 H new ATOM 1763 N PHE B 34 34.296 2.862 22.259 1.00 27.23 N ATOM 1764 CA PHE B 34 34.965 3.468 21.124 1.00 26.81 C ATOM 1765 C PHE B 34 34.343 2.971 19.804 1.00 26.77 C ATOM 1766 O PHE B 34 34.032 3.775 18.919 1.00 26.61 O ATOM 1767 CB PHE B 34 36.440 3.088 21.173 1.00 23.88 C ATOM 1768 CG PHE B 34 37.272 3.710 20.092 1.00 26.31 C ATOM 1769 CD1 PHE B 34 37.702 5.028 20.203 1.00 25.54 C ATOM 1770 CD2 PHE B 34 37.700 2.953 19.010 1.00 25.83 C ATOM 1771 CE1 PHE B 34 38.565 5.586 19.251 1.00 28.01 C ATOM 1772 CE2 PHE B 34 38.557 3.494 18.052 1.00 28.78 C ATOM 1773 CZ PHE B 34 38.997 4.826 18.175 1.00 27.57 C ATOM 0 H PHE B 34 34.811 2.402 22.772 1.00 27.23 H new ATOM 0 HA PHE B 34 34.865 4.432 21.164 1.00 26.81 H new ATOM 0 HB2 PHE B 34 36.802 3.347 22.035 1.00 23.88 H new ATOM 0 HB3 PHE B 34 36.517 2.123 21.112 1.00 23.88 H new ATOM 0 HD1 PHE B 34 37.413 5.546 20.919 1.00 25.54 H new ATOM 0 HD2 PHE B 34 37.411 2.073 18.923 1.00 25.83 H new ATOM 0 HE1 PHE B 34 38.848 6.467 19.341 1.00 28.01 H new ATOM 0 HE2 PHE B 34 38.838 2.976 17.333 1.00 28.78 H new ATOM 0 HZ PHE B 34 39.571 5.192 17.541 1.00 27.57 H new ATOM 1774 N ILE B 35 34.167 1.657 19.686 1.00 27.42 N ATOM 1775 CA ILE B 35 33.628 1.052 18.462 1.00 30.61 C ATOM 1776 C ILE B 35 32.150 1.360 18.212 1.00 33.45 C ATOM 1777 O ILE B 35 31.712 1.441 17.051 1.00 34.27 O ATOM 1778 CB ILE B 35 33.847 -0.463 18.469 1.00 31.84 C ATOM 1779 CG1 ILE B 35 35.347 -0.756 18.557 1.00 32.63 C ATOM 1780 CG2 ILE B 35 33.310 -1.075 17.175 1.00 34.74 C ATOM 1781 CD1 ILE B 35 36.152 -0.102 17.406 1.00 32.81 C ATOM 0 H ILE B 35 34.354 1.092 20.307 1.00 27.42 H new ATOM 0 HA ILE B 35 34.121 1.459 17.732 1.00 30.61 H new ATOM 0 HB ILE B 35 33.382 -0.845 19.230 1.00 31.84 H new ATOM 0 HG12 ILE B 35 35.686 -0.435 19.407 1.00 32.63 H new ATOM 0 HG13 ILE B 35 35.487 -1.716 18.540 1.00 32.63 H new ATOM 0 HG21 ILE B 35 33.452 -2.034 17.187 1.00 34.74 H new ATOM 0 HG22 ILE B 35 32.361 -0.890 17.099 1.00 34.74 H new ATOM 0 HG23 ILE B 35 33.776 -0.689 16.417 1.00 34.74 H new ATOM 0 HD11 ILE B 35 37.093 -0.316 17.506 1.00 32.81 H new ATOM 0 HD12 ILE B 35 35.833 -0.440 16.555 1.00 32.81 H new ATOM 0 HD13 ILE B 35 36.035 0.860 17.435 1.00 32.81 H new ATOM 1782 N LYS B 36 31.368 1.534 19.276 1.00 34.72 N ATOM 1783 CA LYS B 36 29.969 1.875 19.055 1.00 38.14 C ATOM 1784 C LYS B 36 29.924 3.315 18.497 1.00 38.68 C ATOM 1785 O LYS B 36 29.311 3.557 17.448 1.00 38.72 O ATOM 1786 CB LYS B 36 29.150 1.748 20.345 1.00 39.91 C ATOM 1787 CG LYS B 36 29.405 2.805 21.384 1.00 43.11 C ATOM 1788 CD LYS B 36 28.697 2.467 22.716 1.00 44.94 C ATOM 1789 CE LYS B 36 27.213 2.807 22.702 1.00 46.31 C ATOM 1790 NZ LYS B 36 26.960 4.293 22.682 1.00 46.27 N ATOM 0 H LYS B 36 31.614 1.463 20.097 1.00 34.72 H new ATOM 0 HA LYS B 36 29.571 1.258 18.421 1.00 38.14 H new ATOM 0 HB2 LYS B 36 28.208 1.765 20.114 1.00 39.91 H new ATOM 0 HB3 LYS B 36 29.330 0.880 20.739 1.00 39.91 H new ATOM 0 HG2 LYS B 36 30.359 2.889 21.535 1.00 43.11 H new ATOM 0 HG3 LYS B 36 29.093 3.664 21.058 1.00 43.11 H new ATOM 0 HD2 LYS B 36 28.806 1.522 22.904 1.00 44.94 H new ATOM 0 HD3 LYS B 36 29.128 2.951 23.438 1.00 44.94 H new ATOM 0 HE2 LYS B 36 26.799 2.401 21.924 1.00 46.31 H new ATOM 0 HE3 LYS B 36 26.788 2.420 23.484 1.00 46.31 H new ATOM 0 HZ1 LYS B 36 26.092 4.448 22.806 1.00 46.27 H new ATOM 0 HZ2 LYS B 36 27.426 4.683 23.332 1.00 46.27 H new ATOM 0 HZ3 LYS B 36 27.212 4.627 21.896 1.00 46.27 H new ATOM 1791 N ASP B 37 30.607 4.253 19.155 1.00 37.56 N ATOM 1792 CA ASP B 37 30.626 5.639 18.682 1.00 37.55 C ATOM 1793 C ASP B 37 31.375 5.791 17.366 1.00 36.23 C ATOM 1794 O ASP B 37 31.153 6.745 16.620 1.00 36.81 O ATOM 1795 CB ASP B 37 31.243 6.559 19.739 1.00 40.54 C ATOM 1796 CG ASP B 37 30.458 6.556 21.053 1.00 43.53 C ATOM 1797 OD1 ASP B 37 29.236 6.247 21.046 1.00 45.31 O ATOM 1798 OD2 ASP B 37 31.062 6.890 22.097 1.00 46.04 O ATOM 0 H ASP B 37 31.062 4.110 19.871 1.00 37.56 H new ATOM 0 HA ASP B 37 29.704 5.896 18.527 1.00 37.55 H new ATOM 0 HB2 ASP B 37 32.156 6.281 19.911 1.00 40.54 H new ATOM 0 HB3 ASP B 37 31.282 7.464 19.392 1.00 40.54 H new ATOM 1799 N CYS B 38 32.286 4.872 17.095 1.00 33.52 N ATOM 1800 CA CYS B 38 33.022 4.920 15.854 1.00 32.17 C ATOM 1801 C CYS B 38 33.046 3.502 15.305 1.00 31.09 C ATOM 1802 O CYS B 38 34.027 2.752 15.483 1.00 27.95 O ATOM 1803 CB CYS B 38 34.435 5.408 16.080 1.00 32.06 C ATOM 1804 SG ACYS B 38 35.250 5.852 14.574 0.50 33.12 S ATOM 1805 SG BCYS B 38 34.503 7.011 16.777 0.50 33.29 S ATOM 0 H CYS B 38 32.490 4.218 17.614 1.00 33.52 H new ATOM 0 HA CYS B 38 32.600 5.535 15.234 1.00 32.17 H new ATOM 0 HB2ACYS B 38 34.418 6.176 16.673 0.50 32.06 H new ATOM 0 HB2BCYS B 38 34.896 4.787 16.665 0.50 32.06 H new ATOM 0 HB3ACYS B 38 34.945 4.715 16.528 0.50 32.06 H new ATOM 0 HB3BCYS B 38 34.911 5.408 15.235 0.50 32.06 H new ATOM 0 HG ACYS B 38 35.217 7.044 14.437 0.50 33.29 H new ATOM 0 HG BCYS B 38 35.414 7.071 17.556 0.50 33.29 H new ATOM 1806 N PRO B 39 31.969 3.126 14.588 1.00 30.80 N ATOM 1807 CA PRO B 39 31.865 1.777 14.013 1.00 28.65 C ATOM 1808 C PRO B 39 33.069 1.371 13.209 1.00 28.28 C ATOM 1809 O PRO B 39 33.502 0.218 13.277 1.00 29.85 O ATOM 1810 CB PRO B 39 30.593 1.851 13.167 1.00 29.90 C ATOM 1811 CG PRO B 39 29.746 2.860 13.909 1.00 30.32 C ATOM 1812 CD PRO B 39 30.788 3.941 14.247 1.00 30.77 C ATOM 0 HA PRO B 39 31.826 1.092 14.699 1.00 28.65 H new ATOM 0 HB2 PRO B 39 30.782 2.139 12.260 1.00 29.90 H new ATOM 0 HB3 PRO B 39 30.153 0.989 13.105 1.00 29.90 H new ATOM 0 HG2 PRO B 39 29.025 3.206 13.360 1.00 30.32 H new ATOM 0 HG3 PRO B 39 29.340 2.482 14.705 1.00 30.32 H new ATOM 0 HD2 PRO B 39 30.957 4.531 13.496 1.00 30.77 H new ATOM 0 HD3 PRO B 39 30.505 4.500 14.988 1.00 30.77 H new ATOM 1813 N SER B 40 33.625 2.295 12.441 1.00 28.77 N ATOM 1814 CA SER B 40 34.796 1.946 11.637 1.00 28.98 C ATOM 1815 C SER B 40 36.026 1.668 12.472 1.00 28.79 C ATOM 1816 O SER B 40 36.947 1.028 12.001 1.00 28.19 O ATOM 1817 CB SER B 40 35.145 3.050 10.655 1.00 30.36 C ATOM 1818 OG SER B 40 35.829 4.127 11.289 1.00 31.67 O ATOM 0 H SER B 40 33.354 3.108 12.368 1.00 28.77 H new ATOM 0 HA SER B 40 34.545 1.136 11.166 1.00 28.98 H new ATOM 0 HB2 SER B 40 35.699 2.688 9.946 1.00 30.36 H new ATOM 0 HB3 SER B 40 34.334 3.382 10.240 1.00 30.36 H new ATOM 0 HG SER B 40 36.008 4.719 10.720 1.00 31.67 H new ATOM 1819 N GLY B 41 36.052 2.168 13.699 1.00 29.56 N ATOM 1820 CA GLY B 41 37.211 1.951 14.543 1.00 30.62 C ATOM 1821 C GLY B 41 38.300 2.971 14.240 1.00 31.80 C ATOM 1822 O GLY B 41 39.441 2.826 14.679 1.00 29.77 O ATOM 0 H GLY B 41 35.419 2.628 14.056 1.00 29.56 H new ATOM 0 HA2 GLY B 41 36.953 2.015 15.476 1.00 30.62 H new ATOM 0 HA3 GLY B 41 37.554 1.054 14.404 1.00 30.62 H new ATOM 1823 N GLN B 42 37.931 3.996 13.469 1.00 33.12 N ATOM 1824 CA GLN B 42 38.840 5.079 13.064 1.00 34.67 C ATOM 1825 C GLN B 42 38.111 6.401 13.268 1.00 34.56 C ATOM 1826 O GLN B 42 37.181 6.738 12.520 1.00 34.94 O ATOM 1827 CB GLN B 42 39.200 4.969 11.581 1.00 36.66 C ATOM 1828 CG GLN B 42 40.087 3.810 11.202 1.00 39.49 C ATOM 1829 CD GLN B 42 39.824 3.362 9.781 1.00 43.31 C ATOM 1830 OE1 GLN B 42 39.892 4.165 8.825 1.00 45.74 O ATOM 1831 NE2 GLN B 42 39.504 2.075 9.621 1.00 44.17 N ATOM 0 H GLN B 42 37.133 4.085 13.160 1.00 33.12 H new ATOM 0 HA GLN B 42 39.652 5.023 13.592 1.00 34.67 H new ATOM 0 HB2 GLN B 42 38.378 4.905 11.070 1.00 36.66 H new ATOM 0 HB3 GLN B 42 39.638 5.791 11.311 1.00 36.66 H new ATOM 0 HG2 GLN B 42 41.018 4.067 11.296 1.00 39.49 H new ATOM 0 HG3 GLN B 42 39.935 3.070 11.811 1.00 39.49 H new ATOM 0 HE21 GLN B 42 39.467 1.553 10.303 1.00 44.17 H new ATOM 0 HE22 GLN B 42 39.335 1.768 8.836 1.00 44.17 H new ATOM 1832 N LEU B 43 38.561 7.162 14.252 1.00 32.81 N ATOM 1833 CA LEU B 43 37.941 8.434 14.590 1.00 32.56 C ATOM 1834 C LEU B 43 38.625 9.552 13.800 1.00 31.90 C ATOM 1835 O LEU B 43 39.843 9.728 13.893 1.00 31.17 O ATOM 1836 CB LEU B 43 38.071 8.642 16.111 1.00 32.98 C ATOM 1837 CG LEU B 43 37.496 9.864 16.815 1.00 34.17 C ATOM 1838 CD1 LEU B 43 35.990 9.888 16.674 1.00 35.79 C ATOM 1839 CD2 LEU B 43 37.888 9.820 18.297 1.00 34.41 C ATOM 0 H LEU B 43 39.235 6.957 14.744 1.00 32.81 H new ATOM 0 HA LEU B 43 37.000 8.443 14.355 1.00 32.56 H new ATOM 0 HB2 LEU B 43 37.674 7.864 16.534 1.00 32.98 H new ATOM 0 HB3 LEU B 43 39.019 8.623 16.315 1.00 32.98 H new ATOM 0 HG LEU B 43 37.854 10.669 16.409 1.00 34.17 H new ATOM 0 HD11 LEU B 43 35.635 10.670 17.126 1.00 35.79 H new ATOM 0 HD12 LEU B 43 35.753 9.923 15.734 1.00 35.79 H new ATOM 0 HD13 LEU B 43 35.615 9.087 17.072 1.00 35.79 H new ATOM 0 HD21 LEU B 43 37.525 10.596 18.751 1.00 34.41 H new ATOM 0 HD22 LEU B 43 37.533 9.013 18.702 1.00 34.41 H new ATOM 0 HD23 LEU B 43 38.855 9.823 18.376 1.00 34.41 H new ATOM 1840 N ASP B 44 37.852 10.283 12.998 1.00 32.92 N ATOM 1841 CA ASP B 44 38.426 11.366 12.198 1.00 32.52 C ATOM 1842 C ASP B 44 38.287 12.692 12.928 1.00 31.78 C ATOM 1843 O ASP B 44 37.609 12.766 13.951 1.00 31.44 O ATOM 1844 CB ASP B 44 37.741 11.454 10.812 1.00 34.64 C ATOM 1845 CG ASP B 44 36.266 11.865 10.889 1.00 35.80 C ATOM 1846 OD1 ASP B 44 35.715 12.017 12.010 1.00 37.16 O ATOM 1847 OD2 ASP B 44 35.641 12.040 9.811 1.00 37.88 O ATOM 0 H ASP B 44 37.005 10.171 12.903 1.00 32.92 H new ATOM 0 HA ASP B 44 39.367 11.174 12.064 1.00 32.52 H new ATOM 0 HB2 ASP B 44 38.220 12.093 10.262 1.00 34.64 H new ATOM 0 HB3 ASP B 44 37.808 10.593 10.370 1.00 34.64 H new ATOM 1848 N ALA B 45 38.928 13.733 12.392 1.00 31.59 N ATOM 1849 CA ALA B 45 38.878 15.085 12.969 1.00 32.58 C ATOM 1850 C ALA B 45 37.467 15.552 13.327 1.00 32.26 C ATOM 1851 O ALA B 45 37.225 16.027 14.430 1.00 32.64 O ATOM 1852 CB ALA B 45 39.531 16.080 12.010 1.00 31.61 C ATOM 0 H ALA B 45 39.407 13.677 11.680 1.00 31.59 H new ATOM 0 HA ALA B 45 39.369 15.045 13.805 1.00 32.58 H new ATOM 0 HB1 ALA B 45 39.496 16.970 12.394 1.00 31.61 H new ATOM 0 HB2 ALA B 45 40.456 15.828 11.862 1.00 31.61 H new ATOM 0 HB3 ALA B 45 39.056 16.074 11.164 1.00 31.61 H new ATOM 1853 N ALA B 46 36.521 15.409 12.405 1.00 34.54 N ATOM 1854 CA ALA B 46 35.139 15.822 12.671 1.00 33.50 C ATOM 1855 C ALA B 46 34.534 15.117 13.896 1.00 33.71 C ATOM 1856 O ALA B 46 33.830 15.747 14.686 1.00 34.82 O ATOM 1857 CB ALA B 46 34.266 15.561 11.437 1.00 34.65 C ATOM 0 H ALA B 46 36.653 15.078 11.622 1.00 34.54 H new ATOM 0 HA ALA B 46 35.160 16.772 12.868 1.00 33.50 H new ATOM 0 HB1 ALA B 46 33.354 15.837 11.621 1.00 34.65 H new ATOM 0 HB2 ALA B 46 34.610 16.066 10.684 1.00 34.65 H new ATOM 0 HB3 ALA B 46 34.280 14.615 11.224 1.00 34.65 H new ATOM 1858 N GLY B 47 34.785 13.814 14.046 1.00 33.56 N ATOM 1859 CA GLY B 47 34.242 13.079 15.189 1.00 31.66 C ATOM 1860 C GLY B 47 34.860 13.530 16.507 1.00 30.98 C ATOM 1861 O GLY B 47 34.165 13.707 17.520 1.00 28.53 O ATOM 0 H GLY B 47 35.260 13.344 13.505 1.00 33.56 H new ATOM 0 HA2 GLY B 47 33.281 13.203 15.225 1.00 31.66 H new ATOM 0 HA3 GLY B 47 34.401 12.130 15.067 1.00 31.66 H new ATOM 1862 N PHE B 48 36.174 13.718 16.488 1.00 30.12 N ATOM 1863 CA PHE B 48 36.888 14.155 17.676 1.00 31.05 C ATOM 1864 C PHE B 48 36.379 15.502 18.139 1.00 33.67 C ATOM 1865 O PHE B 48 36.142 15.714 19.335 1.00 34.58 O ATOM 1866 CB PHE B 48 38.377 14.240 17.377 1.00 30.72 C ATOM 1867 CG PHE B 48 39.230 14.298 18.596 1.00 29.78 C ATOM 1868 CD1 PHE B 48 39.936 15.464 18.910 1.00 29.02 C ATOM 1869 CD2 PHE B 48 39.340 13.182 19.428 1.00 28.85 C ATOM 1870 CE1 PHE B 48 40.756 15.524 20.045 1.00 30.38 C ATOM 1871 CE2 PHE B 48 40.156 13.212 20.576 1.00 30.72 C ATOM 1872 CZ PHE B 48 40.872 14.395 20.887 1.00 31.01 C ATOM 0 H PHE B 48 36.670 13.597 15.796 1.00 30.12 H new ATOM 0 HA PHE B 48 36.737 13.509 18.384 1.00 31.05 H new ATOM 0 HB2 PHE B 48 38.637 13.470 16.847 1.00 30.72 H new ATOM 0 HB3 PHE B 48 38.546 15.027 16.836 1.00 30.72 H new ATOM 0 HD1 PHE B 48 39.860 16.209 18.359 1.00 29.02 H new ATOM 0 HD2 PHE B 48 38.868 12.408 19.221 1.00 28.85 H new ATOM 0 HE1 PHE B 48 41.222 16.304 20.243 1.00 30.38 H new ATOM 0 HE2 PHE B 48 40.224 12.464 21.124 1.00 30.72 H new ATOM 0 HZ PHE B 48 41.415 14.428 21.641 1.00 31.01 H new ATOM 1873 N GLN B 49 36.178 16.415 17.196 1.00 35.43 N ATOM 1874 CA GLN B 49 35.700 17.741 17.542 1.00 37.31 C ATOM 1875 C GLN B 49 34.303 17.687 18.128 1.00 38.97 C ATOM 1876 O GLN B 49 33.907 18.554 18.898 1.00 38.48 O ATOM 1877 CB GLN B 49 35.706 18.662 16.322 1.00 36.57 C ATOM 1878 CG GLN B 49 35.266 20.088 16.650 1.00 36.61 C ATOM 1879 CD GLN B 49 35.186 20.970 15.434 1.00 36.74 C ATOM 1880 OE1 GLN B 49 34.220 21.716 15.254 1.00 36.93 O ATOM 1881 NE2 GLN B 49 36.208 20.900 14.586 1.00 39.14 N ATOM 0 H GLN B 49 36.312 16.286 16.356 1.00 35.43 H new ATOM 0 HA GLN B 49 36.305 18.098 18.211 1.00 37.31 H new ATOM 0 HB2 GLN B 49 36.599 18.683 15.943 1.00 36.57 H new ATOM 0 HB3 GLN B 49 35.118 18.295 15.643 1.00 36.57 H new ATOM 0 HG2 GLN B 49 34.398 20.062 17.083 1.00 36.61 H new ATOM 0 HG3 GLN B 49 35.889 20.476 17.285 1.00 36.61 H new ATOM 0 HE21 GLN B 49 36.864 20.367 14.746 1.00 39.14 H new ATOM 0 HE22 GLN B 49 36.213 21.387 13.878 1.00 39.14 H new ATOM 1882 N LYS B 50 33.548 16.669 17.741 1.00 41.15 N ATOM 1883 CA LYS B 50 32.196 16.489 18.257 1.00 43.47 C ATOM 1884 C LYS B 50 32.293 16.343 19.779 1.00 43.54 C ATOM 1885 O LYS B 50 31.445 16.848 20.515 1.00 44.26 O ATOM 1886 CB LYS B 50 31.576 15.218 17.660 1.00 45.03 C ATOM 1887 CG LYS B 50 30.175 15.361 17.118 1.00 46.45 C ATOM 1888 CD LYS B 50 29.705 14.017 16.586 1.00 48.65 C ATOM 1889 CE LYS B 50 28.445 14.130 15.720 1.00 50.33 C ATOM 1890 NZ LYS B 50 27.219 14.582 16.461 1.00 51.94 N ATOM 0 H LYS B 50 33.799 16.069 17.179 1.00 41.15 H new ATOM 0 HA LYS B 50 31.640 17.247 18.019 1.00 43.47 H new ATOM 0 HB2 LYS B 50 32.151 14.904 16.944 1.00 45.03 H new ATOM 0 HB3 LYS B 50 31.571 14.529 18.343 1.00 45.03 H new ATOM 0 HG2 LYS B 50 29.577 15.672 17.816 1.00 46.45 H new ATOM 0 HG3 LYS B 50 30.156 16.025 16.411 1.00 46.45 H new ATOM 0 HD2 LYS B 50 30.416 13.614 16.064 1.00 48.65 H new ATOM 0 HD3 LYS B 50 29.528 13.422 17.332 1.00 48.65 H new ATOM 0 HE2 LYS B 50 28.619 14.751 14.996 1.00 50.33 H new ATOM 0 HE3 LYS B 50 28.265 13.267 15.316 1.00 50.33 H new ATOM 0 HZ1 LYS B 50 26.531 14.624 15.898 1.00 51.94 H new ATOM 0 HZ2 LYS B 50 27.035 14.003 17.112 1.00 51.94 H new ATOM 0 HZ3 LYS B 50 27.364 15.387 16.813 1.00 51.94 H new ATOM 1891 N ILE B 51 33.330 15.651 20.249 1.00 43.91 N ATOM 1892 CA ILE B 51 33.517 15.441 21.691 1.00 43.43 C ATOM 1893 C ILE B 51 33.678 16.758 22.449 1.00 43.58 C ATOM 1894 O ILE B 51 33.074 16.967 23.507 1.00 43.45 O ATOM 1895 CB ILE B 51 34.752 14.573 21.972 1.00 43.88 C ATOM 1896 CG1 ILE B 51 34.643 13.263 21.203 1.00 43.97 C ATOM 1897 CG2 ILE B 51 34.875 14.303 23.477 1.00 44.37 C ATOM 1898 CD1 ILE B 51 35.884 12.368 21.345 1.00 44.56 C ATOM 0 H ILE B 51 33.936 15.295 19.754 1.00 43.91 H new ATOM 0 HA ILE B 51 32.716 14.991 22.001 1.00 43.43 H new ATOM 0 HB ILE B 51 35.548 15.044 21.679 1.00 43.88 H new ATOM 0 HG12 ILE B 51 33.864 12.776 21.515 1.00 43.97 H new ATOM 0 HG13 ILE B 51 34.499 13.458 20.264 1.00 43.97 H new ATOM 0 HG21 ILE B 51 35.657 13.754 23.645 1.00 44.37 H new ATOM 0 HG22 ILE B 51 34.963 15.145 23.951 1.00 44.37 H new ATOM 0 HG23 ILE B 51 34.082 13.839 23.789 1.00 44.37 H new ATOM 0 HD11 ILE B 51 35.755 11.553 20.836 1.00 44.56 H new ATOM 0 HD12 ILE B 51 36.663 12.839 21.009 1.00 44.56 H new ATOM 0 HD13 ILE B 51 36.018 12.147 22.280 1.00 44.56 H new ATOM 1899 N TYR B 52 34.508 17.649 21.919 1.00 42.86 N ATOM 1900 CA TYR B 52 34.706 18.930 22.577 1.00 43.05 C ATOM 1901 C TYR B 52 33.465 19.802 22.567 1.00 44.29 C ATOM 1902 O TYR B 52 33.139 20.399 23.591 1.00 44.67 O ATOM 1903 CB TYR B 52 35.890 19.684 21.961 1.00 41.73 C ATOM 1904 CG TYR B 52 37.211 19.224 22.509 1.00 39.22 C ATOM 1905 CD1 TYR B 52 37.980 18.278 21.835 1.00 39.49 C ATOM 1906 CD2 TYR B 52 37.666 19.694 23.734 1.00 38.23 C ATOM 1907 CE1 TYR B 52 39.184 17.809 22.372 1.00 38.44 C ATOM 1908 CE2 TYR B 52 38.851 19.241 24.282 1.00 38.04 C ATOM 1909 CZ TYR B 52 39.612 18.299 23.600 1.00 38.11 C ATOM 1910 OH TYR B 52 40.796 17.865 24.146 1.00 37.12 O ATOM 0 H TYR B 52 34.957 17.534 21.194 1.00 42.86 H new ATOM 0 HA TYR B 52 34.902 18.730 23.506 1.00 43.05 H new ATOM 0 HB2 TYR B 52 35.882 19.562 20.999 1.00 41.73 H new ATOM 0 HB3 TYR B 52 35.787 20.634 22.128 1.00 41.73 H new ATOM 0 HD1 TYR B 52 37.688 17.953 21.014 1.00 39.49 H new ATOM 0 HD2 TYR B 52 37.163 20.326 24.195 1.00 38.23 H new ATOM 0 HE1 TYR B 52 39.691 17.178 21.914 1.00 38.44 H new ATOM 0 HE2 TYR B 52 39.138 19.566 25.105 1.00 38.04 H new ATOM 0 HH TYR B 52 40.921 18.247 24.884 1.00 37.12 H new ATOM 1911 N LYS B 53 32.761 19.873 21.437 1.00 46.22 N ATOM 1912 CA LYS B 53 31.545 20.702 21.359 1.00 48.63 C ATOM 1913 C LYS B 53 30.586 20.328 22.475 1.00 49.47 C ATOM 1914 O LYS B 53 29.878 21.180 23.012 1.00 49.79 O ATOM 1915 CB LYS B 53 30.786 20.504 20.033 1.00 49.26 C ATOM 1916 CG LYS B 53 31.647 20.333 18.799 1.00 51.59 C ATOM 1917 CD LYS B 53 30.827 19.757 17.635 1.00 51.41 C ATOM 1918 CE LYS B 53 31.722 19.343 16.464 1.00 50.89 C ATOM 1919 NZ LYS B 53 31.067 18.318 15.592 1.00 50.88 N ATOM 0 H LYS B 53 32.962 19.457 20.712 1.00 46.22 H new ATOM 0 HA LYS B 53 31.839 21.624 21.430 1.00 48.63 H new ATOM 0 HB2 LYS B 53 30.216 19.724 20.120 1.00 49.26 H new ATOM 0 HB3 LYS B 53 30.203 21.267 19.897 1.00 49.26 H new ATOM 0 HG2 LYS B 53 32.024 21.189 18.542 1.00 51.59 H new ATOM 0 HG3 LYS B 53 32.391 19.744 18.998 1.00 51.59 H new ATOM 0 HD2 LYS B 53 30.321 18.989 17.944 1.00 51.41 H new ATOM 0 HD3 LYS B 53 30.184 20.418 17.334 1.00 51.41 H new ATOM 0 HE2 LYS B 53 31.941 20.125 15.934 1.00 50.89 H new ATOM 0 HE3 LYS B 53 32.558 18.989 16.806 1.00 50.89 H new ATOM 0 HZ1 LYS B 53 31.515 17.551 15.647 1.00 50.88 H new ATOM 0 HZ2 LYS B 53 30.228 18.191 15.862 1.00 50.88 H new ATOM 0 HZ3 LYS B 53 31.067 18.602 14.748 1.00 50.88 H new ATOM 1920 N GLN B 54 30.550 19.042 22.803 1.00 50.93 N ATOM 1921 CA GLN B 54 29.650 18.553 23.831 1.00 52.77 C ATOM 1922 C GLN B 54 29.991 19.050 25.237 1.00 52.78 C ATOM 1923 O GLN B 54 29.107 19.150 26.088 1.00 52.95 O ATOM 1924 CB GLN B 54 29.593 17.020 23.785 1.00 54.22 C ATOM 1925 CG GLN B 54 29.386 16.481 22.363 1.00 56.47 C ATOM 1926 CD GLN B 54 28.987 15.008 22.312 1.00 57.98 C ATOM 1927 OE1 GLN B 54 29.575 14.156 22.993 1.00 58.37 O ATOM 1928 NE2 GLN B 54 27.984 14.701 21.486 1.00 57.93 N ATOM 0 H GLN B 54 31.041 18.437 22.439 1.00 50.93 H new ATOM 0 HA GLN B 54 28.774 18.919 23.634 1.00 52.77 H new ATOM 0 HB2 GLN B 54 30.416 16.658 24.148 1.00 54.22 H new ATOM 0 HB3 GLN B 54 28.871 16.709 24.354 1.00 54.22 H new ATOM 0 HG2 GLN B 54 28.701 17.008 21.923 1.00 56.47 H new ATOM 0 HG3 GLN B 54 30.205 16.603 21.858 1.00 56.47 H new ATOM 0 HE21 GLN B 54 27.599 15.319 21.029 1.00 57.93 H new ATOM 0 HE22 GLN B 54 27.723 13.885 21.411 1.00 57.93 H new ATOM 1929 N PHE B 55 31.261 19.364 25.481 1.00 52.93 N ATOM 1930 CA PHE B 55 31.679 19.877 26.793 1.00 52.49 C ATOM 1931 C PHE B 55 31.737 21.406 26.767 1.00 50.71 C ATOM 1932 O PHE B 55 31.514 22.062 27.785 1.00 50.68 O ATOM 1933 CB PHE B 55 33.055 19.322 27.183 1.00 54.50 C ATOM 1934 CG PHE B 55 33.056 17.848 27.477 1.00 57.31 C ATOM 1935 CD1 PHE B 55 32.884 16.914 26.449 1.00 58.27 C ATOM 1936 CD2 PHE B 55 33.213 17.386 28.792 1.00 58.08 C ATOM 1937 CE1 PHE B 55 32.868 15.528 26.722 1.00 59.43 C ATOM 1938 CE2 PHE B 55 33.200 16.009 29.083 1.00 58.88 C ATOM 1939 CZ PHE B 55 33.027 15.075 28.046 1.00 59.40 C ATOM 0 H PHE B 55 31.896 19.289 24.906 1.00 52.93 H new ATOM 0 HA PHE B 55 31.027 19.588 27.450 1.00 52.49 H new ATOM 0 HB2 PHE B 55 33.681 19.500 26.464 1.00 54.50 H new ATOM 0 HB3 PHE B 55 33.377 19.799 27.964 1.00 54.50 H new ATOM 0 HD1 PHE B 55 32.779 17.210 25.574 1.00 58.27 H new ATOM 0 HD2 PHE B 55 33.327 17.999 29.482 1.00 58.08 H new ATOM 0 HE1 PHE B 55 32.753 14.917 26.030 1.00 59.43 H new ATOM 0 HE2 PHE B 55 33.306 15.717 29.960 1.00 58.88 H new ATOM 0 HZ PHE B 55 33.018 14.164 28.233 1.00 59.40 H new ATOM 1940 N PHE B 56 32.036 21.962 25.593 1.00 48.46 N ATOM 1941 CA PHE B 56 32.134 23.410 25.401 1.00 46.52 C ATOM 1942 C PHE B 56 31.148 23.770 24.298 1.00 46.35 C ATOM 1943 O PHE B 56 31.497 23.881 23.117 1.00 44.66 O ATOM 1944 CB PHE B 56 33.568 23.768 25.024 1.00 45.27 C ATOM 1945 CG PHE B 56 34.570 23.299 26.031 1.00 43.60 C ATOM 1946 CD1 PHE B 56 34.748 23.988 27.219 1.00 44.27 C ATOM 1947 CD2 PHE B 56 35.286 22.130 25.826 1.00 43.13 C ATOM 1948 CE1 PHE B 56 35.635 23.513 28.201 1.00 43.50 C ATOM 1949 CE2 PHE B 56 36.166 21.645 26.784 1.00 42.15 C ATOM 1950 CZ PHE B 56 36.342 22.339 27.978 1.00 43.33 C ATOM 0 H PHE B 56 32.189 21.506 24.880 1.00 48.46 H new ATOM 0 HA PHE B 56 31.918 23.906 26.206 1.00 46.52 H new ATOM 0 HB2 PHE B 56 33.777 23.378 24.161 1.00 45.27 H new ATOM 0 HB3 PHE B 56 33.641 24.730 24.926 1.00 45.27 H new ATOM 0 HD1 PHE B 56 34.275 24.775 27.369 1.00 44.27 H new ATOM 0 HD2 PHE B 56 35.175 21.661 25.031 1.00 43.13 H new ATOM 0 HE1 PHE B 56 35.748 23.983 28.996 1.00 43.50 H new ATOM 0 HE2 PHE B 56 36.637 20.858 26.628 1.00 42.15 H new ATOM 0 HZ PHE B 56 36.930 22.018 28.623 1.00 43.33 H new ATOM 1951 N PRO B 57 29.882 23.956 24.690 1.00 46.68 N ATOM 1952 CA PRO B 57 28.779 24.287 23.796 1.00 46.90 C ATOM 1953 C PRO B 57 28.666 25.729 23.358 1.00 46.75 C ATOM 1954 O PRO B 57 27.929 26.018 22.413 1.00 47.97 O ATOM 1955 CB PRO B 57 27.568 23.868 24.611 1.00 46.77 C ATOM 1956 CG PRO B 57 27.963 24.378 25.961 1.00 47.10 C ATOM 1957 CD PRO B 57 29.399 23.883 26.084 1.00 46.52 C ATOM 0 HA PRO B 57 28.894 23.840 22.943 1.00 46.90 H new ATOM 0 HB2 PRO B 57 26.748 24.273 24.289 1.00 46.77 H new ATOM 0 HB3 PRO B 57 27.432 22.908 24.604 1.00 46.77 H new ATOM 0 HG2 PRO B 57 27.907 25.345 26.014 1.00 47.10 H new ATOM 0 HG3 PRO B 57 27.396 24.023 26.663 1.00 47.10 H new ATOM 0 HD2 PRO B 57 29.924 24.442 26.678 1.00 46.52 H new ATOM 0 HD3 PRO B 57 29.441 22.979 26.434 1.00 46.52 H new ATOM 1958 N PHE B 58 29.393 26.630 24.009 1.00 46.02 N ATOM 1959 CA PHE B 58 29.256 28.041 23.674 1.00 45.65 C ATOM 1960 C PHE B 58 30.260 28.743 22.783 1.00 43.73 C ATOM 1961 O PHE B 58 30.025 29.890 22.406 1.00 44.54 O ATOM 1962 CB PHE B 58 29.094 28.850 24.963 1.00 47.71 C ATOM 1963 CG PHE B 58 28.005 28.333 25.852 1.00 50.61 C ATOM 1964 CD1 PHE B 58 28.314 27.626 27.010 1.00 51.76 C ATOM 1965 CD2 PHE B 58 26.669 28.534 25.519 1.00 51.01 C ATOM 1966 CE1 PHE B 58 27.301 27.125 27.830 1.00 53.23 C ATOM 1967 CE2 PHE B 58 25.647 28.037 26.330 1.00 52.74 C ATOM 1968 CZ PHE B 58 25.962 27.331 27.489 1.00 52.61 C ATOM 0 H PHE B 58 29.958 26.452 24.633 1.00 46.02 H new ATOM 0 HA PHE B 58 28.478 28.013 23.095 1.00 45.65 H new ATOM 0 HB2 PHE B 58 29.933 28.842 25.451 1.00 47.71 H new ATOM 0 HB3 PHE B 58 28.907 29.774 24.736 1.00 47.71 H new ATOM 0 HD1 PHE B 58 29.204 27.486 27.240 1.00 51.76 H new ATOM 0 HD2 PHE B 58 26.454 29.005 24.747 1.00 51.01 H new ATOM 0 HE1 PHE B 58 27.517 26.655 28.602 1.00 53.23 H new ATOM 0 HE2 PHE B 58 24.758 28.177 26.097 1.00 52.74 H new ATOM 0 HZ PHE B 58 25.285 26.999 28.033 1.00 52.61 H new ATOM 1969 N GLY B 59 31.363 28.092 22.435 1.00 41.06 N ATOM 1970 CA GLY B 59 32.330 28.757 21.584 1.00 37.59 C ATOM 1971 C GLY B 59 32.596 27.952 20.336 1.00 34.51 C ATOM 1972 O GLY B 59 31.714 27.233 19.865 1.00 35.75 O ATOM 0 H GLY B 59 31.564 27.290 22.673 1.00 41.06 H new ATOM 0 HA2 GLY B 59 32.001 29.637 21.341 1.00 37.59 H new ATOM 0 HA3 GLY B 59 33.159 28.888 22.071 1.00 37.59 H new ATOM 1973 N ASP B 60 33.812 28.049 19.814 1.00 31.00 N ATOM 1974 CA ASP B 60 34.205 27.311 18.619 1.00 28.32 C ATOM 1975 C ASP B 60 35.440 26.458 18.984 1.00 27.56 C ATOM 1976 O ASP B 60 36.553 26.967 19.018 1.00 27.81 O ATOM 1977 CB ASP B 60 34.546 28.290 17.482 1.00 25.74 C ATOM 1978 CG ASP B 60 34.790 27.575 16.165 1.00 26.75 C ATOM 1979 OD1 ASP B 60 34.845 26.329 16.199 1.00 27.16 O ATOM 1980 OD2 ASP B 60 34.930 28.236 15.101 1.00 24.81 O ATOM 0 H ASP B 60 34.434 28.545 20.142 1.00 31.00 H new ATOM 0 HA ASP B 60 33.481 26.742 18.314 1.00 28.32 H new ATOM 0 HB2 ASP B 60 33.820 28.924 17.374 1.00 25.74 H new ATOM 0 HB3 ASP B 60 35.335 28.800 17.722 1.00 25.74 H new ATOM 1981 N PRO B 61 35.258 25.135 19.186 1.00 26.62 N ATOM 1982 CA PRO B 61 36.312 24.190 19.564 1.00 26.28 C ATOM 1983 C PRO B 61 37.223 23.738 18.444 1.00 24.77 C ATOM 1984 O PRO B 61 38.155 22.977 18.667 1.00 24.36 O ATOM 1985 CB PRO B 61 35.515 23.019 20.113 1.00 27.98 C ATOM 1986 CG PRO B 61 34.442 22.913 19.047 1.00 29.69 C ATOM 1987 CD PRO B 61 34.024 24.396 18.845 1.00 27.89 C ATOM 0 HA PRO B 61 36.935 24.602 20.182 1.00 26.28 H new ATOM 0 HB2 PRO B 61 36.046 22.211 20.187 1.00 27.98 H new ATOM 0 HB3 PRO B 61 35.148 23.199 20.993 1.00 27.98 H new ATOM 0 HG2 PRO B 61 34.783 22.519 18.229 1.00 29.69 H new ATOM 0 HG3 PRO B 61 33.697 22.364 19.337 1.00 29.69 H new ATOM 0 HD2 PRO B 61 33.741 24.569 17.933 1.00 27.89 H new ATOM 0 HD3 PRO B 61 33.285 24.643 19.423 1.00 27.89 H new ATOM 1988 N THR B 62 36.968 24.222 17.231 1.00 23.34 N ATOM 1989 CA THR B 62 37.740 23.777 16.071 1.00 19.49 C ATOM 1990 C THR B 62 39.261 23.842 16.218 1.00 18.45 C ATOM 1991 O THR B 62 39.969 22.867 15.981 1.00 18.28 O ATOM 1992 CB THR B 62 37.327 24.601 14.767 1.00 20.73 C ATOM 1993 OG1 THR B 62 35.916 24.547 14.593 1.00 23.84 O ATOM 1994 CG2 THR B 62 38.002 24.075 13.544 1.00 21.97 C ATOM 0 H THR B 62 36.358 24.803 17.058 1.00 23.34 H new ATOM 0 HA THR B 62 37.513 22.837 15.992 1.00 19.49 H new ATOM 0 HB THR B 62 37.612 25.520 14.894 1.00 20.73 H new ATOM 0 HG1 THR B 62 35.550 25.118 15.089 1.00 23.84 H new ATOM 0 HG21 THR B 62 37.729 24.597 12.774 1.00 21.97 H new ATOM 0 HG22 THR B 62 38.964 24.138 13.653 1.00 21.97 H new ATOM 0 HG23 THR B 62 37.752 23.147 13.410 1.00 21.97 H new ATOM 1995 N LYS B 63 39.787 24.984 16.644 1.00 17.54 N ATOM 1996 CA LYS B 63 41.213 25.106 16.717 1.00 18.06 C ATOM 1997 C LYS B 63 41.851 24.227 17.795 1.00 17.99 C ATOM 1998 O LYS B 63 42.861 23.579 17.531 1.00 17.50 O ATOM 1999 CB LYS B 63 41.589 26.596 16.901 1.00 21.27 C ATOM 2000 CG LYS B 63 43.088 26.949 16.807 1.00 21.18 C ATOM 2001 CD LYS B 63 43.213 28.482 16.993 1.00 24.10 C ATOM 2002 CE LYS B 63 44.638 28.977 17.172 1.00 23.96 C ATOM 2003 NZ LYS B 63 44.576 30.437 17.372 1.00 24.65 N ATOM 0 H LYS B 63 39.340 25.677 16.887 1.00 17.54 H new ATOM 0 HA LYS B 63 41.576 24.777 15.880 1.00 18.06 H new ATOM 0 HB2 LYS B 63 41.114 27.113 16.232 1.00 21.27 H new ATOM 0 HB3 LYS B 63 41.263 26.886 17.768 1.00 21.27 H new ATOM 0 HG2 LYS B 63 43.593 26.479 17.489 1.00 21.18 H new ATOM 0 HG3 LYS B 63 43.450 26.678 15.949 1.00 21.18 H new ATOM 0 HD2 LYS B 63 42.823 28.923 16.222 1.00 24.10 H new ATOM 0 HD3 LYS B 63 42.690 28.747 17.766 1.00 24.10 H new ATOM 0 HE2 LYS B 63 45.056 28.545 17.933 1.00 23.96 H new ATOM 0 HE3 LYS B 63 45.175 28.761 16.393 1.00 23.96 H new ATOM 0 HZ1 LYS B 63 45.354 30.726 17.692 1.00 24.65 H new ATOM 0 HZ2 LYS B 63 44.409 30.837 16.595 1.00 24.65 H new ATOM 0 HZ3 LYS B 63 43.927 30.630 17.950 1.00 24.65 H new ATOM 2004 N PHE B 64 41.245 24.182 18.981 1.00 19.17 N ATOM 2005 CA PHE B 64 41.821 23.385 20.064 1.00 18.48 C ATOM 2006 C PHE B 64 41.642 21.912 19.803 1.00 18.59 C ATOM 2007 O PHE B 64 42.575 21.153 20.009 1.00 19.90 O ATOM 2008 CB PHE B 64 41.201 23.722 21.413 1.00 21.38 C ATOM 2009 CG PHE B 64 41.954 23.098 22.576 1.00 21.28 C ATOM 2010 CD1 PHE B 64 43.281 23.477 22.831 1.00 22.23 C ATOM 2011 CD2 PHE B 64 41.351 22.155 23.398 1.00 21.03 C ATOM 2012 CE1 PHE B 64 44.015 22.921 23.918 1.00 23.60 C ATOM 2013 CE2 PHE B 64 42.054 21.587 24.487 1.00 21.77 C ATOM 2014 CZ PHE B 64 43.393 21.975 24.747 1.00 24.52 C ATOM 0 H PHE B 64 40.517 24.595 19.177 1.00 19.17 H new ATOM 0 HA PHE B 64 42.766 23.602 20.092 1.00 18.48 H new ATOM 0 HB2 PHE B 64 41.182 24.685 21.524 1.00 21.38 H new ATOM 0 HB3 PHE B 64 40.280 23.416 21.427 1.00 21.38 H new ATOM 0 HD1 PHE B 64 43.690 24.104 22.279 1.00 22.23 H new ATOM 0 HD2 PHE B 64 40.474 21.894 23.231 1.00 21.03 H new ATOM 0 HE1 PHE B 64 44.894 23.181 24.076 1.00 23.60 H new ATOM 0 HE2 PHE B 64 41.638 20.959 25.032 1.00 21.77 H new ATOM 0 HZ PHE B 64 43.856 21.604 25.463 1.00 24.52 H new ATOM 2015 N ALA B 65 40.455 21.504 19.360 1.00 19.47 N ATOM 2016 CA ALA B 65 40.209 20.103 19.061 1.00 22.04 C ATOM 2017 C ALA B 65 41.244 19.624 18.051 1.00 23.23 C ATOM 2018 O ALA B 65 41.798 18.539 18.215 1.00 23.22 O ATOM 2019 CB ALA B 65 38.754 19.896 18.514 1.00 24.41 C ATOM 0 H ALA B 65 39.783 22.024 19.227 1.00 19.47 H new ATOM 0 HA ALA B 65 40.289 19.581 19.875 1.00 22.04 H new ATOM 0 HB1 ALA B 65 38.611 18.956 18.321 1.00 24.41 H new ATOM 0 HB2 ALA B 65 38.113 20.190 19.180 1.00 24.41 H new ATOM 0 HB3 ALA B 65 38.637 20.414 17.702 1.00 24.41 H new ATOM 2020 N THR B 66 41.556 20.428 17.024 1.00 22.94 N ATOM 2021 CA THR B 66 42.567 20.007 16.058 1.00 22.30 C ATOM 2022 C THR B 66 43.961 19.918 16.694 1.00 22.99 C ATOM 2023 O THR B 66 44.776 19.033 16.338 1.00 22.87 O ATOM 2024 CB THR B 66 42.641 20.956 14.799 1.00 25.34 C ATOM 2025 OG1 THR B 66 41.458 20.796 14.014 1.00 25.47 O ATOM 2026 CG2 THR B 66 43.847 20.615 13.899 1.00 25.06 C ATOM 0 H THR B 66 41.203 21.198 16.876 1.00 22.94 H new ATOM 0 HA THR B 66 42.289 19.126 15.763 1.00 22.30 H new ATOM 0 HB THR B 66 42.732 21.865 15.125 1.00 25.34 H new ATOM 0 HG1 THR B 66 40.883 21.359 14.256 1.00 25.47 H new ATOM 0 HG21 THR B 66 43.862 21.215 13.137 1.00 25.06 H new ATOM 0 HG22 THR B 66 44.668 20.715 14.406 1.00 25.06 H new ATOM 0 HG23 THR B 66 43.770 19.700 13.587 1.00 25.06 H new ATOM 2027 N PHE B 67 44.283 20.804 17.627 1.00 20.41 N ATOM 2028 CA PHE B 67 45.611 20.697 18.241 1.00 21.87 C ATOM 2029 C PHE B 67 45.748 19.376 19.039 1.00 19.61 C ATOM 2030 O PHE B 67 46.786 18.718 19.008 1.00 20.71 O ATOM 2031 CB PHE B 67 45.872 21.889 19.191 1.00 22.43 C ATOM 2032 CG PHE B 67 46.215 23.169 18.489 1.00 23.69 C ATOM 2033 CD1 PHE B 67 45.603 24.362 18.865 1.00 26.08 C ATOM 2034 CD2 PHE B 67 47.181 23.196 17.498 1.00 25.67 C ATOM 2035 CE1 PHE B 67 45.968 25.590 18.246 1.00 26.34 C ATOM 2036 CE2 PHE B 67 47.555 24.395 16.879 1.00 27.15 C ATOM 2037 CZ PHE B 67 46.941 25.599 17.262 1.00 26.90 C ATOM 0 H PHE B 67 43.783 21.443 17.911 1.00 20.41 H new ATOM 0 HA PHE B 67 46.265 20.706 17.524 1.00 21.87 H new ATOM 0 HB2 PHE B 67 45.084 22.033 19.738 1.00 22.43 H new ATOM 0 HB3 PHE B 67 46.597 21.658 19.793 1.00 22.43 H new ATOM 0 HD1 PHE B 67 44.950 24.356 19.527 1.00 26.08 H new ATOM 0 HD2 PHE B 67 47.590 22.402 17.238 1.00 25.67 H new ATOM 0 HE1 PHE B 67 45.555 26.383 18.501 1.00 26.34 H new ATOM 0 HE2 PHE B 67 48.208 24.394 16.217 1.00 27.15 H new ATOM 0 HZ PHE B 67 47.187 26.399 16.856 1.00 26.90 H new ATOM 2038 N VAL B 68 44.682 18.994 19.714 1.00 19.30 N ATOM 2039 CA VAL B 68 44.689 17.790 20.556 1.00 18.79 C ATOM 2040 C VAL B 68 44.598 16.547 19.667 1.00 20.39 C ATOM 2041 O VAL B 68 45.295 15.527 19.892 1.00 21.26 O ATOM 2042 CB VAL B 68 43.508 17.862 21.541 1.00 18.10 C ATOM 2043 CG1 VAL B 68 43.405 16.543 22.344 1.00 21.18 C ATOM 2044 CG2 VAL B 68 43.726 19.074 22.513 1.00 17.79 C ATOM 0 H VAL B 68 43.932 19.415 19.705 1.00 19.30 H new ATOM 0 HA VAL B 68 45.513 17.736 21.065 1.00 18.79 H new ATOM 0 HB VAL B 68 42.681 17.987 21.050 1.00 18.10 H new ATOM 0 HG11 VAL B 68 42.659 16.597 22.962 1.00 21.18 H new ATOM 0 HG12 VAL B 68 43.266 15.802 21.733 1.00 21.18 H new ATOM 0 HG13 VAL B 68 44.226 16.402 22.841 1.00 21.18 H new ATOM 0 HG21 VAL B 68 42.985 19.126 23.137 1.00 17.79 H new ATOM 0 HG22 VAL B 68 44.554 18.951 23.004 1.00 17.79 H new ATOM 0 HG23 VAL B 68 43.774 19.896 22.000 1.00 17.79 H new ATOM 2045 N PHE B 69 43.794 16.648 18.612 1.00 19.93 N ATOM 2046 CA PHE B 69 43.642 15.505 17.684 1.00 21.15 C ATOM 2047 C PHE B 69 44.993 15.119 17.174 1.00 22.53 C ATOM 2048 O PHE B 69 45.331 13.929 17.128 1.00 24.31 O ATOM 2049 CB PHE B 69 42.737 15.860 16.498 1.00 22.38 C ATOM 2050 CG PHE B 69 42.574 14.739 15.492 1.00 21.84 C ATOM 2051 CD1 PHE B 69 43.571 14.474 14.552 1.00 24.18 C ATOM 2052 CD2 PHE B 69 41.431 13.950 15.505 1.00 24.28 C ATOM 2053 CE1 PHE B 69 43.429 13.419 13.622 1.00 26.21 C ATOM 2054 CE2 PHE B 69 41.259 12.883 14.583 1.00 23.94 C ATOM 2055 CZ PHE B 69 42.253 12.623 13.650 1.00 27.03 C ATOM 0 H PHE B 69 43.334 17.346 18.411 1.00 19.93 H new ATOM 0 HA PHE B 69 43.231 14.770 18.165 1.00 21.15 H new ATOM 0 HB2 PHE B 69 41.862 16.111 16.834 1.00 22.38 H new ATOM 0 HB3 PHE B 69 43.101 16.637 16.046 1.00 22.38 H new ATOM 0 HD1 PHE B 69 44.339 14.998 14.537 1.00 24.18 H new ATOM 0 HD2 PHE B 69 40.765 14.124 16.130 1.00 24.28 H new ATOM 0 HE1 PHE B 69 44.098 13.248 12.999 1.00 26.21 H new ATOM 0 HE2 PHE B 69 40.488 12.364 14.604 1.00 23.94 H new ATOM 0 HZ PHE B 69 42.149 11.927 13.042 1.00 27.03 H new ATOM 2056 N ASN B 70 45.791 16.108 16.802 1.00 22.00 N ATOM 2057 CA ASN B 70 47.090 15.803 16.277 1.00 24.58 C ATOM 2058 C ASN B 70 48.092 15.183 17.269 1.00 25.84 C ATOM 2059 O ASN B 70 49.017 14.518 16.832 1.00 26.93 O ATOM 2060 CB ASN B 70 47.660 17.028 15.552 1.00 26.73 C ATOM 2061 CG ASN B 70 46.913 17.343 14.226 1.00 26.41 C ATOM 2062 OD1 ASN B 70 46.146 16.509 13.683 1.00 26.55 O ATOM 2063 ND2 ASN B 70 47.147 18.542 13.698 1.00 24.77 N ATOM 0 H ASN B 70 45.597 16.945 16.847 1.00 22.00 H new ATOM 0 HA ASN B 70 46.952 15.083 15.642 1.00 24.58 H new ATOM 0 HB2 ASN B 70 47.609 17.799 16.139 1.00 26.73 H new ATOM 0 HB3 ASN B 70 48.599 16.878 15.362 1.00 26.73 H new ATOM 0 HD21 ASN B 70 46.768 18.768 12.960 1.00 24.77 H new ATOM 0 HD22 ASN B 70 47.678 19.090 14.095 1.00 24.77 H new ATOM 2064 N VAL B 71 47.894 15.356 18.578 1.00 24.94 N ATOM 2065 CA VAL B 71 48.783 14.710 19.548 1.00 26.40 C ATOM 2066 C VAL B 71 48.297 13.247 19.741 1.00 25.23 C ATOM 2067 O VAL B 71 49.101 12.317 19.860 1.00 26.67 O ATOM 2068 CB VAL B 71 48.773 15.475 20.866 1.00 27.35 C ATOM 2069 CG1 VAL B 71 49.610 14.742 21.892 1.00 27.15 C ATOM 2070 CG2 VAL B 71 49.324 16.893 20.604 1.00 27.80 C ATOM 0 H VAL B 71 47.265 15.833 18.920 1.00 24.94 H new ATOM 0 HA VAL B 71 49.698 14.709 19.225 1.00 26.40 H new ATOM 0 HB VAL B 71 47.871 15.542 21.217 1.00 27.35 H new ATOM 0 HG11 VAL B 71 49.600 15.233 22.728 1.00 27.15 H new ATOM 0 HG12 VAL B 71 49.244 13.855 22.034 1.00 27.15 H new ATOM 0 HG13 VAL B 71 50.523 14.668 21.572 1.00 27.15 H new ATOM 0 HG21 VAL B 71 49.326 17.398 21.432 1.00 27.80 H new ATOM 0 HG22 VAL B 71 50.229 16.830 20.262 1.00 27.80 H new ATOM 0 HG23 VAL B 71 48.763 17.343 19.953 1.00 27.80 H new ATOM 2071 N PHE B 72 46.986 13.054 19.738 1.00 23.25 N ATOM 2072 CA PHE B 72 46.401 11.728 19.858 1.00 23.25 C ATOM 2073 C PHE B 72 46.852 10.910 18.634 1.00 24.39 C ATOM 2074 O PHE B 72 47.255 9.768 18.748 1.00 22.47 O ATOM 2075 CB PHE B 72 44.888 11.804 19.835 1.00 22.17 C ATOM 2076 CG PHE B 72 44.240 11.876 21.202 1.00 23.28 C ATOM 2077 CD1 PHE B 72 44.394 12.998 22.009 1.00 22.63 C ATOM 2078 CD2 PHE B 72 43.404 10.848 21.641 1.00 23.04 C ATOM 2079 CE1 PHE B 72 43.718 13.103 23.219 1.00 20.72 C ATOM 2080 CE2 PHE B 72 42.716 10.935 22.864 1.00 22.23 C ATOM 2081 CZ PHE B 72 42.872 12.078 23.658 1.00 21.60 C ATOM 0 H PHE B 72 46.410 13.689 19.666 1.00 23.25 H new ATOM 0 HA PHE B 72 46.685 11.325 20.693 1.00 23.25 H new ATOM 0 HB2 PHE B 72 44.623 12.584 19.323 1.00 22.17 H new ATOM 0 HB3 PHE B 72 44.544 11.027 19.367 1.00 22.17 H new ATOM 0 HD1 PHE B 72 44.956 13.687 21.736 1.00 22.63 H new ATOM 0 HD2 PHE B 72 43.300 10.089 21.113 1.00 23.04 H new ATOM 0 HE1 PHE B 72 43.829 13.863 23.743 1.00 20.72 H new ATOM 0 HE2 PHE B 72 42.163 10.241 23.143 1.00 22.23 H new ATOM 0 HZ PHE B 72 42.419 12.155 24.467 1.00 21.60 H new ATOM 2082 N ASP B 73 46.796 11.525 17.453 1.00 24.71 N ATOM 2083 CA ASP B 73 47.193 10.854 16.208 1.00 26.72 C ATOM 2084 C ASP B 73 48.715 10.705 16.164 1.00 29.94 C ATOM 2085 O ASP B 73 49.396 11.407 15.397 1.00 29.65 O ATOM 2086 CB ASP B 73 46.676 11.674 14.995 1.00 25.50 C ATOM 2087 CG ASP B 73 46.825 10.931 13.654 1.00 26.46 C ATOM 2088 OD1 ASP B 73 46.903 9.684 13.642 1.00 22.98 O ATOM 2089 OD2 ASP B 73 46.853 11.598 12.590 1.00 26.41 O ATOM 0 H ASP B 73 46.530 12.336 17.348 1.00 24.71 H new ATOM 0 HA ASP B 73 46.802 9.967 16.170 1.00 26.72 H new ATOM 0 HB2 ASP B 73 45.741 11.893 15.135 1.00 25.50 H new ATOM 0 HB3 ASP B 73 47.160 12.513 14.949 1.00 25.50 H new ATOM 2090 N GLU B 74 49.244 9.763 16.958 1.00 32.47 N ATOM 2091 CA GLU B 74 50.684 9.566 17.066 1.00 35.46 C ATOM 2092 C GLU B 74 51.390 9.277 15.753 1.00 36.33 C ATOM 2093 O GLU B 74 52.535 9.706 15.557 1.00 37.36 O ATOM 2094 CB GLU B 74 51.004 8.452 18.068 1.00 38.17 C ATOM 2095 CG GLU B 74 52.201 8.784 18.963 1.00 44.02 C ATOM 2096 CD GLU B 74 52.807 7.551 19.625 1.00 47.31 C ATOM 2097 OE1 GLU B 74 52.041 6.754 20.222 1.00 48.80 O ATOM 2098 OE2 GLU B 74 54.053 7.385 19.554 1.00 49.61 O ATOM 0 H GLU B 74 48.777 9.228 17.443 1.00 32.47 H new ATOM 0 HA GLU B 74 51.027 10.419 17.376 1.00 35.46 H new ATOM 0 HB2 GLU B 74 50.226 8.289 18.623 1.00 38.17 H new ATOM 0 HB3 GLU B 74 51.185 7.630 17.585 1.00 38.17 H new ATOM 0 HG2 GLU B 74 52.881 9.229 18.434 1.00 44.02 H new ATOM 0 HG3 GLU B 74 51.922 9.410 19.650 1.00 44.02 H new ATOM 2099 N ASN B 75 50.724 8.562 14.851 1.00 36.03 N ATOM 2100 CA ASN B 75 51.337 8.238 13.566 1.00 36.17 C ATOM 2101 C ASN B 75 50.960 9.196 12.452 1.00 37.05 C ATOM 2102 O ASN B 75 51.181 8.905 11.278 1.00 36.94 O ATOM 2103 CB ASN B 75 51.038 6.787 13.130 1.00 35.88 C ATOM 2104 CG ASN B 75 49.562 6.549 12.764 1.00 35.53 C ATOM 2105 OD1 ASN B 75 48.702 7.408 12.963 1.00 34.79 O ATOM 2106 ND2 ASN B 75 49.272 5.357 12.230 1.00 34.08 N ATOM 0 H ASN B 75 49.927 8.258 14.960 1.00 36.03 H new ATOM 0 HA ASN B 75 52.290 8.333 13.717 1.00 36.17 H new ATOM 0 HB2 ASN B 75 51.593 6.565 12.366 1.00 35.88 H new ATOM 0 HB3 ASN B 75 51.288 6.183 13.847 1.00 35.88 H new ATOM 0 HD21 ASN B 75 48.461 5.169 12.013 1.00 34.08 H new ATOM 0 HD22 ASN B 75 49.896 4.779 12.104 1.00 34.08 H new ATOM 2107 N LYS B 76 50.367 10.329 12.814 1.00 37.43 N ATOM 2108 CA LYS B 76 50.026 11.372 11.843 1.00 37.69 C ATOM 2109 C LYS B 76 49.364 10.884 10.574 1.00 37.24 C ATOM 2110 O LYS B 76 49.589 11.441 9.510 1.00 38.45 O ATOM 2111 CB LYS B 76 51.298 12.127 11.431 1.00 38.89 C ATOM 2112 CG LYS B 76 52.225 12.443 12.589 1.00 40.10 C ATOM 2113 CD LYS B 76 51.459 13.140 13.695 1.00 41.07 C ATOM 2114 CE LYS B 76 52.255 13.093 14.999 1.00 43.74 C ATOM 2115 NZ LYS B 76 51.423 13.332 16.219 1.00 43.47 N ATOM 0 H LYS B 76 50.151 10.517 13.625 1.00 37.43 H new ATOM 0 HA LYS B 76 49.382 11.933 12.303 1.00 37.69 H new ATOM 0 HB2 LYS B 76 51.780 11.598 10.777 1.00 38.89 H new ATOM 0 HB3 LYS B 76 51.045 12.956 10.995 1.00 38.89 H new ATOM 0 HG2 LYS B 76 52.622 11.625 12.927 1.00 40.10 H new ATOM 0 HG3 LYS B 76 52.953 13.007 12.285 1.00 40.10 H new ATOM 0 HD2 LYS B 76 51.286 14.062 13.447 1.00 41.07 H new ATOM 0 HD3 LYS B 76 50.597 12.713 13.819 1.00 41.07 H new ATOM 0 HE2 LYS B 76 52.685 12.227 15.075 1.00 43.74 H new ATOM 0 HE3 LYS B 76 52.960 13.758 14.963 1.00 43.74 H new ATOM 0 HZ1 LYS B 76 51.954 13.509 16.911 1.00 43.47 H new ATOM 0 HZ2 LYS B 76 50.880 14.023 16.078 1.00 43.47 H new ATOM 0 HZ3 LYS B 76 50.939 12.606 16.395 1.00 43.47 H new ATOM 2116 N ASP B 77 48.545 9.850 10.660 1.00 36.57 N ATOM 2117 CA ASP B 77 47.916 9.350 9.459 1.00 34.68 C ATOM 2118 C ASP B 77 46.529 9.926 9.257 1.00 34.02 C ATOM 2119 O ASP B 77 45.820 9.530 8.316 1.00 34.17 O ATOM 2120 CB ASP B 77 47.841 7.812 9.457 1.00 34.78 C ATOM 2121 CG ASP B 77 46.717 7.259 10.334 1.00 32.65 C ATOM 2122 OD1 ASP B 77 46.448 6.046 10.218 1.00 33.74 O ATOM 2123 OD2 ASP B 77 46.107 7.998 11.132 1.00 30.96 O ATOM 0 H ASP B 77 48.345 9.434 11.386 1.00 36.57 H new ATOM 0 HA ASP B 77 48.476 9.639 8.721 1.00 34.68 H new ATOM 0 HB2 ASP B 77 47.714 7.502 8.547 1.00 34.78 H new ATOM 0 HB3 ASP B 77 48.688 7.453 9.764 1.00 34.78 H new ATOM 2124 N GLY B 78 46.114 10.841 10.138 1.00 32.00 N ATOM 2125 CA GLY B 78 44.797 11.464 9.972 1.00 27.74 C ATOM 2126 C GLY B 78 43.611 10.807 10.660 1.00 27.72 C ATOM 2127 O GLY B 78 42.434 11.236 10.536 1.00 23.87 O ATOM 0 H GLY B 78 46.565 11.109 10.820 1.00 32.00 H new ATOM 0 HA2 GLY B 78 44.857 12.378 10.290 1.00 27.74 H new ATOM 0 HA3 GLY B 78 44.605 11.506 9.022 1.00 27.74 H new ATOM 2128 N ARG B 79 43.898 9.721 11.362 1.00 27.03 N ATOM 2129 CA ARG B 79 42.862 9.051 12.117 1.00 25.89 C ATOM 2130 C ARG B 79 43.465 8.524 13.431 1.00 23.80 C ATOM 2131 O ARG B 79 44.660 8.154 13.542 1.00 23.01 O ATOM 2132 CB ARG B 79 42.235 7.858 11.359 1.00 29.39 C ATOM 2133 CG ARG B 79 41.413 8.196 10.107 1.00 32.86 C ATOM 2134 CD ARG B 79 40.008 8.769 10.406 1.00 35.33 C ATOM 2135 NE ARG B 79 39.141 8.724 9.219 1.00 36.74 N ATOM 2136 CZ ARG B 79 39.242 9.536 8.163 1.00 39.90 C ATOM 2137 NH1 ARG B 79 38.402 9.398 7.135 1.00 39.01 N ATOM 2138 NH2 ARG B 79 40.165 10.498 8.127 1.00 39.40 N ATOM 0 H ARG B 79 44.678 9.362 11.413 1.00 27.03 H new ATOM 0 HA ARG B 79 42.160 9.701 12.275 1.00 25.89 H new ATOM 0 HB2 ARG B 79 42.949 7.255 11.100 1.00 29.39 H new ATOM 0 HB3 ARG B 79 41.664 7.373 11.975 1.00 29.39 H new ATOM 0 HG2 ARG B 79 41.906 8.838 9.573 1.00 32.86 H new ATOM 0 HG3 ARG B 79 41.317 7.394 9.570 1.00 32.86 H new ATOM 0 HD2 ARG B 79 39.598 8.264 11.126 1.00 35.33 H new ATOM 0 HD3 ARG B 79 40.090 9.685 10.713 1.00 35.33 H new ATOM 0 HE ARG B 79 38.521 8.129 9.203 1.00 36.74 H new ATOM 0 HH11 ARG B 79 37.797 8.787 7.153 1.00 39.01 H new ATOM 0 HH12 ARG B 79 38.466 9.920 6.455 1.00 39.01 H new ATOM 0 HH21 ARG B 79 40.704 10.601 8.789 1.00 39.40 H new ATOM 0 HH22 ARG B 79 40.221 11.015 7.442 1.00 39.40 H new ATOM 2139 N ILE B 80 42.593 8.501 14.415 1.00 22.00 N ATOM 2140 CA ILE B 80 42.918 8.012 15.740 1.00 22.72 C ATOM 2141 C ILE B 80 42.403 6.571 15.844 1.00 22.63 C ATOM 2142 O ILE B 80 41.193 6.361 15.887 1.00 24.39 O ATOM 2143 CB ILE B 80 42.211 8.883 16.808 1.00 21.96 C ATOM 2144 CG1 ILE B 80 42.848 10.291 16.798 1.00 22.37 C ATOM 2145 CG2 ILE B 80 42.387 8.239 18.231 1.00 23.14 C ATOM 2146 CD1 ILE B 80 42.169 11.303 17.676 1.00 23.73 C ATOM 0 H ILE B 80 41.781 8.773 14.334 1.00 22.00 H new ATOM 0 HA ILE B 80 43.876 8.049 15.888 1.00 22.72 H new ATOM 0 HB ILE B 80 41.264 8.942 16.606 1.00 21.96 H new ATOM 0 HG12 ILE B 80 43.775 10.214 17.074 1.00 22.37 H new ATOM 0 HG13 ILE B 80 42.850 10.623 15.887 1.00 22.37 H new ATOM 0 HG21 ILE B 80 41.942 8.790 18.893 1.00 23.14 H new ATOM 0 HG22 ILE B 80 41.997 7.351 18.235 1.00 23.14 H new ATOM 0 HG23 ILE B 80 43.331 8.178 18.444 1.00 23.14 H new ATOM 0 HD11 ILE B 80 42.632 12.153 17.609 1.00 23.73 H new ATOM 0 HD12 ILE B 80 41.248 11.413 17.391 1.00 23.73 H new ATOM 0 HD13 ILE B 80 42.187 10.997 18.596 1.00 23.73 H new ATOM 2147 N GLU B 81 43.285 5.581 15.850 1.00 24.64 N ATOM 2148 CA GLU B 81 42.799 4.197 16.002 1.00 26.01 C ATOM 2149 C GLU B 81 42.742 3.935 17.524 1.00 26.77 C ATOM 2150 O GLU B 81 43.198 4.776 18.326 1.00 22.77 O ATOM 2151 CB GLU B 81 43.703 3.189 15.271 1.00 30.51 C ATOM 2152 CG GLU B 81 45.121 3.068 15.816 1.00 36.08 C ATOM 2153 CD GLU B 81 45.931 1.972 15.113 1.00 40.65 C ATOM 2154 OE1 GLU B 81 46.337 2.182 13.939 1.00 42.15 O ATOM 2155 OE2 GLU B 81 46.159 0.901 15.741 1.00 42.39 O ATOM 0 H GLU B 81 44.137 5.672 15.772 1.00 24.64 H new ATOM 0 HA GLU B 81 41.924 4.084 15.598 1.00 26.01 H new ATOM 0 HB2 GLU B 81 43.283 2.315 15.307 1.00 30.51 H new ATOM 0 HB3 GLU B 81 43.753 3.441 14.336 1.00 30.51 H new ATOM 0 HG2 GLU B 81 45.577 3.918 15.714 1.00 36.08 H new ATOM 0 HG3 GLU B 81 45.084 2.878 16.767 1.00 36.08 H new ATOM 2156 N PHE B 82 42.148 2.815 17.929 1.00 24.78 N ATOM 2157 CA PHE B 82 42.000 2.549 19.364 1.00 25.01 C ATOM 2158 C PHE B 82 43.301 2.555 20.167 1.00 23.62 C ATOM 2159 O PHE B 82 43.335 3.058 21.290 1.00 24.96 O ATOM 2160 CB PHE B 82 41.226 1.252 19.606 1.00 23.93 C ATOM 2161 CG PHE B 82 40.943 0.999 21.078 1.00 22.37 C ATOM 2162 CD1 PHE B 82 40.037 1.801 21.773 1.00 21.33 C ATOM 2163 CD2 PHE B 82 41.610 -0.015 21.760 1.00 21.28 C ATOM 2164 CE1 PHE B 82 39.798 1.598 23.145 1.00 21.13 C ATOM 2165 CE2 PHE B 82 41.385 -0.239 23.136 1.00 21.07 C ATOM 2166 CZ PHE B 82 40.469 0.582 23.824 1.00 18.38 C ATOM 0 H PHE B 82 41.831 2.209 17.408 1.00 24.78 H new ATOM 0 HA PHE B 82 41.492 3.304 19.700 1.00 25.01 H new ATOM 0 HB2 PHE B 82 40.387 1.286 19.121 1.00 23.93 H new ATOM 0 HB3 PHE B 82 41.732 0.507 19.246 1.00 23.93 H new ATOM 0 HD1 PHE B 82 39.585 2.478 21.324 1.00 21.33 H new ATOM 0 HD2 PHE B 82 42.214 -0.554 21.302 1.00 21.28 H new ATOM 0 HE1 PHE B 82 39.194 2.141 23.598 1.00 21.13 H new ATOM 0 HE2 PHE B 82 41.835 -0.919 23.582 1.00 21.07 H new ATOM 0 HZ PHE B 82 40.312 0.446 24.731 1.00 18.38 H new ATOM 2167 N SER B 83 44.363 2.017 19.599 1.00 23.49 N ATOM 2168 CA SER B 83 45.677 1.989 20.247 1.00 24.75 C ATOM 2169 C SER B 83 46.089 3.430 20.665 1.00 24.81 C ATOM 2170 O SER B 83 46.552 3.690 21.785 1.00 22.77 O ATOM 2171 CB SER B 83 46.678 1.455 19.240 1.00 25.11 C ATOM 2172 OG SER B 83 47.978 1.377 19.782 1.00 33.08 O ATOM 0 H SER B 83 44.350 1.653 18.820 1.00 23.49 H new ATOM 0 HA SER B 83 45.651 1.428 21.038 1.00 24.75 H new ATOM 0 HB2 SER B 83 46.399 0.575 18.942 1.00 25.11 H new ATOM 0 HB3 SER B 83 46.688 2.029 18.458 1.00 25.11 H new ATOM 0 HG SER B 83 48.506 1.077 19.202 1.00 33.08 H new ATOM 2173 N GLU B 84 45.948 4.364 19.728 1.00 22.10 N ATOM 2174 CA GLU B 84 46.295 5.759 20.008 1.00 21.88 C ATOM 2175 C GLU B 84 45.341 6.376 21.024 1.00 21.83 C ATOM 2176 O GLU B 84 45.743 7.122 21.948 1.00 23.72 O ATOM 2177 CB GLU B 84 46.245 6.556 18.698 1.00 19.85 C ATOM 2178 CG GLU B 84 47.303 6.107 17.724 1.00 22.14 C ATOM 2179 CD GLU B 84 47.050 6.705 16.312 1.00 21.51 C ATOM 2180 OE1 GLU B 84 45.875 6.914 15.961 1.00 19.77 O ATOM 2181 OE2 GLU B 84 48.029 6.927 15.587 1.00 20.57 O ATOM 0 H GLU B 84 45.657 4.216 18.932 1.00 22.10 H new ATOM 0 HA GLU B 84 47.188 5.787 20.385 1.00 21.88 H new ATOM 0 HB2 GLU B 84 45.370 6.456 18.292 1.00 19.85 H new ATOM 0 HB3 GLU B 84 46.362 7.500 18.890 1.00 19.85 H new ATOM 0 HG2 GLU B 84 48.178 6.380 18.043 1.00 22.14 H new ATOM 0 HG3 GLU B 84 47.310 5.138 17.672 1.00 22.14 H new ATOM 2182 N PHE B 85 44.066 6.074 20.857 1.00 18.69 N ATOM 2183 CA PHE B 85 43.061 6.600 21.753 1.00 19.82 C ATOM 2184 C PHE B 85 43.265 6.197 23.229 1.00 20.57 C ATOM 2185 O PHE B 85 43.229 7.049 24.161 1.00 18.81 O ATOM 2186 CB PHE B 85 41.713 6.095 21.318 1.00 21.45 C ATOM 2187 CG PHE B 85 40.581 6.564 22.176 1.00 23.36 C ATOM 2188 CD1 PHE B 85 40.013 7.810 21.971 1.00 26.22 C ATOM 2189 CD2 PHE B 85 40.047 5.735 23.156 1.00 25.06 C ATOM 2190 CE1 PHE B 85 38.904 8.232 22.737 1.00 28.50 C ATOM 2191 CE2 PHE B 85 38.950 6.134 23.927 1.00 27.70 C ATOM 2192 CZ PHE B 85 38.373 7.391 23.715 1.00 27.46 C ATOM 0 H PHE B 85 43.764 5.567 20.232 1.00 18.69 H new ATOM 0 HA PHE B 85 43.130 7.566 21.706 1.00 19.82 H new ATOM 0 HB2 PHE B 85 41.552 6.377 20.404 1.00 21.45 H new ATOM 0 HB3 PHE B 85 41.726 5.125 21.318 1.00 21.45 H new ATOM 0 HD1 PHE B 85 40.366 8.375 21.322 1.00 26.22 H new ATOM 0 HD2 PHE B 85 40.427 4.899 23.302 1.00 25.06 H new ATOM 0 HE1 PHE B 85 38.528 9.070 22.589 1.00 28.50 H new ATOM 0 HE2 PHE B 85 38.606 5.566 24.578 1.00 27.70 H new ATOM 0 HZ PHE B 85 37.642 7.663 24.222 1.00 27.46 H new ATOM 2193 N ILE B 86 43.461 4.905 23.450 1.00 18.44 N ATOM 2194 CA ILE B 86 43.599 4.435 24.821 1.00 19.79 C ATOM 2195 C ILE B 86 44.894 4.872 25.499 1.00 18.75 C ATOM 2196 O ILE B 86 44.900 5.203 26.686 1.00 18.87 O ATOM 2197 CB ILE B 86 43.350 2.881 24.915 1.00 18.78 C ATOM 2198 CG1 ILE B 86 43.121 2.512 26.380 1.00 18.24 C ATOM 2199 CG2 ILE B 86 44.494 2.076 24.248 1.00 19.20 C ATOM 2200 CD1 ILE B 86 41.762 2.980 26.925 1.00 16.28 C ATOM 0 H ILE B 86 43.516 4.300 22.842 1.00 18.44 H new ATOM 0 HA ILE B 86 42.902 4.875 25.333 1.00 19.79 H new ATOM 0 HB ILE B 86 42.554 2.641 24.415 1.00 18.78 H new ATOM 0 HG12 ILE B 86 43.186 1.549 26.478 1.00 18.24 H new ATOM 0 HG13 ILE B 86 43.828 2.900 26.918 1.00 18.24 H new ATOM 0 HG21 ILE B 86 44.309 1.127 24.324 1.00 19.20 H new ATOM 0 HG22 ILE B 86 44.557 2.319 23.311 1.00 19.20 H new ATOM 0 HG23 ILE B 86 45.333 2.278 24.691 1.00 19.20 H new ATOM 0 HD11 ILE B 86 41.678 2.717 27.855 1.00 16.28 H new ATOM 0 HD12 ILE B 86 41.701 3.946 26.856 1.00 16.28 H new ATOM 0 HD13 ILE B 86 41.049 2.573 26.409 1.00 16.28 H new ATOM 2201 N GLN B 87 45.996 4.914 24.770 1.00 19.86 N ATOM 2202 CA GLN B 87 47.226 5.357 25.387 1.00 21.06 C ATOM 2203 C GLN B 87 47.213 6.848 25.738 1.00 20.94 C ATOM 2204 O GLN B 87 47.815 7.257 26.736 1.00 17.93 O ATOM 2205 CB GLN B 87 48.404 5.035 24.487 1.00 22.51 C ATOM 2206 CG GLN B 87 48.629 3.532 24.381 1.00 27.33 C ATOM 2207 CD GLN B 87 49.765 3.199 23.455 1.00 30.57 C ATOM 2208 OE1 GLN B 87 50.939 3.345 23.822 1.00 33.64 O ATOM 2209 NE2 GLN B 87 49.433 2.764 22.231 1.00 30.65 N ATOM 0 H GLN B 87 46.052 4.697 23.940 1.00 19.86 H new ATOM 0 HA GLN B 87 47.314 4.876 26.225 1.00 21.06 H new ATOM 0 HB2 GLN B 87 48.248 5.403 23.603 1.00 22.51 H new ATOM 0 HB3 GLN B 87 49.204 5.460 24.834 1.00 22.51 H new ATOM 0 HG2 GLN B 87 48.814 3.170 25.262 1.00 27.33 H new ATOM 0 HG3 GLN B 87 47.818 3.106 24.063 1.00 27.33 H new ATOM 0 HE21 GLN B 87 48.605 2.676 22.016 1.00 30.65 H new ATOM 0 HE22 GLN B 87 50.048 2.573 21.661 1.00 30.65 H new ATOM 2210 N ALA B 88 46.543 7.657 24.911 1.00 18.50 N ATOM 2211 CA ALA B 88 46.448 9.076 25.173 1.00 19.92 C ATOM 2212 C ALA B 88 45.571 9.248 26.395 1.00 18.84 C ATOM 2213 O ALA B 88 45.900 10.039 27.289 1.00 19.75 O ATOM 2214 CB ALA B 88 45.832 9.825 23.964 1.00 17.64 C ATOM 0 H ALA B 88 46.141 7.395 24.197 1.00 18.50 H new ATOM 0 HA ALA B 88 47.331 9.449 25.322 1.00 19.92 H new ATOM 0 HB1 ALA B 88 45.779 10.773 24.163 1.00 17.64 H new ATOM 0 HB2 ALA B 88 46.389 9.690 23.182 1.00 17.64 H new ATOM 0 HB3 ALA B 88 44.942 9.481 23.789 1.00 17.64 H new ATOM 2215 N LEU B 89 44.479 8.498 26.437 1.00 16.22 N ATOM 2216 CA LEU B 89 43.547 8.583 27.544 1.00 19.34 C ATOM 2217 C LEU B 89 44.230 8.148 28.868 1.00 19.36 C ATOM 2218 O LEU B 89 43.995 8.759 29.930 1.00 19.55 O ATOM 2219 CB LEU B 89 42.366 7.705 27.235 1.00 21.80 C ATOM 2220 CG LEU B 89 41.157 7.834 28.124 1.00 27.81 C ATOM 2221 CD1 LEU B 89 40.692 9.281 28.102 1.00 30.26 C ATOM 2222 CD2 LEU B 89 40.060 6.862 27.616 1.00 28.53 C ATOM 0 H LEU B 89 44.260 7.931 25.829 1.00 16.22 H new ATOM 0 HA LEU B 89 43.251 9.500 27.659 1.00 19.34 H new ATOM 0 HB2 LEU B 89 42.089 7.885 26.323 1.00 21.80 H new ATOM 0 HB3 LEU B 89 42.663 6.782 27.264 1.00 21.80 H new ATOM 0 HG LEU B 89 41.364 7.598 29.042 1.00 27.81 H new ATOM 0 HD11 LEU B 89 39.913 9.379 28.671 1.00 30.26 H new ATOM 0 HD12 LEU B 89 41.404 9.855 28.427 1.00 30.26 H new ATOM 0 HD13 LEU B 89 40.463 9.534 27.194 1.00 30.26 H new ATOM 0 HD21 LEU B 89 39.275 6.936 28.181 1.00 28.53 H new ATOM 0 HD22 LEU B 89 39.823 7.089 26.703 1.00 28.53 H new ATOM 0 HD23 LEU B 89 40.395 5.952 27.646 1.00 28.53 H new ATOM 2223 N SER B 90 45.053 7.097 28.787 1.00 17.84 N ATOM 2224 CA SER B 90 45.797 6.599 29.946 1.00 18.06 C ATOM 2225 C SER B 90 46.704 7.680 30.582 1.00 19.46 C ATOM 2226 O SER B 90 46.641 7.921 31.806 1.00 19.90 O ATOM 2227 CB SER B 90 46.665 5.391 29.555 1.00 17.12 C ATOM 2228 OG SER B 90 47.471 4.950 30.649 1.00 16.45 O ATOM 0 H SER B 90 45.194 6.656 28.062 1.00 17.84 H new ATOM 0 HA SER B 90 45.133 6.337 30.602 1.00 18.06 H new ATOM 0 HB2 SER B 90 46.095 4.664 29.258 1.00 17.12 H new ATOM 0 HB3 SER B 90 47.235 5.629 28.807 1.00 17.12 H new ATOM 0 HG SER B 90 48.243 4.767 30.373 1.00 16.45 H new ATOM 2229 N VAL B 91 47.558 8.304 29.765 1.00 18.19 N ATOM 2230 CA VAL B 91 48.473 9.329 30.273 1.00 19.32 C ATOM 2231 C VAL B 91 47.736 10.555 30.776 1.00 18.82 C ATOM 2232 O VAL B 91 48.014 11.034 31.887 1.00 18.70 O ATOM 2233 CB VAL B 91 49.514 9.800 29.207 1.00 21.27 C ATOM 2234 CG1 VAL B 91 50.478 10.885 29.840 1.00 20.23 C ATOM 2235 CG2 VAL B 91 50.291 8.628 28.672 1.00 21.52 C ATOM 0 H VAL B 91 47.623 8.150 28.921 1.00 18.19 H new ATOM 0 HA VAL B 91 48.940 8.898 31.006 1.00 19.32 H new ATOM 0 HB VAL B 91 49.043 10.205 28.462 1.00 21.27 H new ATOM 0 HG11 VAL B 91 51.122 11.174 29.174 1.00 20.23 H new ATOM 0 HG12 VAL B 91 49.957 11.647 30.137 1.00 20.23 H new ATOM 0 HG13 VAL B 91 50.947 10.500 30.597 1.00 20.23 H new ATOM 0 HG21 VAL B 91 50.931 8.938 28.013 1.00 21.52 H new ATOM 0 HG22 VAL B 91 50.762 8.192 29.400 1.00 21.52 H new ATOM 0 HG23 VAL B 91 49.681 7.997 28.258 1.00 21.52 H new ATOM 2236 N THR B 92 46.783 11.048 29.996 1.00 17.07 N ATOM 2237 CA THR B 92 46.036 12.241 30.399 1.00 20.18 C ATOM 2238 C THR B 92 45.095 12.100 31.592 1.00 20.64 C ATOM 2239 O THR B 92 44.894 13.076 32.308 1.00 20.99 O ATOM 2240 CB THR B 92 45.247 12.834 29.196 1.00 17.76 C ATOM 2241 OG1ATHR B 92 46.176 13.382 28.257 0.50 20.81 O ATOM 2242 OG1BTHR B 92 44.191 11.950 28.825 0.50 12.97 O ATOM 2243 CG2ATHR B 92 44.283 13.911 29.655 0.50 19.25 C ATOM 2244 CG2BTHR B 92 46.171 13.013 28.003 0.50 18.57 C ATOM 0 H THR B 92 46.552 10.714 29.238 1.00 17.07 H new ATOM 0 HA THR B 92 46.735 12.841 30.703 1.00 20.18 H new ATOM 0 HB ATHR B 92 44.730 12.127 28.780 0.50 17.76 H new ATOM 0 HB BTHR B 92 44.882 13.693 29.461 0.50 17.76 H new ATOM 0 HG1ATHR B 92 45.757 13.703 27.603 0.50 12.97 H new ATOM 0 HG1BTHR B 92 44.501 11.320 28.364 0.50 12.97 H new ATOM 0 HG21ATHR B 92 43.804 14.265 28.889 0.50 18.57 H new ATOM 0 HG21BTHR B 92 45.671 13.383 27.259 0.50 18.57 H new ATOM 0 HG22ATHR B 92 43.650 13.532 30.285 0.50 18.57 H new ATOM 0 HG22BTHR B 92 46.892 13.617 28.240 0.50 18.57 H new ATOM 0 HG23ATHR B 92 44.777 14.626 30.085 0.50 18.57 H new ATOM 0 HG23BTHR B 92 46.541 12.153 27.748 0.50 18.57 H new ATOM 2245 N SER B 93 44.521 10.921 31.836 1.00 20.95 N ATOM 2246 CA SER B 93 43.620 10.828 32.989 1.00 21.92 C ATOM 2247 C SER B 93 44.214 10.136 34.193 1.00 22.13 C ATOM 2248 O SER B 93 43.737 10.367 35.308 1.00 25.27 O ATOM 2249 CB SER B 93 42.322 10.088 32.656 1.00 22.30 C ATOM 2250 OG SER B 93 42.617 8.707 32.478 1.00 28.29 O ATOM 0 H SER B 93 44.629 10.201 31.378 1.00 20.95 H new ATOM 0 HA SER B 93 43.451 11.758 33.208 1.00 21.92 H new ATOM 0 HB2 SER B 93 41.676 10.205 33.370 1.00 22.30 H new ATOM 0 HB3 SER B 93 41.924 10.453 31.851 1.00 22.30 H new ATOM 0 HG SER B 93 43.038 8.601 31.759 1.00 28.29 H new ATOM 2251 N ARG B 94 45.227 9.292 33.980 1.00 20.33 N ATOM 2252 CA ARG B 94 45.823 8.501 35.053 1.00 19.34 C ATOM 2253 C ARG B 94 47.323 8.589 35.180 1.00 18.47 C ATOM 2254 O ARG B 94 47.931 7.925 36.031 1.00 20.75 O ATOM 2255 CB ARG B 94 45.478 7.028 34.852 1.00 16.87 C ATOM 2256 CG ARG B 94 44.020 6.729 35.020 1.00 18.80 C ATOM 2257 CD ARG B 94 43.706 5.245 34.786 1.00 18.21 C ATOM 2258 NE ARG B 94 42.302 5.031 35.122 1.00 18.05 N ATOM 2259 CZ ARG B 94 41.741 3.848 35.326 1.00 19.96 C ATOM 2260 NH1 ARG B 94 42.473 2.746 35.222 1.00 20.87 N ATOM 2261 NH2 ARG B 94 40.444 3.783 35.650 1.00 21.63 N ATOM 0 H ARG B 94 45.586 9.164 33.209 1.00 20.33 H new ATOM 0 HA ARG B 94 45.449 8.880 35.864 1.00 19.34 H new ATOM 0 HB2 ARG B 94 45.757 6.756 33.964 1.00 16.87 H new ATOM 0 HB3 ARG B 94 45.985 6.495 35.484 1.00 16.87 H new ATOM 0 HG2 ARG B 94 43.740 6.981 35.914 1.00 18.80 H new ATOM 0 HG3 ARG B 94 43.506 7.269 34.399 1.00 18.80 H new ATOM 0 HD2 ARG B 94 43.876 5.003 33.862 1.00 18.21 H new ATOM 0 HD3 ARG B 94 44.277 4.685 35.336 1.00 18.21 H new ATOM 0 HE ARG B 94 41.800 5.726 35.193 1.00 18.05 H new ATOM 0 HH11 ARG B 94 43.308 2.801 35.023 1.00 20.87 H new ATOM 0 HH12 ARG B 94 42.113 1.976 35.354 1.00 20.87 H new ATOM 0 HH21 ARG B 94 39.983 4.505 35.724 1.00 21.63 H new ATOM 0 HH22 ARG B 94 40.072 3.019 35.784 1.00 21.63 H new ATOM 2262 N GLY B 95 47.957 9.395 34.356 1.00 18.83 N ATOM 2263 CA GLY B 95 49.404 9.437 34.460 1.00 16.58 C ATOM 2264 C GLY B 95 49.897 10.194 35.691 1.00 16.86 C ATOM 2265 O GLY B 95 49.123 10.861 36.376 1.00 16.28 O ATOM 0 H GLY B 95 47.598 9.901 33.760 1.00 18.83 H new ATOM 0 HA2 GLY B 95 49.747 8.530 34.486 1.00 16.58 H new ATOM 0 HA3 GLY B 95 49.768 9.855 33.664 1.00 16.58 H new ATOM 2266 N THR B 96 51.177 10.046 35.983 1.00 17.40 N ATOM 2267 CA THR B 96 51.798 10.780 37.079 1.00 20.02 C ATOM 2268 C THR B 96 51.831 12.261 36.673 1.00 21.30 C ATOM 2269 O THR B 96 51.561 12.623 35.513 1.00 18.85 O ATOM 2270 CB THR B 96 53.266 10.315 37.312 1.00 21.19 C ATOM 2271 OG1 THR B 96 54.035 10.535 36.125 1.00 22.39 O ATOM 2272 CG2 THR B 96 53.331 8.821 37.646 1.00 23.35 C ATOM 0 H THR B 96 51.710 9.522 35.557 1.00 17.40 H new ATOM 0 HA THR B 96 51.293 10.628 37.893 1.00 20.02 H new ATOM 0 HB THR B 96 53.621 10.826 38.056 1.00 21.19 H new ATOM 0 HG1 THR B 96 54.827 10.285 36.253 1.00 22.39 H new ATOM 0 HG21 THR B 96 54.255 8.560 37.786 1.00 23.35 H new ATOM 0 HG22 THR B 96 52.821 8.647 38.453 1.00 23.35 H new ATOM 0 HG23 THR B 96 52.958 8.309 36.912 1.00 23.35 H new ATOM 2273 N LEU B 97 52.150 13.135 37.616 1.00 21.36 N ATOM 2274 CA LEU B 97 52.245 14.558 37.300 1.00 23.80 C ATOM 2275 C LEU B 97 53.316 14.756 36.195 1.00 22.87 C ATOM 2276 O LEU B 97 53.096 15.475 35.213 1.00 22.44 O ATOM 2277 CB LEU B 97 52.609 15.343 38.575 1.00 24.88 C ATOM 2278 CG LEU B 97 52.737 16.871 38.499 1.00 28.91 C ATOM 2279 CD1 LEU B 97 51.487 17.508 37.970 1.00 29.40 C ATOM 2280 CD2 LEU B 97 53.040 17.419 39.913 1.00 29.49 C ATOM 0 H LEU B 97 52.314 12.932 38.435 1.00 21.36 H new ATOM 0 HA LEU B 97 51.395 14.891 36.973 1.00 23.80 H new ATOM 0 HB2 LEU B 97 51.939 15.139 39.246 1.00 24.88 H new ATOM 0 HB3 LEU B 97 53.453 14.995 38.902 1.00 24.88 H new ATOM 0 HG LEU B 97 53.458 17.087 37.888 1.00 28.91 H new ATOM 0 HD11 LEU B 97 51.603 18.470 37.936 1.00 29.40 H new ATOM 0 HD12 LEU B 97 51.305 17.173 37.078 1.00 29.40 H new ATOM 0 HD13 LEU B 97 50.742 17.293 38.553 1.00 29.40 H new ATOM 0 HD21 LEU B 97 53.123 18.385 39.875 1.00 29.49 H new ATOM 0 HD22 LEU B 97 52.317 17.180 40.515 1.00 29.49 H new ATOM 0 HD23 LEU B 97 53.870 17.036 40.238 1.00 29.49 H new ATOM 2281 N ASP B 98 54.451 14.091 36.340 1.00 22.31 N ATOM 2282 CA ASP B 98 55.537 14.187 35.361 1.00 24.12 C ATOM 2283 C ASP B 98 55.126 13.684 33.973 1.00 23.48 C ATOM 2284 O ASP B 98 55.484 14.297 32.952 1.00 21.96 O ATOM 2285 CB ASP B 98 56.750 13.385 35.836 1.00 27.71 C ATOM 2286 CG ASP B 98 57.782 14.242 36.560 1.00 33.51 C ATOM 2287 OD1 ASP B 98 57.435 15.344 37.031 1.00 33.87 O ATOM 2288 OD2 ASP B 98 58.959 13.792 36.670 1.00 36.66 O ATOM 0 H ASP B 98 54.619 13.571 37.004 1.00 22.31 H new ATOM 0 HA ASP B 98 55.759 15.128 35.286 1.00 24.12 H new ATOM 0 HB2 ASP B 98 56.452 12.677 36.428 1.00 27.71 H new ATOM 0 HB3 ASP B 98 57.169 12.959 35.072 1.00 27.71 H new ATOM 2289 N GLU B 99 54.390 12.572 33.919 1.00 21.52 N ATOM 2290 CA GLU B 99 53.957 12.042 32.610 1.00 20.50 C ATOM 2291 C GLU B 99 52.930 12.955 31.966 1.00 19.68 C ATOM 2292 O GLU B 99 52.926 13.117 30.732 1.00 19.02 O ATOM 2293 CB GLU B 99 53.365 10.619 32.722 1.00 20.33 C ATOM 2294 CG GLU B 99 54.406 9.584 33.101 1.00 21.40 C ATOM 2295 CD GLU B 99 53.836 8.351 33.825 1.00 23.80 C ATOM 2296 OE1 GLU B 99 52.634 8.305 34.169 1.00 21.53 O ATOM 2297 OE2 GLU B 99 54.632 7.420 34.066 1.00 24.80 O ATOM 0 H GLU B 99 54.134 12.117 34.603 1.00 21.52 H new ATOM 0 HA GLU B 99 54.752 12.001 32.056 1.00 20.50 H new ATOM 0 HB2 GLU B 99 52.657 10.618 33.385 1.00 20.33 H new ATOM 0 HB3 GLU B 99 52.962 10.372 31.875 1.00 20.33 H new ATOM 0 HG2 GLU B 99 54.864 9.292 32.298 1.00 21.40 H new ATOM 0 HG3 GLU B 99 55.071 10.002 33.670 1.00 21.40 H new ATOM 2298 N LYS B 100 52.044 13.528 32.765 1.00 17.48 N ATOM 2299 CA LYS B 100 51.047 14.437 32.226 1.00 19.33 C ATOM 2300 C LYS B 100 51.717 15.710 31.685 1.00 20.15 C ATOM 2301 O LYS B 100 51.286 16.284 30.665 1.00 19.88 O ATOM 2302 CB LYS B 100 50.051 14.817 33.312 1.00 19.19 C ATOM 2303 CG LYS B 100 49.063 13.721 33.666 1.00 22.34 C ATOM 2304 CD LYS B 100 48.022 14.262 34.609 1.00 23.13 C ATOM 2305 CE LYS B 100 46.985 13.212 34.959 1.00 25.30 C ATOM 2306 NZ LYS B 100 46.620 13.318 36.365 1.00 26.03 N ATOM 0 H LYS B 100 52.002 13.406 33.615 1.00 17.48 H new ATOM 0 HA LYS B 100 50.584 13.989 31.501 1.00 19.33 H new ATOM 0 HB2 LYS B 100 50.540 15.067 34.111 1.00 19.19 H new ATOM 0 HB3 LYS B 100 49.558 15.601 33.024 1.00 19.19 H new ATOM 0 HG2 LYS B 100 48.639 13.383 32.862 1.00 22.34 H new ATOM 0 HG3 LYS B 100 49.527 12.975 34.076 1.00 22.34 H new ATOM 0 HD2 LYS B 100 48.451 14.577 35.420 1.00 23.13 H new ATOM 0 HD3 LYS B 100 47.585 15.027 34.204 1.00 23.13 H new ATOM 0 HE2 LYS B 100 46.198 13.327 34.404 1.00 25.30 H new ATOM 0 HE3 LYS B 100 47.336 12.327 34.774 1.00 25.30 H new ATOM 0 HZ1 LYS B 100 45.735 13.267 36.447 1.00 26.03 H new ATOM 0 HZ2 LYS B 100 46.999 12.654 36.821 1.00 26.03 H new ATOM 0 HZ3 LYS B 100 46.903 14.098 36.687 1.00 26.03 H new ATOM 2307 N LEU B 101 52.780 16.146 32.349 1.00 18.79 N ATOM 2308 CA LEU B 101 53.472 17.354 31.911 1.00 20.94 C ATOM 2309 C LEU B 101 54.229 17.103 30.609 1.00 19.74 C ATOM 2310 O LEU B 101 54.311 18.006 29.788 1.00 19.30 O ATOM 2311 CB LEU B 101 54.423 17.880 32.998 1.00 20.67 C ATOM 2312 CG LEU B 101 53.596 18.513 34.125 1.00 21.97 C ATOM 2313 CD1 LEU B 101 54.460 18.878 35.316 1.00 23.23 C ATOM 2314 CD2 LEU B 101 52.901 19.751 33.547 1.00 25.16 C ATOM 0 H LEU B 101 53.114 15.766 33.044 1.00 18.79 H new ATOM 0 HA LEU B 101 52.801 18.035 31.749 1.00 20.94 H new ATOM 0 HB2 LEU B 101 54.965 17.156 33.347 1.00 20.67 H new ATOM 0 HB3 LEU B 101 55.032 18.534 32.622 1.00 20.67 H new ATOM 0 HG LEU B 101 52.940 17.877 34.451 1.00 21.97 H new ATOM 0 HD11 LEU B 101 53.907 19.274 36.008 1.00 23.23 H new ATOM 0 HD12 LEU B 101 54.888 18.079 35.663 1.00 23.23 H new ATOM 0 HD13 LEU B 101 55.139 19.514 35.041 1.00 23.23 H new ATOM 0 HD21 LEU B 101 52.368 20.175 34.238 1.00 25.16 H new ATOM 0 HD22 LEU B 101 53.569 20.376 33.225 1.00 25.16 H new ATOM 0 HD23 LEU B 101 52.326 19.486 32.812 1.00 25.16 H new ATOM 2315 N ARG B 102 54.756 15.894 30.423 1.00 21.01 N ATOM 2316 CA ARG B 102 55.491 15.548 29.202 1.00 21.35 C ATOM 2317 C ARG B 102 54.541 15.547 28.029 1.00 21.04 C ATOM 2318 O ARG B 102 54.892 15.986 26.956 1.00 21.67 O ATOM 2319 CB ARG B 102 56.160 14.170 29.289 1.00 23.71 C ATOM 2320 CG ARG B 102 57.505 14.162 30.001 1.00 29.05 C ATOM 2321 CD ARG B 102 58.338 12.892 29.728 1.00 33.07 C ATOM 2322 NE ARG B 102 57.906 11.688 30.454 1.00 38.57 N ATOM 2323 CZ ARG B 102 57.288 10.635 29.899 1.00 39.26 C ATOM 2324 NH1 ARG B 102 56.995 10.607 28.595 1.00 39.34 N ATOM 2325 NH2 ARG B 102 57.005 9.573 30.644 1.00 40.58 N ATOM 0 H ARG B 102 54.699 15.254 30.995 1.00 21.01 H new ATOM 0 HA ARG B 102 56.188 16.213 29.089 1.00 21.35 H new ATOM 0 HB2 ARG B 102 55.561 13.561 29.748 1.00 23.71 H new ATOM 0 HB3 ARG B 102 56.281 13.825 28.391 1.00 23.71 H new ATOM 0 HG2 ARG B 102 58.014 14.940 29.724 1.00 29.05 H new ATOM 0 HG3 ARG B 102 57.358 14.245 30.956 1.00 29.05 H new ATOM 0 HD2 ARG B 102 58.312 12.705 28.777 1.00 33.07 H new ATOM 0 HD3 ARG B 102 59.263 13.075 29.956 1.00 33.07 H new ATOM 0 HE ARG B 102 58.062 11.657 31.299 1.00 38.57 H new ATOM 0 HH11 ARG B 102 57.203 11.274 28.093 1.00 39.34 H new ATOM 0 HH12 ARG B 102 56.598 9.922 28.258 1.00 39.34 H new ATOM 0 HH21 ARG B 102 57.218 9.563 31.477 1.00 40.58 H new ATOM 0 HH22 ARG B 102 56.609 8.895 30.293 1.00 40.58 H new ATOM 2326 N TRP B 103 53.330 15.053 28.237 1.00 20.77 N ATOM 2327 CA TRP B 103 52.333 15.015 27.180 1.00 21.49 C ATOM 2328 C TRP B 103 51.870 16.462 26.839 1.00 22.46 C ATOM 2329 O TRP B 103 51.787 16.850 25.644 1.00 19.30 O ATOM 2330 CB TRP B 103 51.151 14.164 27.642 1.00 21.92 C ATOM 2331 CG TRP B 103 50.243 13.724 26.533 1.00 24.80 C ATOM 2332 CD1 TRP B 103 50.319 12.560 25.829 1.00 25.38 C ATOM 2333 CD2 TRP B 103 49.106 14.421 26.034 1.00 24.84 C ATOM 2334 NE1 TRP B 103 49.289 12.484 24.923 1.00 26.77 N ATOM 2335 CE2 TRP B 103 48.532 13.617 25.026 1.00 26.74 C ATOM 2336 CE3 TRP B 103 48.515 15.648 26.337 1.00 27.71 C ATOM 2337 CZ2 TRP B 103 47.394 14.005 24.317 1.00 28.10 C ATOM 2338 CZ3 TRP B 103 47.371 16.037 25.617 1.00 28.44 C ATOM 2339 CH2 TRP B 103 46.834 15.216 24.628 1.00 28.04 C ATOM 0 H TRP B 103 53.064 14.732 28.989 1.00 20.77 H new ATOM 0 HA TRP B 103 52.713 14.621 26.379 1.00 21.49 H new ATOM 0 HB2 TRP B 103 51.490 13.379 28.100 1.00 21.92 H new ATOM 0 HB3 TRP B 103 50.634 14.669 28.289 1.00 21.92 H new ATOM 0 HD1 TRP B 103 50.974 11.910 25.945 1.00 25.38 H new ATOM 0 HE1 TRP B 103 49.145 11.832 24.381 1.00 26.77 H new ATOM 0 HE3 TRP B 103 48.869 16.196 27.000 1.00 27.71 H new ATOM 0 HZ2 TRP B 103 47.029 13.461 23.657 1.00 28.10 H new ATOM 0 HZ3 TRP B 103 46.967 16.854 25.804 1.00 28.44 H new ATOM 0 HH2 TRP B 103 46.076 15.497 24.167 1.00 28.04 H new ATOM 2340 N ALA B 104 51.580 17.249 27.877 1.00 20.76 N ATOM 2341 CA ALA B 104 51.149 18.633 27.675 1.00 21.60 C ATOM 2342 C ALA B 104 52.246 19.361 26.920 1.00 21.32 C ATOM 2343 O ALA B 104 51.952 20.198 26.035 1.00 20.20 O ATOM 2344 CB ALA B 104 50.889 19.324 28.999 1.00 21.77 C ATOM 0 H ALA B 104 51.626 17.003 28.700 1.00 20.76 H new ATOM 0 HA ALA B 104 50.320 18.643 27.171 1.00 21.60 H new ATOM 0 HB1 ALA B 104 50.605 20.237 28.837 1.00 21.77 H new ATOM 0 HB2 ALA B 104 50.193 18.850 29.480 1.00 21.77 H new ATOM 0 HB3 ALA B 104 51.702 19.327 29.528 1.00 21.77 H new ATOM 2345 N PHE B 105 53.496 19.072 27.271 1.00 20.79 N ATOM 2346 CA PHE B 105 54.592 19.723 26.574 1.00 22.77 C ATOM 2347 C PHE B 105 54.487 19.429 25.070 1.00 25.80 C ATOM 2348 O PHE B 105 54.675 20.329 24.244 1.00 26.68 O ATOM 2349 CB PHE B 105 55.943 19.253 27.078 1.00 22.61 C ATOM 2350 CG PHE B 105 57.094 20.044 26.522 1.00 22.57 C ATOM 2351 CD1 PHE B 105 57.468 21.265 27.096 1.00 23.33 C ATOM 2352 CD2 PHE B 105 57.789 19.585 25.412 1.00 23.49 C ATOM 2353 CE1 PHE B 105 58.527 22.023 26.572 1.00 21.60 C ATOM 2354 CE2 PHE B 105 58.862 20.344 24.869 1.00 24.74 C ATOM 2355 CZ PHE B 105 59.220 21.562 25.462 1.00 22.83 C ATOM 0 H PHE B 105 53.724 18.520 27.890 1.00 20.79 H new ATOM 0 HA PHE B 105 54.524 20.676 26.742 1.00 22.77 H new ATOM 0 HB2 PHE B 105 55.958 19.310 28.046 1.00 22.61 H new ATOM 0 HB3 PHE B 105 56.060 18.318 26.847 1.00 22.61 H new ATOM 0 HD1 PHE B 105 57.006 21.580 27.839 1.00 23.33 H new ATOM 0 HD2 PHE B 105 57.551 18.776 25.021 1.00 23.49 H new ATOM 0 HE1 PHE B 105 58.763 22.831 26.967 1.00 21.60 H new ATOM 0 HE2 PHE B 105 59.324 20.033 24.124 1.00 24.74 H new ATOM 0 HZ PHE B 105 59.922 22.061 25.112 1.00 22.83 H new ATOM 2356 N LYS B 106 54.202 18.170 24.721 1.00 27.31 N ATOM 2357 CA LYS B 106 54.059 17.772 23.313 1.00 27.56 C ATOM 2358 C LYS B 106 52.940 18.535 22.647 1.00 26.64 C ATOM 2359 O LYS B 106 53.072 18.892 21.479 1.00 27.88 O ATOM 2360 CB LYS B 106 53.785 16.275 23.170 1.00 29.50 C ATOM 2361 CG LYS B 106 55.005 15.398 23.278 1.00 33.85 C ATOM 2362 CD LYS B 106 54.604 13.913 23.342 1.00 37.40 C ATOM 2363 CE LYS B 106 53.605 13.528 22.236 1.00 39.65 C ATOM 2364 NZ LYS B 106 52.980 12.154 22.415 1.00 42.30 N ATOM 0 H LYS B 106 54.087 17.530 25.284 1.00 27.31 H new ATOM 0 HA LYS B 106 54.902 17.980 22.880 1.00 27.56 H new ATOM 0 HB2 LYS B 106 53.149 16.009 23.852 1.00 29.50 H new ATOM 0 HB3 LYS B 106 53.363 16.117 22.311 1.00 29.50 H new ATOM 0 HG2 LYS B 106 55.586 15.548 22.516 1.00 33.85 H new ATOM 0 HG3 LYS B 106 55.511 15.636 24.071 1.00 33.85 H new ATOM 0 HD2 LYS B 106 55.399 13.362 23.263 1.00 37.40 H new ATOM 0 HD3 LYS B 106 54.212 13.723 24.209 1.00 37.40 H new ATOM 0 HE2 LYS B 106 52.899 14.192 22.206 1.00 39.65 H new ATOM 0 HE3 LYS B 106 54.059 13.557 21.379 1.00 39.65 H new ATOM 0 HZ1 LYS B 106 52.416 11.995 21.745 1.00 42.30 H new ATOM 0 HZ2 LYS B 106 53.619 11.535 22.417 1.00 42.30 H new ATOM 0 HZ3 LYS B 106 52.539 12.127 23.187 1.00 42.30 H new ATOM 2365 N LEU B 107 51.848 18.791 23.360 1.00 24.00 N ATOM 2366 CA LEU B 107 50.737 19.547 22.784 1.00 24.76 C ATOM 2367 C LEU B 107 51.113 21.030 22.516 1.00 26.02 C ATOM 2368 O LEU B 107 50.722 21.618 21.481 1.00 25.02 O ATOM 2369 CB LEU B 107 49.534 19.484 23.704 1.00 24.47 C ATOM 2370 CG LEU B 107 48.319 20.373 23.410 1.00 25.95 C ATOM 2371 CD1 LEU B 107 47.631 19.898 22.131 1.00 24.83 C ATOM 2372 CD2 LEU B 107 47.335 20.290 24.585 1.00 25.38 C ATOM 0 H LEU B 107 51.729 18.539 24.174 1.00 24.00 H new ATOM 0 HA LEU B 107 50.522 19.139 21.931 1.00 24.76 H new ATOM 0 HB2 LEU B 107 49.226 18.564 23.719 1.00 24.47 H new ATOM 0 HB3 LEU B 107 49.840 19.695 24.600 1.00 24.47 H new ATOM 0 HG LEU B 107 48.610 21.291 23.293 1.00 25.95 H new ATOM 0 HD11 LEU B 107 46.863 20.462 21.948 1.00 24.83 H new ATOM 0 HD12 LEU B 107 48.254 19.950 21.390 1.00 24.83 H new ATOM 0 HD13 LEU B 107 47.338 18.980 22.243 1.00 24.83 H new ATOM 0 HD21 LEU B 107 46.565 20.851 24.403 1.00 25.38 H new ATOM 0 HD22 LEU B 107 47.045 19.372 24.700 1.00 25.38 H new ATOM 0 HD23 LEU B 107 47.772 20.595 25.396 1.00 25.38 H new ATOM 2373 N TYR B 108 51.864 21.631 23.446 1.00 25.16 N ATOM 2374 CA TYR B 108 52.302 23.016 23.304 1.00 25.59 C ATOM 2375 C TYR B 108 53.417 23.233 22.277 1.00 25.74 C ATOM 2376 O TYR B 108 53.453 24.296 21.624 1.00 26.91 O ATOM 2377 CB TYR B 108 52.759 23.579 24.671 1.00 25.53 C ATOM 2378 CG TYR B 108 51.582 23.979 25.535 1.00 25.68 C ATOM 2379 CD1 TYR B 108 50.783 25.069 25.172 1.00 28.10 C ATOM 2380 CD2 TYR B 108 51.214 23.241 26.650 1.00 26.46 C ATOM 2381 CE1 TYR B 108 49.650 25.407 25.893 1.00 28.11 C ATOM 2382 CE2 TYR B 108 50.061 23.567 27.376 1.00 27.96 C ATOM 2383 CZ TYR B 108 49.288 24.659 26.981 1.00 27.51 C ATOM 2384 OH TYR B 108 48.138 25.020 27.643 1.00 30.26 O ATOM 0 H TYR B 108 52.129 21.248 24.169 1.00 25.16 H new ATOM 0 HA TYR B 108 51.525 23.492 22.971 1.00 25.59 H new ATOM 0 HB2 TYR B 108 53.289 22.912 25.135 1.00 25.53 H new ATOM 0 HB3 TYR B 108 53.332 24.348 24.529 1.00 25.53 H new ATOM 0 HD1 TYR B 108 51.018 25.578 24.430 1.00 28.10 H new ATOM 0 HD2 TYR B 108 51.739 22.522 26.919 1.00 26.46 H new ATOM 0 HE1 TYR B 108 49.137 26.140 25.639 1.00 28.11 H new ATOM 0 HE2 TYR B 108 49.813 23.060 28.115 1.00 27.96 H new ATOM 0 HH TYR B 108 48.233 24.881 28.466 1.00 30.26 H new ATOM 2385 N ASP B 109 54.315 22.265 22.157 1.00 23.50 N ATOM 2386 CA ASP B 109 55.440 22.339 21.222 1.00 25.15 C ATOM 2387 C ASP B 109 54.916 22.018 19.805 1.00 26.43 C ATOM 2388 O ASP B 109 55.226 20.980 19.232 1.00 26.35 O ATOM 2389 CB ASP B 109 56.526 21.337 21.619 1.00 24.05 C ATOM 2390 CG ASP B 109 57.757 21.433 20.726 1.00 26.64 C ATOM 2391 OD1 ASP B 109 57.765 22.348 19.860 1.00 25.98 O ATOM 2392 OD2 ASP B 109 58.706 20.626 20.884 1.00 24.33 O ATOM 0 H ASP B 109 54.292 21.539 22.618 1.00 23.50 H new ATOM 0 HA ASP B 109 55.827 23.228 21.241 1.00 25.15 H new ATOM 0 HB2 ASP B 109 56.785 21.492 22.541 1.00 24.05 H new ATOM 0 HB3 ASP B 109 56.165 20.438 21.573 1.00 24.05 H new ATOM 2393 N LEU B 110 54.101 22.917 19.272 1.00 28.36 N ATOM 2394 CA LEU B 110 53.467 22.691 17.961 1.00 31.71 C ATOM 2395 C LEU B 110 54.391 22.113 16.866 1.00 32.75 C ATOM 2396 O LEU B 110 53.981 21.195 16.142 1.00 32.95 O ATOM 2397 CB LEU B 110 52.780 23.975 17.473 1.00 33.50 C ATOM 2398 CG LEU B 110 51.550 24.423 18.282 1.00 35.08 C ATOM 2399 CD1 LEU B 110 50.967 25.682 17.650 1.00 35.40 C ATOM 2400 CD2 LEU B 110 50.488 23.322 18.302 1.00 34.98 C ATOM 0 H LEU B 110 53.897 23.665 19.645 1.00 28.36 H new ATOM 0 HA LEU B 110 52.810 21.995 18.116 1.00 31.71 H new ATOM 0 HB2 LEU B 110 53.431 24.694 17.481 1.00 33.50 H new ATOM 0 HB3 LEU B 110 52.510 23.847 16.550 1.00 33.50 H new ATOM 0 HG LEU B 110 51.823 24.605 19.195 1.00 35.08 H new ATOM 0 HD11 LEU B 110 50.191 25.969 18.156 1.00 35.40 H new ATOM 0 HD12 LEU B 110 51.634 26.386 17.655 1.00 35.40 H new ATOM 0 HD13 LEU B 110 50.704 25.493 16.736 1.00 35.40 H new ATOM 0 HD21 LEU B 110 49.721 23.621 18.815 1.00 34.98 H new ATOM 0 HD22 LEU B 110 50.211 23.123 17.394 1.00 34.98 H new ATOM 0 HD23 LEU B 110 50.858 22.523 18.709 1.00 34.98 H new ATOM 2401 N ASP B 111 55.622 22.609 16.752 1.00 32.70 N ATOM 2402 CA ASP B 111 56.523 22.089 15.730 1.00 34.71 C ATOM 2403 C ASP B 111 57.489 21.003 16.202 1.00 34.92 C ATOM 2404 O ASP B 111 58.431 20.655 15.497 1.00 34.73 O ATOM 2405 CB ASP B 111 57.278 23.236 15.037 1.00 34.39 C ATOM 2406 CG ASP B 111 58.289 23.949 15.954 1.00 36.38 C ATOM 2407 OD1 ASP B 111 58.432 23.564 17.130 1.00 34.58 O ATOM 2408 OD2 ASP B 111 58.956 24.903 15.480 1.00 36.75 O ATOM 0 H ASP B 111 55.948 23.233 17.246 1.00 32.70 H new ATOM 0 HA ASP B 111 55.946 21.642 15.091 1.00 34.71 H new ATOM 0 HB2 ASP B 111 57.746 22.885 14.263 1.00 34.39 H new ATOM 0 HB3 ASP B 111 56.636 23.885 14.709 1.00 34.39 H new ATOM 2409 N ASN B 112 57.240 20.469 17.395 1.00 36.03 N ATOM 2410 CA ASN B 112 58.038 19.382 17.974 1.00 36.38 C ATOM 2411 C ASN B 112 59.539 19.596 17.901 1.00 35.30 C ATOM 2412 O ASN B 112 60.323 18.671 17.697 1.00 35.33 O ATOM 2413 CB ASN B 112 57.640 18.042 17.318 1.00 38.64 C ATOM 2414 CG ASN B 112 58.503 16.872 17.782 1.00 42.31 C ATOM 2415 OD1 ASN B 112 58.750 16.686 18.987 1.00 44.31 O ATOM 2416 ND2 ASN B 112 58.965 16.064 16.822 1.00 43.70 N ATOM 0 H ASN B 112 56.595 20.729 17.900 1.00 36.03 H new ATOM 0 HA ASN B 112 57.833 19.367 18.922 1.00 36.38 H new ATOM 0 HB2 ASN B 112 56.711 17.852 17.520 1.00 38.64 H new ATOM 0 HB3 ASN B 112 57.709 18.126 16.354 1.00 38.64 H new ATOM 0 HD21 ASN B 112 59.452 15.386 17.028 1.00 43.70 H new ATOM 0 HD22 ASN B 112 58.775 16.222 15.998 1.00 43.70 H new ATOM 2417 N ASP B 113 59.938 20.830 18.146 1.00 35.46 N ATOM 2418 CA ASP B 113 61.331 21.213 18.097 1.00 34.67 C ATOM 2419 C ASP B 113 62.056 21.125 19.444 1.00 34.65 C ATOM 2420 O ASP B 113 63.287 21.275 19.518 1.00 35.99 O ATOM 2421 CB ASP B 113 61.405 22.630 17.493 1.00 34.54 C ATOM 2422 CG ASP B 113 61.163 23.767 18.519 1.00 35.37 C ATOM 2423 OD1 ASP B 113 60.130 23.814 19.270 1.00 28.70 O ATOM 2424 OD2 ASP B 113 62.044 24.661 18.528 1.00 34.88 O ATOM 0 H ASP B 113 59.403 21.473 18.347 1.00 35.46 H new ATOM 0 HA ASP B 113 61.804 20.575 17.540 1.00 34.67 H new ATOM 0 HB2 ASP B 113 62.277 22.753 17.087 1.00 34.54 H new ATOM 0 HB3 ASP B 113 60.749 22.703 16.782 1.00 34.54 H new ATOM 2425 N GLY B 114 61.298 20.864 20.509 1.00 34.72 N ATOM 2426 CA GLY B 114 61.888 20.767 21.834 1.00 32.86 C ATOM 2427 C GLY B 114 61.784 22.034 22.674 1.00 31.44 C ATOM 2428 O GLY B 114 62.345 22.081 23.768 1.00 32.69 O ATOM 0 H GLY B 114 60.447 20.741 20.482 1.00 34.72 H new ATOM 0 HA2 GLY B 114 61.459 20.041 22.313 1.00 32.86 H new ATOM 0 HA3 GLY B 114 62.824 20.532 21.741 1.00 32.86 H new ATOM 2429 N TYR B 115 61.092 23.058 22.179 1.00 30.06 N ATOM 2430 CA TYR B 115 60.913 24.298 22.939 1.00 28.37 C ATOM 2431 C TYR B 115 59.509 24.831 22.672 1.00 26.74 C ATOM 2432 O TYR B 115 58.993 24.704 21.578 1.00 25.96 O ATOM 2433 CB TYR B 115 61.890 25.397 22.501 1.00 32.38 C ATOM 2434 CG TYR B 115 63.357 25.107 22.664 1.00 34.03 C ATOM 2435 CD1 TYR B 115 63.996 25.369 23.854 1.00 36.23 C ATOM 2436 CD2 TYR B 115 64.108 24.579 21.617 1.00 37.83 C ATOM 2437 CE1 TYR B 115 65.340 25.121 24.019 1.00 37.97 C ATOM 2438 CE2 TYR B 115 65.475 24.320 21.769 1.00 37.42 C ATOM 2439 CZ TYR B 115 66.077 24.597 22.977 1.00 39.37 C ATOM 2440 OH TYR B 115 67.426 24.355 23.181 1.00 43.14 O ATOM 0 H TYR B 115 60.717 23.057 21.405 1.00 30.06 H new ATOM 0 HA TYR B 115 61.067 24.089 23.873 1.00 28.37 H new ATOM 0 HB2 TYR B 115 61.723 25.594 21.566 1.00 32.38 H new ATOM 0 HB3 TYR B 115 61.684 26.202 23.002 1.00 32.38 H new ATOM 0 HD1 TYR B 115 63.509 25.722 24.563 1.00 36.23 H new ATOM 0 HD2 TYR B 115 63.695 24.396 20.804 1.00 37.83 H new ATOM 0 HE1 TYR B 115 65.751 25.307 24.832 1.00 37.97 H new ATOM 0 HE2 TYR B 115 65.970 23.966 21.065 1.00 37.42 H new ATOM 0 HH TYR B 115 67.763 24.038 22.480 1.00 43.14 H new ATOM 2441 N ILE B 116 58.870 25.407 23.677 1.00 23.50 N ATOM 2442 CA ILE B 116 57.577 26.024 23.445 1.00 23.70 C ATOM 2443 C ILE B 116 57.896 27.511 23.322 1.00 24.16 C ATOM 2444 O ILE B 116 58.402 28.114 24.265 1.00 24.83 O ATOM 2445 CB ILE B 116 56.623 25.875 24.635 1.00 23.07 C ATOM 2446 CG1 ILE B 116 56.380 24.388 24.939 1.00 21.72 C ATOM 2447 CG2 ILE B 116 55.330 26.592 24.312 1.00 20.54 C ATOM 2448 CD1 ILE B 116 55.779 24.139 26.349 1.00 21.34 C ATOM 0 H ILE B 116 59.160 25.452 24.485 1.00 23.50 H new ATOM 0 HA ILE B 116 57.148 25.618 22.676 1.00 23.70 H new ATOM 0 HB ILE B 116 57.014 26.272 25.429 1.00 23.07 H new ATOM 0 HG12 ILE B 116 55.781 24.021 24.270 1.00 21.72 H new ATOM 0 HG13 ILE B 116 57.219 23.907 24.863 1.00 21.72 H new ATOM 0 HG21 ILE B 116 54.716 26.505 25.058 1.00 20.54 H new ATOM 0 HG22 ILE B 116 55.512 27.531 24.151 1.00 20.54 H new ATOM 0 HG23 ILE B 116 54.932 26.200 23.519 1.00 20.54 H new ATOM 0 HD11 ILE B 116 55.649 23.187 26.482 1.00 21.34 H new ATOM 0 HD12 ILE B 116 56.386 24.479 27.025 1.00 21.34 H new ATOM 0 HD13 ILE B 116 54.926 24.595 26.422 1.00 21.34 H new ATOM 2449 N THR B 117 57.609 28.117 22.180 1.00 24.04 N ATOM 2450 CA THR B 117 57.868 29.546 22.041 1.00 23.27 C ATOM 2451 C THR B 117 56.652 30.255 22.566 1.00 22.51 C ATOM 2452 O THR B 117 55.581 29.656 22.713 1.00 21.46 O ATOM 2453 CB THR B 117 57.952 29.973 20.563 1.00 23.73 C ATOM 2454 OG1 THR B 117 56.660 29.778 19.970 1.00 23.03 O ATOM 2455 CG2 THR B 117 58.966 29.170 19.819 1.00 21.56 C ATOM 0 H THR B 117 57.272 27.733 21.488 1.00 24.04 H new ATOM 0 HA THR B 117 58.698 29.751 22.499 1.00 23.27 H new ATOM 0 HB THR B 117 58.221 30.904 20.517 1.00 23.73 H new ATOM 0 HG1 THR B 117 56.417 30.486 19.588 1.00 23.03 H new ATOM 0 HG21 THR B 117 58.995 29.462 18.894 1.00 21.56 H new ATOM 0 HG22 THR B 117 59.838 29.294 20.224 1.00 21.56 H new ATOM 0 HG23 THR B 117 58.725 28.231 19.854 1.00 21.56 H new ATOM 2456 N ARG B 118 56.799 31.553 22.813 1.00 23.47 N ATOM 2457 CA ARG B 118 55.668 32.353 23.243 1.00 25.34 C ATOM 2458 C ARG B 118 54.505 32.271 22.228 1.00 22.50 C ATOM 2459 O ARG B 118 53.350 32.093 22.625 1.00 21.40 O ATOM 2460 CB ARG B 118 56.114 33.823 23.446 1.00 28.38 C ATOM 2461 CG ARG B 118 54.997 34.759 23.813 1.00 33.60 C ATOM 2462 CD ARG B 118 55.477 36.213 23.948 1.00 38.16 C ATOM 2463 NE ARG B 118 54.352 37.148 24.069 1.00 39.84 N ATOM 2464 CZ ARG B 118 53.447 37.362 23.115 1.00 41.62 C ATOM 2465 NH1 ARG B 118 53.528 36.709 21.960 1.00 41.76 N ATOM 2466 NH2 ARG B 118 52.463 38.229 23.317 1.00 40.68 N ATOM 0 H ARG B 118 57.540 31.983 22.737 1.00 23.47 H new ATOM 0 HA ARG B 118 55.345 32.000 24.087 1.00 25.34 H new ATOM 0 HB2 ARG B 118 56.789 33.853 24.142 1.00 28.38 H new ATOM 0 HB3 ARG B 118 56.533 34.139 22.630 1.00 28.38 H new ATOM 0 HG2 ARG B 118 54.302 34.711 23.138 1.00 33.60 H new ATOM 0 HG3 ARG B 118 54.599 34.473 24.650 1.00 33.60 H new ATOM 0 HD2 ARG B 118 56.050 36.294 24.726 1.00 38.16 H new ATOM 0 HD3 ARG B 118 56.013 36.450 23.175 1.00 38.16 H new ATOM 0 HE ARG B 118 54.272 37.587 24.804 1.00 39.84 H new ATOM 0 HH11 ARG B 118 54.165 36.147 21.827 1.00 41.76 H new ATOM 0 HH12 ARG B 118 52.943 36.848 21.345 1.00 41.76 H new ATOM 0 HH21 ARG B 118 52.410 38.653 24.064 1.00 40.68 H new ATOM 0 HH22 ARG B 118 51.879 38.367 22.701 1.00 40.68 H new ATOM 2467 N ASN B 119 54.794 32.378 20.930 1.00 23.43 N ATOM 2468 CA ASN B 119 53.724 32.309 19.919 1.00 22.97 C ATOM 2469 C ASN B 119 53.037 30.926 19.842 1.00 21.25 C ATOM 2470 O ASN B 119 51.834 30.848 19.571 1.00 20.96 O ATOM 2471 CB ASN B 119 54.262 32.745 18.537 1.00 25.91 C ATOM 2472 CG ASN B 119 54.512 34.261 18.466 1.00 28.22 C ATOM 2473 OD1 ASN B 119 54.081 35.012 19.345 1.00 30.47 O ATOM 2474 ND2 ASN B 119 55.188 34.712 17.416 1.00 30.05 N ATOM 0 H ASN B 119 55.586 32.489 20.614 1.00 23.43 H new ATOM 0 HA ASN B 119 53.034 32.929 20.202 1.00 22.97 H new ATOM 0 HB2 ASN B 119 55.088 32.273 18.349 1.00 25.91 H new ATOM 0 HB3 ASN B 119 53.627 32.490 17.849 1.00 25.91 H new ATOM 0 HD21 ASN B 119 55.339 35.554 17.331 1.00 30.05 H new ATOM 0 HD22 ASN B 119 55.475 34.162 16.821 1.00 30.05 H new ATOM 2475 N GLU B 120 53.778 29.855 20.083 1.00 21.17 N ATOM 2476 CA GLU B 120 53.138 28.529 20.073 1.00 22.55 C ATOM 2477 C GLU B 120 52.181 28.446 21.262 1.00 21.87 C ATOM 2478 O GLU B 120 51.054 27.984 21.116 1.00 22.19 O ATOM 2479 CB GLU B 120 54.165 27.419 20.172 1.00 21.67 C ATOM 2480 CG GLU B 120 54.849 27.076 18.860 1.00 25.26 C ATOM 2481 CD GLU B 120 55.970 26.106 19.074 1.00 27.08 C ATOM 2482 OE1 GLU B 120 56.529 26.146 20.180 1.00 27.28 O ATOM 2483 OE2 GLU B 120 56.301 25.306 18.166 1.00 27.88 O ATOM 0 H GLU B 120 54.622 29.861 20.250 1.00 21.17 H new ATOM 0 HA GLU B 120 52.660 28.417 19.237 1.00 22.55 H new ATOM 0 HB2 GLU B 120 54.841 27.676 20.819 1.00 21.67 H new ATOM 0 HB3 GLU B 120 53.732 26.622 20.516 1.00 21.67 H new ATOM 0 HG2 GLU B 120 54.202 26.697 18.244 1.00 25.26 H new ATOM 0 HG3 GLU B 120 55.192 27.885 18.449 1.00 25.26 H new ATOM 2484 N MET B 121 52.616 28.938 22.436 1.00 21.69 N ATOM 2485 CA MET B 121 51.736 28.898 23.588 1.00 20.31 C ATOM 2486 C MET B 121 50.558 29.825 23.331 1.00 20.84 C ATOM 2487 O MET B 121 49.417 29.508 23.684 1.00 18.83 O ATOM 2488 CB MET B 121 52.472 29.294 24.883 1.00 21.81 C ATOM 2489 CG MET B 121 51.581 29.067 26.069 1.00 26.54 C ATOM 2490 SD MET B 121 52.429 29.239 27.651 1.00 30.22 S ATOM 2491 CE MET B 121 53.258 27.628 27.724 1.00 29.67 C ATOM 0 H MET B 121 53.391 29.285 22.572 1.00 21.69 H new ATOM 0 HA MET B 121 51.421 27.989 23.713 1.00 20.31 H new ATOM 0 HB2 MET B 121 53.285 28.772 24.975 1.00 21.81 H new ATOM 0 HB3 MET B 121 52.737 30.226 24.841 1.00 21.81 H new ATOM 0 HG2 MET B 121 50.844 29.696 26.036 1.00 26.54 H new ATOM 0 HG3 MET B 121 51.198 28.178 26.011 1.00 26.54 H new ATOM 0 HE1 MET B 121 53.459 27.409 28.647 1.00 29.67 H new ATOM 0 HE2 MET B 121 52.677 26.948 27.350 1.00 29.67 H new ATOM 0 HE3 MET B 121 54.082 27.665 27.214 1.00 29.67 H new ATOM 2492 N LEU B 122 50.825 30.967 22.690 1.00 20.21 N ATOM 2493 CA LEU B 122 49.760 31.901 22.362 1.00 22.65 C ATOM 2494 C LEU B 122 48.715 31.211 21.457 1.00 20.87 C ATOM 2495 O LEU B 122 47.528 31.405 21.656 1.00 21.14 O ATOM 2496 CB LEU B 122 50.339 33.165 21.691 1.00 20.48 C ATOM 2497 CG LEU B 122 49.346 34.282 21.391 1.00 25.11 C ATOM 2498 CD1 LEU B 122 48.748 34.823 22.667 1.00 25.86 C ATOM 2499 CD2 LEU B 122 50.095 35.413 20.685 1.00 25.60 C ATOM 0 H LEU B 122 51.611 31.213 22.441 1.00 20.21 H new ATOM 0 HA LEU B 122 49.317 32.179 23.179 1.00 22.65 H new ATOM 0 HB2 LEU B 122 51.036 33.522 22.263 1.00 20.48 H new ATOM 0 HB3 LEU B 122 50.762 32.902 20.859 1.00 20.48 H new ATOM 0 HG LEU B 122 48.632 33.932 20.835 1.00 25.11 H new ATOM 0 HD11 LEU B 122 48.120 35.531 22.455 1.00 25.86 H new ATOM 0 HD12 LEU B 122 48.285 34.111 23.135 1.00 25.86 H new ATOM 0 HD13 LEU B 122 49.454 35.175 23.231 1.00 25.86 H new ATOM 0 HD21 LEU B 122 49.478 36.135 20.485 1.00 25.60 H new ATOM 0 HD22 LEU B 122 50.802 35.743 21.262 1.00 25.60 H new ATOM 0 HD23 LEU B 122 50.480 35.080 19.859 1.00 25.60 H new ATOM 2500 N ASP B 123 49.164 30.402 20.502 1.00 23.63 N ATOM 2501 CA ASP B 123 48.258 29.646 19.603 1.00 23.88 C ATOM 2502 C ASP B 123 47.278 28.768 20.408 1.00 24.16 C ATOM 2503 O ASP B 123 46.043 28.769 20.207 1.00 22.97 O ATOM 2504 CB ASP B 123 49.085 28.727 18.714 1.00 29.47 C ATOM 2505 CG ASP B 123 49.030 29.119 17.259 1.00 34.72 C ATOM 2506 OD1 ASP B 123 48.190 29.990 16.927 1.00 37.08 O ATOM 2507 OD2 ASP B 123 49.829 28.552 16.459 1.00 39.51 O ATOM 0 H ASP B 123 50.000 30.268 20.348 1.00 23.63 H new ATOM 0 HA ASP B 123 47.756 30.288 19.076 1.00 23.88 H new ATOM 0 HB2 ASP B 123 50.008 28.738 19.013 1.00 29.47 H new ATOM 0 HB3 ASP B 123 48.766 27.816 18.812 1.00 29.47 H new ATOM 2508 N ILE B 124 47.857 28.006 21.327 1.00 23.89 N ATOM 2509 CA ILE B 124 47.088 27.109 22.168 1.00 23.78 C ATOM 2510 C ILE B 124 46.134 27.833 23.068 1.00 21.01 C ATOM 2511 O ILE B 124 44.976 27.469 23.144 1.00 22.02 O ATOM 2512 CB ILE B 124 48.041 26.214 23.049 1.00 25.29 C ATOM 2513 CG1 ILE B 124 48.953 25.368 22.141 1.00 26.95 C ATOM 2514 CG2 ILE B 124 47.221 25.325 23.966 1.00 25.05 C ATOM 2515 CD1 ILE B 124 48.214 24.457 21.132 1.00 28.04 C ATOM 0 H ILE B 124 48.704 27.996 21.478 1.00 23.89 H new ATOM 0 HA ILE B 124 46.570 26.553 21.565 1.00 23.78 H new ATOM 0 HB ILE B 124 48.599 26.787 23.598 1.00 25.29 H new ATOM 0 HG12 ILE B 124 49.538 25.964 21.648 1.00 26.95 H new ATOM 0 HG13 ILE B 124 49.519 24.814 22.701 1.00 26.95 H new ATOM 0 HG21 ILE B 124 47.815 24.779 24.504 1.00 25.05 H new ATOM 0 HG22 ILE B 124 46.675 25.876 24.548 1.00 25.05 H new ATOM 0 HG23 ILE B 124 46.648 24.751 23.433 1.00 25.05 H new ATOM 0 HD11 ILE B 124 48.863 23.964 20.605 1.00 28.04 H new ATOM 0 HD12 ILE B 124 47.648 23.833 21.613 1.00 28.04 H new ATOM 0 HD13 ILE B 124 47.667 25.002 20.544 1.00 28.04 H new ATOM 2516 N VAL B 125 46.605 28.874 23.761 1.00 20.90 N ATOM 2517 CA VAL B 125 45.739 29.599 24.698 1.00 21.24 C ATOM 2518 C VAL B 125 44.590 30.299 23.959 1.00 19.76 C ATOM 2519 O VAL B 125 43.430 30.294 24.394 1.00 17.77 O ATOM 2520 CB VAL B 125 46.573 30.622 25.537 1.00 22.06 C ATOM 2521 CG1 VAL B 125 45.690 31.413 26.426 1.00 22.53 C ATOM 2522 CG2 VAL B 125 47.614 29.869 26.318 1.00 25.25 C ATOM 0 H VAL B 125 47.409 29.173 23.705 1.00 20.90 H new ATOM 0 HA VAL B 125 45.347 28.955 25.308 1.00 21.24 H new ATOM 0 HB VAL B 125 47.016 31.251 24.946 1.00 22.06 H new ATOM 0 HG11 VAL B 125 46.224 32.041 26.937 1.00 22.53 H new ATOM 0 HG12 VAL B 125 45.044 31.900 25.891 1.00 22.53 H new ATOM 0 HG13 VAL B 125 45.223 30.817 27.033 1.00 22.53 H new ATOM 0 HG21 VAL B 125 48.139 30.493 26.843 1.00 25.25 H new ATOM 0 HG22 VAL B 125 47.179 29.235 26.909 1.00 25.25 H new ATOM 0 HG23 VAL B 125 48.196 29.393 25.706 1.00 25.25 H new ATOM 2523 N ASP B 126 44.910 30.898 22.828 1.00 20.61 N ATOM 2524 CA ASP B 126 43.858 31.509 22.022 1.00 20.82 C ATOM 2525 C ASP B 126 42.807 30.424 21.641 1.00 18.11 C ATOM 2526 O ASP B 126 41.589 30.636 21.764 1.00 20.19 O ATOM 2527 CB ASP B 126 44.432 32.135 20.747 1.00 21.74 C ATOM 2528 CG ASP B 126 43.319 32.588 19.799 1.00 24.59 C ATOM 2529 OD1 ASP B 126 42.717 33.659 20.046 1.00 24.69 O ATOM 2530 OD2 ASP B 126 43.015 31.832 18.841 1.00 24.40 O ATOM 0 H ASP B 126 45.706 30.964 22.511 1.00 20.61 H new ATOM 0 HA ASP B 126 43.439 32.212 22.544 1.00 20.82 H new ATOM 0 HB2 ASP B 126 44.990 32.894 20.980 1.00 21.74 H new ATOM 0 HB3 ASP B 126 45.001 31.492 20.297 1.00 21.74 H new ATOM 2531 N ALA B 127 43.258 29.248 21.227 1.00 19.56 N ATOM 2532 CA ALA B 127 42.310 28.169 20.901 1.00 17.69 C ATOM 2533 C ALA B 127 41.436 27.833 22.104 1.00 20.18 C ATOM 2534 O ALA B 127 40.239 27.570 21.952 1.00 19.68 O ATOM 2535 CB ALA B 127 43.035 26.954 20.458 1.00 18.82 C ATOM 0 H ALA B 127 44.088 29.048 21.127 1.00 19.56 H new ATOM 0 HA ALA B 127 41.742 28.481 20.179 1.00 17.69 H new ATOM 0 HB1 ALA B 127 42.397 26.255 20.248 1.00 18.82 H new ATOM 0 HB2 ALA B 127 43.560 27.160 19.669 1.00 18.82 H new ATOM 0 HB3 ALA B 127 43.623 26.651 21.167 1.00 18.82 H new ATOM 2536 N ILE B 128 42.019 27.857 23.309 1.00 21.45 N ATOM 2537 CA ILE B 128 41.237 27.578 24.524 1.00 22.22 C ATOM 2538 C ILE B 128 40.211 28.670 24.742 1.00 21.87 C ATOM 2539 O ILE B 128 39.040 28.387 24.996 1.00 24.83 O ATOM 2540 CB ILE B 128 42.147 27.468 25.784 1.00 22.58 C ATOM 2541 CG1 ILE B 128 43.014 26.209 25.670 1.00 23.74 C ATOM 2542 CG2 ILE B 128 41.290 27.400 27.056 1.00 24.42 C ATOM 2543 CD1 ILE B 128 44.087 26.092 26.782 1.00 24.62 C ATOM 0 H ILE B 128 42.851 28.029 23.445 1.00 21.45 H new ATOM 0 HA ILE B 128 40.793 26.725 24.395 1.00 22.22 H new ATOM 0 HB ILE B 128 42.716 28.252 25.838 1.00 22.58 H new ATOM 0 HG12 ILE B 128 42.441 25.427 25.700 1.00 23.74 H new ATOM 0 HG13 ILE B 128 43.453 26.205 24.805 1.00 23.74 H new ATOM 0 HG21 ILE B 128 41.868 27.332 27.832 1.00 24.42 H new ATOM 0 HG22 ILE B 128 40.749 28.202 27.125 1.00 24.42 H new ATOM 0 HG23 ILE B 128 40.711 26.623 27.015 1.00 24.42 H new ATOM 0 HD11 ILE B 128 44.599 25.278 26.654 1.00 24.62 H new ATOM 0 HD12 ILE B 128 44.681 26.857 26.740 1.00 24.62 H new ATOM 0 HD13 ILE B 128 43.653 26.067 27.649 1.00 24.62 H new ATOM 2544 N TYR B 129 40.630 29.927 24.643 1.00 24.79 N ATOM 2545 CA TYR B 129 39.687 31.023 24.840 1.00 24.74 C ATOM 2546 C TYR B 129 38.565 30.927 23.817 1.00 26.76 C ATOM 2547 O TYR B 129 37.398 31.066 24.176 1.00 28.57 O ATOM 2548 CB TYR B 129 40.390 32.383 24.737 1.00 25.70 C ATOM 2549 CG TYR B 129 41.093 32.823 26.023 1.00 25.70 C ATOM 2550 CD1 TYR B 129 41.910 31.945 26.729 1.00 26.92 C ATOM 2551 CD2 TYR B 129 40.963 34.131 26.511 1.00 26.82 C ATOM 2552 CE1 TYR B 129 42.585 32.357 27.900 1.00 27.27 C ATOM 2553 CE2 TYR B 129 41.640 34.557 27.678 1.00 25.30 C ATOM 2554 CZ TYR B 129 42.443 33.663 28.366 1.00 27.28 C ATOM 2555 OH TYR B 129 43.058 34.035 29.556 1.00 28.22 O ATOM 0 H TYR B 129 41.438 30.164 24.467 1.00 24.79 H new ATOM 0 HA TYR B 129 39.313 30.949 25.732 1.00 24.74 H new ATOM 0 HB2 TYR B 129 41.042 32.345 24.020 1.00 25.70 H new ATOM 0 HB3 TYR B 129 39.736 33.056 24.491 1.00 25.70 H new ATOM 0 HD1 TYR B 129 42.013 31.072 26.425 1.00 26.92 H new ATOM 0 HD2 TYR B 129 40.419 34.733 26.057 1.00 26.82 H new ATOM 0 HE1 TYR B 129 43.125 31.756 28.361 1.00 27.27 H new ATOM 0 HE2 TYR B 129 41.546 35.431 27.981 1.00 25.30 H new ATOM 0 HH TYR B 129 42.742 34.768 29.818 1.00 28.22 H new ATOM 2556 N GLN B 130 38.903 30.673 22.547 1.00 26.07 N ATOM 2557 CA GLN B 130 37.867 30.567 21.515 1.00 28.18 C ATOM 2558 C GLN B 130 36.898 29.432 21.854 1.00 28.69 C ATOM 2559 O GLN B 130 35.690 29.555 21.654 1.00 27.42 O ATOM 2560 CB GLN B 130 38.472 30.291 20.118 1.00 28.42 C ATOM 2561 CG GLN B 130 39.276 31.450 19.487 1.00 27.72 C ATOM 2562 CD GLN B 130 39.370 31.376 17.944 1.00 30.29 C ATOM 2563 OE1 GLN B 130 40.486 31.356 17.369 1.00 29.07 O ATOM 2564 NE2 GLN B 130 38.197 31.347 17.265 1.00 25.50 N ATOM 0 H GLN B 130 39.709 30.561 22.268 1.00 26.07 H new ATOM 0 HA GLN B 130 37.401 31.417 21.492 1.00 28.18 H new ATOM 0 HB2 GLN B 130 39.052 29.517 20.184 1.00 28.42 H new ATOM 0 HB3 GLN B 130 37.751 30.055 19.514 1.00 28.42 H new ATOM 0 HG2 GLN B 130 38.865 32.292 19.738 1.00 27.72 H new ATOM 0 HG3 GLN B 130 40.172 31.450 19.858 1.00 27.72 H new ATOM 0 HE21 GLN B 130 37.452 31.362 17.694 1.00 25.50 H new ATOM 0 HE22 GLN B 130 38.198 31.313 16.406 1.00 25.50 H new ATOM 2565 N MET B 131 37.421 28.335 22.389 1.00 28.48 N ATOM 2566 CA MET B 131 36.566 27.212 22.710 1.00 29.58 C ATOM 2567 C MET B 131 35.617 27.524 23.865 1.00 30.45 C ATOM 2568 O MET B 131 34.428 27.167 23.847 1.00 28.68 O ATOM 2569 CB MET B 131 37.430 25.973 23.002 1.00 30.12 C ATOM 2570 CG MET B 131 36.641 24.705 23.246 1.00 30.40 C ATOM 2571 SD MET B 131 37.734 23.290 23.461 1.00 31.48 S ATOM 2572 CE AMET B 131 38.248 22.965 21.835 0.50 33.12 C ATOM 2573 CE BMET B 131 38.527 23.707 25.038 0.50 29.47 C ATOM 0 H MET B 131 38.255 28.225 22.570 1.00 28.48 H new ATOM 0 HA MET B 131 36.003 27.027 21.942 1.00 29.58 H new ATOM 0 HB2 MET B 131 38.031 25.828 22.255 1.00 30.12 H new ATOM 0 HB3 MET B 131 37.982 26.153 23.779 1.00 30.12 H new ATOM 0 HG2 MET B 131 36.087 24.812 24.035 1.00 30.40 H new ATOM 0 HG3 MET B 131 36.043 24.544 22.500 1.00 30.40 H new ATOM 0 HE1AMET B 131 38.968 22.315 21.847 0.50 29.47 H new ATOM 0 HE1BMET B 131 38.942 22.914 25.411 0.50 29.47 H new ATOM 0 HE2AMET B 131 37.503 22.612 21.324 0.50 29.47 H new ATOM 0 HE2BMET B 131 39.203 24.387 24.891 0.50 29.47 H new ATOM 0 HE3AMET B 131 38.561 23.786 21.424 0.50 29.47 H new ATOM 0 HE3BMET B 131 37.860 24.044 25.657 0.50 29.47 H new ATOM 2574 N VAL B 132 36.132 28.223 24.861 1.00 32.73 N ATOM 2575 CA VAL B 132 35.324 28.582 26.005 1.00 35.44 C ATOM 2576 C VAL B 132 34.293 29.624 25.572 1.00 37.04 C ATOM 2577 O VAL B 132 33.131 29.569 25.979 1.00 35.89 O ATOM 2578 CB VAL B 132 36.210 29.150 27.133 1.00 36.09 C ATOM 2579 CG1 VAL B 132 35.336 29.826 28.195 1.00 36.61 C ATOM 2580 CG2 VAL B 132 37.054 28.025 27.735 1.00 35.41 C ATOM 0 H VAL B 132 36.946 28.498 24.892 1.00 32.73 H new ATOM 0 HA VAL B 132 34.872 27.793 26.343 1.00 35.44 H new ATOM 0 HB VAL B 132 36.811 29.821 26.773 1.00 36.09 H new ATOM 0 HG11 VAL B 132 35.900 30.180 28.900 1.00 36.61 H new ATOM 0 HG12 VAL B 132 34.834 30.550 27.788 1.00 36.61 H new ATOM 0 HG13 VAL B 132 34.720 29.176 28.569 1.00 36.61 H new ATOM 0 HG21 VAL B 132 37.611 28.382 28.444 1.00 35.41 H new ATOM 0 HG22 VAL B 132 36.470 27.340 28.097 1.00 35.41 H new ATOM 0 HG23 VAL B 132 37.617 27.638 27.046 1.00 35.41 H new ATOM 2581 N GLY B 133 34.723 30.539 24.706 1.00 39.06 N ATOM 2582 CA GLY B 133 33.853 31.598 24.236 1.00 43.29 C ATOM 2583 C GLY B 133 33.808 32.663 25.311 1.00 47.04 C ATOM 2584 O GLY B 133 34.501 32.551 26.327 1.00 47.00 O ATOM 0 H GLY B 133 35.519 30.559 24.381 1.00 39.06 H new ATOM 0 HA2 GLY B 133 34.186 31.968 23.403 1.00 43.29 H new ATOM 0 HA3 GLY B 133 32.963 31.255 24.059 1.00 43.29 H new ATOM 2585 N ASN B 134 33.000 33.696 25.118 1.00 50.50 N ATOM 2586 CA ASN B 134 32.911 34.751 26.124 1.00 54.19 C ATOM 2587 C ASN B 134 31.513 34.833 26.748 1.00 56.31 C ATOM 2588 O ASN B 134 30.877 35.889 26.736 1.00 56.87 O ATOM 2589 CB ASN B 134 33.276 36.089 25.494 1.00 55.07 C ATOM 2590 CG ASN B 134 32.276 36.517 24.455 1.00 56.08 C ATOM 2591 OD1 ASN B 134 31.900 35.728 23.583 1.00 57.17 O ATOM 2592 ND2 ASN B 134 31.834 37.770 24.536 1.00 55.67 N ATOM 0 H ASN B 134 32.502 33.807 24.426 1.00 50.50 H new ATOM 0 HA ASN B 134 33.536 34.537 26.835 1.00 54.19 H new ATOM 0 HB2 ASN B 134 33.332 36.766 26.186 1.00 55.07 H new ATOM 0 HB3 ASN B 134 34.155 36.025 25.088 1.00 55.07 H new ATOM 0 HD21 ASN B 134 31.261 38.062 23.965 1.00 55.67 H new ATOM 0 HD22 ASN B 134 32.121 38.288 25.159 1.00 55.67 H new ATOM 2593 N THR B 135 31.036 33.716 27.292 1.00 58.34 N ATOM 2594 CA THR B 135 29.719 33.692 27.917 1.00 60.03 C ATOM 2595 C THR B 135 29.875 34.207 29.340 1.00 61.03 C ATOM 2596 O THR B 135 28.889 34.468 30.046 1.00 61.39 O ATOM 2597 CB THR B 135 29.134 32.270 27.954 1.00 60.46 C ATOM 2598 OG1 THR B 135 29.129 31.723 26.626 1.00 61.57 O ATOM 2599 CG2 THR B 135 27.698 32.299 28.492 1.00 60.44 C ATOM 0 H THR B 135 31.457 32.966 27.309 1.00 58.34 H new ATOM 0 HA THR B 135 29.111 34.245 27.401 1.00 60.03 H new ATOM 0 HB THR B 135 29.680 31.721 28.538 1.00 60.46 H new ATOM 0 HG1 THR B 135 28.690 31.007 26.619 1.00 61.57 H new ATOM 0 HG21 THR B 135 27.341 31.397 28.510 1.00 60.44 H new ATOM 0 HG22 THR B 135 27.696 32.665 29.390 1.00 60.44 H new ATOM 0 HG23 THR B 135 27.148 32.853 27.916 1.00 60.44 H new ATOM 2600 N VAL B 136 31.129 34.352 29.748 1.00 61.10 N ATOM 2601 CA VAL B 136 31.448 34.854 31.073 1.00 61.83 C ATOM 2602 C VAL B 136 32.372 36.055 30.891 1.00 61.68 C ATOM 2603 O VAL B 136 32.635 36.480 29.760 1.00 62.95 O ATOM 2604 CB VAL B 136 32.151 33.766 31.911 1.00 62.50 C ATOM 2605 CG1 VAL B 136 32.300 34.229 33.365 1.00 63.09 C ATOM 2606 CG2 VAL B 136 31.349 32.465 31.832 1.00 62.11 C ATOM 0 H VAL B 136 31.815 34.163 29.266 1.00 61.10 H new ATOM 0 HA VAL B 136 30.638 35.108 31.543 1.00 61.83 H new ATOM 0 HB VAL B 136 33.039 33.608 31.555 1.00 62.50 H new ATOM 0 HG11 VAL B 136 32.743 33.537 33.881 1.00 63.09 H new ATOM 0 HG12 VAL B 136 32.829 35.042 33.393 1.00 63.09 H new ATOM 0 HG13 VAL B 136 31.423 34.401 33.741 1.00 63.09 H new ATOM 0 HG21 VAL B 136 31.790 31.780 32.359 1.00 62.11 H new ATOM 0 HG22 VAL B 136 30.456 32.614 32.179 1.00 62.11 H new ATOM 0 HG23 VAL B 136 31.292 32.175 30.908 1.00 62.11 H new ATOM 2607 N GLU B 137 32.848 36.615 31.994 1.00 60.33 N ATOM 2608 CA GLU B 137 33.747 37.757 31.925 1.00 58.58 C ATOM 2609 C GLU B 137 34.939 37.414 32.805 1.00 56.30 C ATOM 2610 O GLU B 137 34.807 37.246 34.021 1.00 56.67 O ATOM 2611 CB GLU B 137 33.047 39.009 32.441 1.00 60.26 C ATOM 2612 CG GLU B 137 33.545 40.294 31.817 1.00 62.33 C ATOM 2613 CD GLU B 137 32.838 41.513 32.383 1.00 64.14 C ATOM 2614 OE1 GLU B 137 31.584 41.526 32.378 1.00 64.39 O ATOM 2615 OE2 GLU B 137 33.532 42.456 32.835 1.00 65.61 O ATOM 0 H GLU B 137 32.663 36.350 32.791 1.00 60.33 H new ATOM 0 HA GLU B 137 34.024 37.936 31.013 1.00 58.58 H new ATOM 0 HB2 GLU B 137 32.095 38.928 32.275 1.00 60.26 H new ATOM 0 HB3 GLU B 137 33.164 39.061 33.403 1.00 60.26 H new ATOM 0 HG2 GLU B 137 34.500 40.376 31.967 1.00 62.33 H new ATOM 0 HG3 GLU B 137 33.410 40.260 30.857 1.00 62.33 H new ATOM 2616 N LEU B 138 36.105 37.296 32.188 1.00 52.80 N ATOM 2617 CA LEU B 138 37.297 36.939 32.936 1.00 49.07 C ATOM 2618 C LEU B 138 37.876 38.115 33.707 1.00 45.96 C ATOM 2619 O LEU B 138 37.609 39.273 33.366 1.00 45.28 O ATOM 2620 CB LEU B 138 38.341 36.368 31.974 1.00 49.29 C ATOM 2621 CG LEU B 138 38.083 34.946 31.452 1.00 49.57 C ATOM 2622 CD1 LEU B 138 36.664 34.802 30.900 1.00 49.13 C ATOM 2623 CD2 LEU B 138 39.097 34.641 30.380 1.00 49.19 C ATOM 0 H LEU B 138 36.227 37.417 31.345 1.00 52.80 H new ATOM 0 HA LEU B 138 37.047 36.272 33.594 1.00 49.07 H new ATOM 0 HB2 LEU B 138 38.410 36.964 31.212 1.00 49.29 H new ATOM 0 HB3 LEU B 138 39.202 36.377 32.420 1.00 49.29 H new ATOM 0 HG LEU B 138 38.170 34.317 32.185 1.00 49.57 H new ATOM 0 HD11 LEU B 138 36.532 33.896 30.579 1.00 49.13 H new ATOM 0 HD12 LEU B 138 36.023 34.993 31.602 1.00 49.13 H new ATOM 0 HD13 LEU B 138 36.536 35.426 30.168 1.00 49.13 H new ATOM 0 HD21 LEU B 138 38.948 33.745 30.039 1.00 49.19 H new ATOM 0 HD22 LEU B 138 39.006 35.281 29.657 1.00 49.19 H new ATOM 0 HD23 LEU B 138 39.990 34.700 30.753 1.00 49.19 H new ATOM 2624 N PRO B 139 38.643 37.833 34.791 1.00 43.10 N ATOM 2625 CA PRO B 139 39.260 38.901 35.589 1.00 39.92 C ATOM 2626 C PRO B 139 40.112 39.653 34.570 1.00 36.38 C ATOM 2627 O PRO B 139 40.667 39.039 33.661 1.00 34.37 O ATOM 2628 CB PRO B 139 40.122 38.144 36.592 1.00 40.22 C ATOM 2629 CG PRO B 139 39.390 36.851 36.761 1.00 42.53 C ATOM 2630 CD PRO B 139 38.997 36.510 35.330 1.00 42.96 C ATOM 0 HA PRO B 139 38.669 39.515 36.053 1.00 39.92 H new ATOM 0 HB2 PRO B 139 41.022 38.006 36.259 1.00 40.22 H new ATOM 0 HB3 PRO B 139 40.201 38.624 37.431 1.00 40.22 H new ATOM 0 HG2 PRO B 139 39.952 36.166 37.155 1.00 42.53 H new ATOM 0 HG3 PRO B 139 38.615 36.947 37.336 1.00 42.53 H new ATOM 0 HD2 PRO B 139 39.727 36.101 34.840 1.00 42.96 H new ATOM 0 HD3 PRO B 139 38.251 35.891 35.295 1.00 42.96 H new ATOM 2631 N GLU B 140 40.195 40.966 34.710 1.00 33.47 N ATOM 2632 CA GLU B 140 40.951 41.774 33.772 1.00 31.30 C ATOM 2633 C GLU B 140 42.394 41.324 33.544 1.00 29.14 C ATOM 2634 O GLU B 140 42.889 41.351 32.414 1.00 27.89 O ATOM 2635 CB GLU B 140 40.916 43.236 34.229 1.00 32.48 C ATOM 2636 CG GLU B 140 41.786 44.184 33.402 1.00 32.64 C ATOM 2637 CD GLU B 140 41.711 45.610 33.924 1.00 34.27 C ATOM 2638 OE1 GLU B 140 40.661 46.259 33.728 1.00 34.37 O ATOM 2639 OE2 GLU B 140 42.700 46.081 34.540 1.00 35.50 O ATOM 0 H GLU B 140 39.819 41.409 35.344 1.00 33.47 H new ATOM 0 HA GLU B 140 40.518 41.663 32.911 1.00 31.30 H new ATOM 0 HB2 GLU B 140 39.999 43.550 34.199 1.00 32.48 H new ATOM 0 HB3 GLU B 140 41.201 43.280 35.155 1.00 32.48 H new ATOM 0 HG2 GLU B 140 42.707 43.879 33.421 1.00 32.64 H new ATOM 0 HG3 GLU B 140 41.500 44.162 32.476 1.00 32.64 H new ATOM 2640 N GLU B 141 43.072 40.875 34.591 1.00 28.06 N ATOM 2641 CA GLU B 141 44.457 40.493 34.430 1.00 27.87 C ATOM 2642 C GLU B 141 44.655 39.239 33.580 1.00 27.60 C ATOM 2643 O GLU B 141 45.780 38.917 33.192 1.00 27.17 O ATOM 2644 CB GLU B 141 45.159 40.423 35.820 1.00 32.16 C ATOM 2645 CG GLU B 141 45.247 39.101 36.549 1.00 36.34 C ATOM 2646 CD GLU B 141 45.560 39.296 38.071 1.00 40.15 C ATOM 2647 OE1 GLU B 141 46.317 40.251 38.440 1.00 39.25 O ATOM 2648 OE2 GLU B 141 45.044 38.493 38.892 1.00 41.17 O ATOM 0 H GLU B 141 42.754 40.787 35.385 1.00 28.06 H new ATOM 0 HA GLU B 141 44.894 41.188 33.914 1.00 27.87 H new ATOM 0 HB2 GLU B 141 46.065 40.751 35.704 1.00 32.16 H new ATOM 0 HB3 GLU B 141 44.704 41.048 36.406 1.00 32.16 H new ATOM 0 HG2 GLU B 141 44.410 38.621 36.450 1.00 36.34 H new ATOM 0 HG3 GLU B 141 45.938 38.554 36.144 1.00 36.34 H new ATOM 2649 N GLU B 142 43.570 38.547 33.247 1.00 26.32 N ATOM 2650 CA GLU B 142 43.710 37.388 32.387 1.00 30.00 C ATOM 2651 C GLU B 142 42.669 37.397 31.277 1.00 29.06 C ATOM 2652 O GLU B 142 42.349 36.341 30.731 1.00 30.04 O ATOM 2653 CB GLU B 142 43.631 36.064 33.190 1.00 33.90 C ATOM 2654 CG GLU B 142 42.275 35.723 33.791 1.00 38.45 C ATOM 2655 CD GLU B 142 42.405 34.867 35.061 1.00 43.19 C ATOM 2656 OE1 GLU B 142 43.254 33.934 35.082 1.00 44.32 O ATOM 2657 OE2 GLU B 142 41.659 35.134 36.038 1.00 44.16 O ATOM 0 H GLU B 142 42.768 38.727 33.501 1.00 26.32 H new ATOM 0 HA GLU B 142 44.590 37.440 31.983 1.00 30.00 H new ATOM 0 HB2 GLU B 142 43.897 35.337 32.606 1.00 33.90 H new ATOM 0 HB3 GLU B 142 44.282 36.104 33.908 1.00 33.90 H new ATOM 0 HG2 GLU B 142 41.801 36.542 34.002 1.00 38.45 H new ATOM 0 HG3 GLU B 142 41.742 35.247 33.135 1.00 38.45 H new ATOM 2658 N ASN B 143 42.194 38.590 30.893 1.00 27.81 N ATOM 2659 CA ASN B 143 41.161 38.694 29.863 1.00 25.77 C ATOM 2660 C ASN B 143 41.584 38.560 28.392 1.00 25.40 C ATOM 2661 O ASN B 143 40.758 38.727 27.480 1.00 24.14 O ATOM 2662 CB ASN B 143 40.306 39.966 30.067 1.00 27.38 C ATOM 2663 CG ASN B 143 41.033 41.274 29.711 1.00 26.17 C ATOM 2664 OD1 ASN B 143 42.149 41.300 29.198 1.00 25.85 O ATOM 2665 ND2 ASN B 143 40.353 42.377 29.974 1.00 28.09 N ATOM 0 H ASN B 143 42.457 39.343 31.216 1.00 27.81 H new ATOM 0 HA ASN B 143 40.641 37.888 30.010 1.00 25.77 H new ATOM 0 HB2 ASN B 143 39.504 39.895 29.526 1.00 27.38 H new ATOM 0 HB3 ASN B 143 40.021 40.007 30.993 1.00 27.38 H new ATOM 0 HD21 ASN B 143 40.690 43.145 29.785 1.00 28.09 H new ATOM 0 HD22 ASN B 143 39.574 42.326 30.334 1.00 28.09 H new ATOM 2666 N THR B 144 42.863 38.283 28.151 1.00 23.20 N ATOM 2667 CA THR B 144 43.332 38.047 26.801 1.00 23.60 C ATOM 2668 C THR B 144 44.322 36.902 26.833 1.00 23.01 C ATOM 2669 O THR B 144 44.997 36.683 27.839 1.00 24.38 O ATOM 2670 CB THR B 144 44.104 39.235 26.127 1.00 23.87 C ATOM 2671 OG1 THR B 144 45.298 39.540 26.868 1.00 22.21 O ATOM 2672 CG2 THR B 144 43.213 40.471 25.968 1.00 23.64 C ATOM 0 H THR B 144 43.470 38.228 28.758 1.00 23.20 H new ATOM 0 HA THR B 144 42.525 37.886 26.287 1.00 23.60 H new ATOM 0 HB THR B 144 44.362 38.957 25.234 1.00 23.87 H new ATOM 0 HG1 THR B 144 45.667 40.218 26.538 1.00 22.21 H new ATOM 0 HG21 THR B 144 43.720 41.184 25.549 1.00 23.64 H new ATOM 0 HG22 THR B 144 42.449 40.250 25.413 1.00 23.64 H new ATOM 0 HG23 THR B 144 42.905 40.763 26.840 1.00 23.64 H new ATOM 2673 N PRO B 145 44.433 36.156 25.727 1.00 22.41 N ATOM 2674 CA PRO B 145 45.378 35.039 25.667 1.00 21.97 C ATOM 2675 C PRO B 145 46.786 35.635 25.814 1.00 22.23 C ATOM 2676 O PRO B 145 47.693 35.029 26.370 1.00 21.70 O ATOM 2677 CB PRO B 145 45.171 34.461 24.244 1.00 23.71 C ATOM 2678 CG PRO B 145 43.754 34.885 23.870 1.00 20.70 C ATOM 2679 CD PRO B 145 43.660 36.280 24.466 1.00 23.02 C ATOM 0 HA PRO B 145 45.258 34.360 26.349 1.00 21.97 H new ATOM 0 HB2 PRO B 145 45.823 34.815 23.619 1.00 23.71 H new ATOM 0 HB3 PRO B 145 45.266 33.496 24.236 1.00 23.71 H new ATOM 0 HG2 PRO B 145 43.621 34.893 22.909 1.00 20.70 H new ATOM 0 HG3 PRO B 145 43.088 34.287 24.243 1.00 20.70 H new ATOM 0 HD2 PRO B 145 44.040 36.949 23.876 1.00 23.02 H new ATOM 0 HD3 PRO B 145 42.740 36.538 24.632 1.00 23.02 H new ATOM 2680 N GLU B 146 46.991 36.837 25.303 1.00 21.71 N ATOM 2681 CA GLU B 146 48.316 37.431 25.454 1.00 22.23 C ATOM 2682 C GLU B 146 48.714 37.676 26.928 1.00 20.24 C ATOM 2683 O GLU B 146 49.867 37.528 27.288 1.00 20.39 O ATOM 2684 CB GLU B 146 48.415 38.756 24.693 1.00 24.89 C ATOM 2685 CG GLU B 146 48.479 38.572 23.189 1.00 28.64 C ATOM 2686 CD GLU B 146 47.112 38.354 22.532 1.00 30.17 C ATOM 2687 OE1 GLU B 146 47.092 38.338 21.278 1.00 35.88 O ATOM 2688 OE2 GLU B 146 46.079 38.215 23.224 1.00 25.32 O ATOM 0 H GLU B 146 46.409 37.311 24.883 1.00 21.71 H new ATOM 0 HA GLU B 146 48.933 36.781 25.082 1.00 22.23 H new ATOM 0 HB2 GLU B 146 47.649 39.308 24.914 1.00 24.89 H new ATOM 0 HB3 GLU B 146 49.205 39.235 24.989 1.00 24.89 H new ATOM 0 HG2 GLU B 146 48.897 39.353 22.794 1.00 28.64 H new ATOM 0 HG3 GLU B 146 49.049 37.813 22.989 1.00 28.64 H new ATOM 2689 N LYS B 147 47.761 38.019 27.774 1.00 20.09 N ATOM 2690 CA LYS B 147 48.079 38.286 29.168 1.00 18.48 C ATOM 2691 C LYS B 147 48.360 37.000 29.919 1.00 19.48 C ATOM 2692 O LYS B 147 49.206 36.970 30.819 1.00 18.19 O ATOM 2693 CB LYS B 147 46.935 39.036 29.815 1.00 20.03 C ATOM 2694 CG LYS B 147 46.822 40.498 29.357 1.00 18.30 C ATOM 2695 CD LYS B 147 45.656 41.101 30.113 1.00 21.25 C ATOM 2696 CE LYS B 147 45.413 42.574 29.791 1.00 18.36 C ATOM 2697 NZ LYS B 147 44.133 42.904 30.455 1.00 20.86 N ATOM 0 H LYS B 147 46.930 38.103 27.567 1.00 20.09 H new ATOM 0 HA LYS B 147 48.881 38.831 29.204 1.00 18.48 H new ATOM 0 HB2 LYS B 147 46.104 38.577 29.616 1.00 20.03 H new ATOM 0 HB3 LYS B 147 47.047 39.014 30.778 1.00 20.03 H new ATOM 0 HG2 LYS B 147 47.641 40.982 29.544 1.00 18.30 H new ATOM 0 HG3 LYS B 147 46.675 40.549 28.400 1.00 18.30 H new ATOM 0 HD2 LYS B 147 44.853 40.597 29.909 1.00 21.25 H new ATOM 0 HD3 LYS B 147 45.815 41.008 31.065 1.00 21.25 H new ATOM 0 HE2 LYS B 147 46.135 43.130 30.123 1.00 18.36 H new ATOM 0 HE3 LYS B 147 45.360 42.720 28.834 1.00 18.36 H new ATOM 0 HZ1 LYS B 147 43.917 43.750 30.280 1.00 20.86 H new ATOM 0 HZ2 LYS B 147 43.493 42.366 30.150 1.00 20.86 H new ATOM 0 HZ3 LYS B 147 44.218 42.795 31.334 1.00 20.86 H new ATOM 2698 N ARG B 148 47.666 35.930 29.529 1.00 19.82 N ATOM 2699 CA ARG B 148 47.859 34.620 30.132 1.00 20.70 C ATOM 2700 C ARG B 148 49.266 34.129 29.772 1.00 20.58 C ATOM 2701 O ARG B 148 49.990 33.639 30.629 1.00 19.72 O ATOM 2702 CB ARG B 148 46.825 33.617 29.604 1.00 21.66 C ATOM 2703 CG ARG B 148 47.099 32.161 29.986 1.00 23.57 C ATOM 2704 CD ARG B 148 47.206 32.045 31.499 1.00 26.98 C ATOM 2705 NE ARG B 148 47.160 30.660 31.993 1.00 27.70 N ATOM 2706 CZ ARG B 148 47.453 30.321 33.242 1.00 29.77 C ATOM 2707 NH1 ARG B 148 47.804 31.280 34.104 1.00 28.59 N ATOM 2708 NH2 ARG B 148 47.456 29.027 33.613 1.00 32.29 N ATOM 0 H ARG B 148 47.072 35.947 28.908 1.00 19.82 H new ATOM 0 HA ARG B 148 47.751 34.691 31.093 1.00 20.70 H new ATOM 0 HB2 ARG B 148 45.949 33.867 29.937 1.00 21.66 H new ATOM 0 HB3 ARG B 148 46.790 33.685 28.637 1.00 21.66 H new ATOM 0 HG2 ARG B 148 46.386 31.591 29.658 1.00 23.57 H new ATOM 0 HG3 ARG B 148 47.920 31.856 29.570 1.00 23.57 H new ATOM 0 HD2 ARG B 148 48.036 32.455 31.789 1.00 26.98 H new ATOM 0 HD3 ARG B 148 46.484 32.549 31.905 1.00 26.98 H new ATOM 0 HE ARG B 148 46.932 30.038 31.444 1.00 27.70 H new ATOM 0 HH11 ARG B 148 47.837 32.100 33.845 1.00 28.59 H new ATOM 0 HH12 ARG B 148 47.997 31.078 34.917 1.00 28.59 H new ATOM 0 HH21 ARG B 148 47.267 28.415 33.039 1.00 32.29 H new ATOM 0 HH22 ARG B 148 47.647 28.813 34.424 1.00 32.29 H new ATOM 2709 N VAL B 149 49.635 34.247 28.503 1.00 18.94 N ATOM 2710 CA VAL B 149 50.939 33.812 28.042 1.00 19.83 C ATOM 2711 C VAL B 149 52.061 34.625 28.653 1.00 20.31 C ATOM 2712 O VAL B 149 53.122 34.096 28.975 1.00 21.41 O ATOM 2713 CB VAL B 149 51.061 33.857 26.473 1.00 18.67 C ATOM 2714 CG1 VAL B 149 52.516 33.543 26.051 1.00 19.75 C ATOM 2715 CG2 VAL B 149 50.154 32.823 25.871 1.00 21.95 C ATOM 0 H VAL B 149 49.135 34.581 27.888 1.00 18.94 H new ATOM 0 HA VAL B 149 51.025 32.891 28.335 1.00 19.83 H new ATOM 0 HB VAL B 149 50.812 34.742 26.163 1.00 18.67 H new ATOM 0 HG11 VAL B 149 52.586 33.572 25.084 1.00 19.75 H new ATOM 0 HG12 VAL B 149 53.115 34.201 26.438 1.00 19.75 H new ATOM 0 HG13 VAL B 149 52.761 32.659 26.366 1.00 19.75 H new ATOM 0 HG21 VAL B 149 50.229 32.850 24.904 1.00 21.95 H new ATOM 0 HG22 VAL B 149 50.409 31.943 26.190 1.00 21.95 H new ATOM 0 HG23 VAL B 149 49.237 33.007 26.129 1.00 21.95 H new ATOM 2716 N ASP B 150 51.854 35.916 28.830 1.00 21.77 N ATOM 2717 CA ASP B 150 52.918 36.693 29.438 1.00 22.69 C ATOM 2718 C ASP B 150 53.165 36.296 30.894 1.00 20.63 C ATOM 2719 O ASP B 150 54.309 36.278 31.345 1.00 19.70 O ATOM 2720 CB ASP B 150 52.608 38.180 29.345 1.00 26.63 C ATOM 2721 CG ASP B 150 52.758 38.702 27.911 1.00 33.88 C ATOM 2722 OD1 ASP B 150 53.544 38.086 27.102 1.00 35.36 O ATOM 2723 OD2 ASP B 150 52.103 39.730 27.611 1.00 36.28 O ATOM 0 H ASP B 150 51.141 36.347 28.617 1.00 21.77 H new ATOM 0 HA ASP B 150 53.730 36.502 28.944 1.00 22.69 H new ATOM 0 HB2 ASP B 150 51.704 38.342 29.656 1.00 26.63 H new ATOM 0 HB3 ASP B 150 53.202 38.672 29.933 1.00 26.63 H new ATOM 2724 N ARG B 151 52.102 35.979 31.616 1.00 18.02 N ATOM 2725 CA ARG B 151 52.231 35.579 33.014 1.00 18.50 C ATOM 2726 C ARG B 151 52.985 34.235 33.099 1.00 17.99 C ATOM 2727 O ARG B 151 53.916 34.069 33.895 1.00 21.34 O ATOM 2728 CB ARG B 151 50.838 35.489 33.650 1.00 18.10 C ATOM 2729 CG ARG B 151 50.808 34.908 35.056 1.00 20.32 C ATOM 2730 CD ARG B 151 51.641 35.744 36.067 1.00 21.66 C ATOM 2731 NE ARG B 151 51.402 35.208 37.409 1.00 23.78 N ATOM 2732 CZ ARG B 151 52.132 35.501 38.482 1.00 23.10 C ATOM 2733 NH1 ARG B 151 53.150 36.345 38.400 1.00 21.10 N ATOM 2734 NH2 ARG B 151 51.892 34.869 39.626 1.00 26.46 N ATOM 0 H ARG B 151 51.295 35.988 31.318 1.00 18.02 H new ATOM 0 HA ARG B 151 52.743 36.240 33.506 1.00 18.50 H new ATOM 0 HB2 ARG B 151 50.450 36.378 33.674 1.00 18.10 H new ATOM 0 HB3 ARG B 151 50.271 34.947 33.079 1.00 18.10 H new ATOM 0 HG2 ARG B 151 49.889 34.859 35.362 1.00 20.32 H new ATOM 0 HG3 ARG B 151 51.149 34.000 35.034 1.00 20.32 H new ATOM 0 HD2 ARG B 151 52.585 35.698 35.847 1.00 21.66 H new ATOM 0 HD3 ARG B 151 51.385 36.679 36.025 1.00 21.66 H new ATOM 0 HE ARG B 151 50.743 34.665 37.511 1.00 23.78 H new ATOM 0 HH11 ARG B 151 53.346 36.711 37.647 1.00 21.10 H new ATOM 0 HH12 ARG B 151 53.615 36.527 39.100 1.00 21.10 H new ATOM 0 HH21 ARG B 151 51.270 34.277 39.668 1.00 26.46 H new ATOM 0 HH22 ARG B 151 52.359 35.052 40.325 1.00 26.46 H new ATOM 2735 N ILE B 152 52.589 33.282 32.271 1.00 18.47 N ATOM 2736 CA ILE B 152 53.243 31.993 32.239 1.00 17.86 C ATOM 2737 C ILE B 152 54.730 32.125 31.958 1.00 17.51 C ATOM 2738 O ILE B 152 55.554 31.501 32.655 1.00 17.82 O ATOM 2739 CB ILE B 152 52.632 31.050 31.191 1.00 16.45 C ATOM 2740 CG1 ILE B 152 51.163 30.782 31.474 1.00 18.79 C ATOM 2741 CG2 ILE B 152 53.350 29.719 31.229 1.00 21.21 C ATOM 2742 CD1 ILE B 152 50.868 30.049 32.767 1.00 24.49 C ATOM 0 H ILE B 152 51.937 33.366 31.716 1.00 18.47 H new ATOM 0 HA ILE B 152 53.108 31.612 33.121 1.00 17.86 H new ATOM 0 HB ILE B 152 52.723 31.479 30.326 1.00 16.45 H new ATOM 0 HG12 ILE B 152 50.693 31.630 31.487 1.00 18.79 H new ATOM 0 HG13 ILE B 152 50.797 30.267 30.738 1.00 18.79 H new ATOM 0 HG21 ILE B 152 52.964 29.124 30.567 1.00 21.21 H new ATOM 0 HG22 ILE B 152 54.291 29.853 31.033 1.00 21.21 H new ATOM 0 HG23 ILE B 152 53.256 29.326 32.111 1.00 21.21 H new ATOM 0 HD11 ILE B 152 49.910 29.926 32.858 1.00 24.49 H new ATOM 0 HD12 ILE B 152 51.305 29.183 32.755 1.00 24.49 H new ATOM 0 HD13 ILE B 152 51.199 30.568 33.516 1.00 24.49 H new ATOM 2743 N PHE B 153 55.104 32.937 30.978 1.00 16.90 N ATOM 2744 CA PHE B 153 56.519 33.078 30.666 1.00 18.86 C ATOM 2745 C PHE B 153 57.275 33.878 31.715 1.00 19.84 C ATOM 2746 O PHE B 153 58.445 33.618 31.968 1.00 21.02 O ATOM 2747 CB PHE B 153 56.733 33.681 29.260 1.00 18.95 C ATOM 2748 CG PHE B 153 56.784 32.640 28.189 1.00 20.06 C ATOM 2749 CD1 PHE B 153 55.616 31.983 27.787 1.00 21.39 C ATOM 2750 CD2 PHE B 153 58.003 32.266 27.632 1.00 19.29 C ATOM 2751 CE1 PHE B 153 55.657 30.968 26.848 1.00 20.04 C ATOM 2752 CE2 PHE B 153 58.068 31.244 26.690 1.00 22.01 C ATOM 2753 CZ PHE B 153 56.892 30.592 26.293 1.00 21.67 C ATOM 0 H PHE B 153 54.570 33.405 30.492 1.00 16.90 H new ATOM 0 HA PHE B 153 56.887 32.181 30.673 1.00 18.86 H new ATOM 0 HB2 PHE B 153 56.015 34.304 29.067 1.00 18.95 H new ATOM 0 HB3 PHE B 153 57.559 34.189 29.252 1.00 18.95 H new ATOM 0 HD1 PHE B 153 54.800 32.232 28.157 1.00 21.39 H new ATOM 0 HD2 PHE B 153 58.782 32.703 27.892 1.00 19.29 H new ATOM 0 HE1 PHE B 153 54.875 30.539 26.587 1.00 20.04 H new ATOM 0 HE2 PHE B 153 58.887 30.995 26.326 1.00 22.01 H new ATOM 0 HZ PHE B 153 56.929 29.910 25.662 1.00 21.67 H new ATOM 2754 N ALA B 154 56.619 34.844 32.334 1.00 21.17 N ATOM 2755 CA ALA B 154 57.300 35.602 33.371 1.00 22.32 C ATOM 2756 C ALA B 154 57.625 34.601 34.492 1.00 22.64 C ATOM 2757 O ALA B 154 58.678 34.696 35.128 1.00 25.45 O ATOM 2758 CB ALA B 154 56.414 36.751 33.877 1.00 22.66 C ATOM 0 H ALA B 154 55.805 35.073 32.177 1.00 21.17 H new ATOM 0 HA ALA B 154 58.111 36.015 33.035 1.00 22.32 H new ATOM 0 HB1 ALA B 154 56.885 37.244 34.567 1.00 22.66 H new ATOM 0 HB2 ALA B 154 56.205 37.347 33.141 1.00 22.66 H new ATOM 0 HB3 ALA B 154 55.592 36.389 34.243 1.00 22.66 H new ATOM 2759 N MET B 155 56.768 33.596 34.700 1.00 23.05 N ATOM 2760 CA MET B 155 57.007 32.629 35.781 1.00 23.61 C ATOM 2761 C MET B 155 57.905 31.454 35.419 1.00 24.30 C ATOM 2762 O MET B 155 58.630 30.927 36.281 1.00 23.45 O ATOM 2763 CB MET B 155 55.680 32.055 36.304 1.00 25.69 C ATOM 2764 CG MET B 155 54.696 33.084 36.840 1.00 29.05 C ATOM 2765 SD MET B 155 53.049 32.361 36.962 1.00 38.37 S ATOM 2766 CE MET B 155 53.354 30.886 37.903 1.00 34.71 C ATOM 0 H MET B 155 56.056 33.457 34.238 1.00 23.05 H new ATOM 0 HA MET B 155 57.472 33.148 36.456 1.00 23.61 H new ATOM 0 HB2 MET B 155 55.252 31.562 35.586 1.00 25.69 H new ATOM 0 HB3 MET B 155 55.875 31.417 37.009 1.00 25.69 H new ATOM 0 HG2 MET B 155 54.986 33.396 37.712 1.00 29.05 H new ATOM 0 HG3 MET B 155 54.675 33.857 36.255 1.00 29.05 H new ATOM 0 HE1 MET B 155 52.619 30.737 38.518 1.00 34.71 H new ATOM 0 HE2 MET B 155 53.431 30.129 37.302 1.00 34.71 H new ATOM 0 HE3 MET B 155 54.179 30.986 38.403 1.00 34.71 H new ATOM 2767 N MET B 156 57.884 31.045 34.153 1.00 21.32 N ATOM 2768 CA MET B 156 58.637 29.876 33.759 1.00 19.81 C ATOM 2769 C MET B 156 59.887 30.025 32.925 1.00 21.02 C ATOM 2770 O MET B 156 60.730 29.146 32.958 1.00 21.28 O ATOM 2771 CB MET B 156 57.702 28.892 33.051 1.00 18.23 C ATOM 2772 CG MET B 156 56.463 28.535 33.838 1.00 18.88 C ATOM 2773 SD MET B 156 55.607 27.120 33.043 1.00 22.79 S ATOM 2774 CE MET B 156 54.115 27.129 33.917 1.00 15.07 C ATOM 0 H MET B 156 57.445 31.428 33.520 1.00 21.32 H new ATOM 0 HA MET B 156 58.986 29.572 34.611 1.00 19.81 H new ATOM 0 HB2 MET B 156 57.433 29.273 32.200 1.00 18.23 H new ATOM 0 HB3 MET B 156 58.193 28.079 32.855 1.00 18.23 H new ATOM 0 HG2 MET B 156 56.703 28.307 34.750 1.00 18.88 H new ATOM 0 HG3 MET B 156 55.868 29.299 33.884 1.00 18.88 H new ATOM 0 HE1 MET B 156 53.432 26.678 33.397 1.00 15.07 H new ATOM 0 HE2 MET B 156 54.233 26.670 34.763 1.00 15.07 H new ATOM 0 HE3 MET B 156 53.842 28.045 34.082 1.00 15.07 H new ATOM 2775 N ASP B 157 60.003 31.096 32.152 1.00 22.70 N ATOM 2776 CA ASP B 157 61.180 31.271 31.306 1.00 26.59 C ATOM 2777 C ASP B 157 62.293 31.823 32.186 1.00 29.06 C ATOM 2778 O ASP B 157 62.353 33.006 32.434 1.00 29.71 O ATOM 2779 CB ASP B 157 60.864 32.244 30.166 1.00 24.61 C ATOM 2780 CG ASP B 157 61.973 32.320 29.136 1.00 26.04 C ATOM 2781 OD1 ASP B 157 62.931 31.517 29.211 1.00 22.25 O ATOM 2782 OD2 ASP B 157 61.858 33.194 28.243 1.00 27.69 O ATOM 0 H ASP B 157 59.421 31.727 32.101 1.00 22.70 H new ATOM 0 HA ASP B 157 61.450 30.428 30.909 1.00 26.59 H new ATOM 0 HB2 ASP B 157 60.042 31.970 29.731 1.00 24.61 H new ATOM 0 HB3 ASP B 157 60.709 33.128 30.534 1.00 24.61 H new ATOM 2783 N LYS B 158 63.165 30.937 32.651 1.00 31.69 N ATOM 2784 CA LYS B 158 64.263 31.311 33.523 1.00 34.42 C ATOM 2785 C LYS B 158 65.477 31.970 32.867 1.00 36.32 C ATOM 2786 O LYS B 158 66.211 32.713 33.527 1.00 37.99 O ATOM 2787 CB LYS B 158 64.718 30.081 34.322 1.00 34.80 C ATOM 2788 CG LYS B 158 63.622 29.452 35.165 1.00 36.56 C ATOM 2789 CD LYS B 158 62.847 30.533 35.924 1.00 38.06 C ATOM 2790 CE LYS B 158 62.011 29.977 37.063 1.00 38.88 C ATOM 2791 NZ LYS B 158 61.830 31.025 38.131 1.00 38.72 N ATOM 0 H LYS B 158 63.134 30.098 32.467 1.00 31.69 H new ATOM 0 HA LYS B 158 63.893 32.007 34.088 1.00 34.42 H new ATOM 0 HB2 LYS B 158 65.062 29.415 33.706 1.00 34.80 H new ATOM 0 HB3 LYS B 158 65.453 30.337 34.902 1.00 34.80 H new ATOM 0 HG2 LYS B 158 63.017 28.950 34.597 1.00 36.56 H new ATOM 0 HG3 LYS B 158 64.010 28.822 35.793 1.00 36.56 H new ATOM 0 HD2 LYS B 158 63.473 31.184 36.277 1.00 38.06 H new ATOM 0 HD3 LYS B 158 62.268 31.003 35.304 1.00 38.06 H new ATOM 0 HE2 LYS B 158 61.146 29.692 36.730 1.00 38.88 H new ATOM 0 HE3 LYS B 158 62.443 29.194 37.438 1.00 38.88 H new ATOM 0 HZ1 LYS B 158 61.339 30.691 38.794 1.00 38.72 H new ATOM 0 HZ2 LYS B 158 62.626 31.270 38.445 1.00 38.72 H new ATOM 0 HZ3 LYS B 158 61.418 31.734 37.785 1.00 38.72 H new ATOM 2792 N ASN B 159 65.725 31.719 31.591 1.00 36.55 N ATOM 2793 CA ASN B 159 66.885 32.354 30.986 1.00 37.85 C ATOM 2794 C ASN B 159 66.387 33.444 30.055 1.00 37.71 C ATOM 2795 O ASN B 159 67.113 33.943 29.213 1.00 36.59 O ATOM 2796 CB ASN B 159 67.724 31.335 30.232 1.00 39.33 C ATOM 2797 CG ASN B 159 67.006 30.772 29.037 1.00 41.34 C ATOM 2798 OD1 ASN B 159 65.903 30.248 29.158 1.00 40.96 O ATOM 2799 ND2 ASN B 159 67.629 30.876 27.867 1.00 42.66 N ATOM 0 H ASN B 159 65.260 31.209 31.078 1.00 36.55 H new ATOM 0 HA ASN B 159 67.453 32.739 31.672 1.00 37.85 H new ATOM 0 HB2 ASN B 159 68.551 31.751 29.943 1.00 39.33 H new ATOM 0 HB3 ASN B 159 67.965 30.612 30.831 1.00 39.33 H new ATOM 0 HD21 ASN B 159 67.259 30.569 27.154 1.00 42.66 H new ATOM 0 HD22 ASN B 159 68.402 31.250 27.823 1.00 42.66 H new ATOM 2800 N ALA B 160 65.120 33.796 30.239 1.00 38.24 N ATOM 2801 CA ALA B 160 64.440 34.833 29.469 1.00 37.76 C ATOM 2802 C ALA B 160 64.768 34.883 27.983 1.00 37.80 C ATOM 2803 O ALA B 160 65.071 35.945 27.456 1.00 39.12 O ATOM 2804 CB ALA B 160 64.697 36.194 30.097 1.00 39.21 C ATOM 0 H ALA B 160 64.617 33.428 30.832 1.00 38.24 H new ATOM 0 HA ALA B 160 63.501 34.593 29.508 1.00 37.76 H new ATOM 0 HB1 ALA B 160 64.243 36.879 29.582 1.00 39.21 H new ATOM 0 HB2 ALA B 160 64.362 36.199 31.007 1.00 39.21 H new ATOM 0 HB3 ALA B 160 65.650 36.373 30.103 1.00 39.21 H new ATOM 2805 N ASP B 161 64.693 33.748 27.296 1.00 36.39 N ATOM 2806 CA ASP B 161 64.984 33.739 25.867 1.00 35.40 C ATOM 2807 C ASP B 161 63.711 33.624 25.019 1.00 33.63 C ATOM 2808 O ASP B 161 63.778 33.519 23.791 1.00 34.70 O ATOM 2809 CB ASP B 161 65.977 32.615 25.533 1.00 36.20 C ATOM 2810 CG ASP B 161 65.427 31.216 25.848 1.00 37.63 C ATOM 2811 OD1 ASP B 161 64.367 31.117 26.505 1.00 35.23 O ATOM 2812 OD2 ASP B 161 66.064 30.213 25.438 1.00 38.00 O ATOM 0 H ASP B 161 64.479 32.985 27.631 1.00 36.39 H new ATOM 0 HA ASP B 161 65.392 34.590 25.644 1.00 35.40 H new ATOM 0 HB2 ASP B 161 66.207 32.662 24.592 1.00 36.20 H new ATOM 0 HB3 ASP B 161 66.797 32.755 26.033 1.00 36.20 H new ATOM 2813 N GLY B 162 62.552 33.661 25.676 1.00 31.12 N ATOM 2814 CA GLY B 162 61.285 33.593 24.963 1.00 29.40 C ATOM 2815 C GLY B 162 60.853 32.201 24.526 1.00 28.16 C ATOM 2816 O GLY B 162 59.976 32.078 23.689 1.00 30.04 O ATOM 0 H GLY B 162 62.481 33.725 26.531 1.00 31.12 H new ATOM 0 HA2 GLY B 162 60.592 33.966 25.530 1.00 29.40 H new ATOM 0 HA3 GLY B 162 61.343 34.158 24.177 1.00 29.40 H new ATOM 2817 N LYS B 163 61.480 31.166 25.078 1.00 27.82 N ATOM 2818 CA LYS B 163 61.171 29.762 24.767 1.00 28.11 C ATOM 2819 C LYS B 163 61.206 28.969 26.081 1.00 27.17 C ATOM 2820 O LYS B 163 61.941 29.319 26.996 1.00 26.26 O ATOM 2821 CB LYS B 163 62.252 29.124 23.882 1.00 29.90 C ATOM 2822 CG LYS B 163 62.386 29.674 22.502 1.00 33.54 C ATOM 2823 CD LYS B 163 63.416 28.886 21.685 1.00 35.46 C ATOM 2824 CE LYS B 163 64.715 28.645 22.445 1.00 37.46 C ATOM 2825 NZ LYS B 163 65.833 28.229 21.514 1.00 39.05 N ATOM 0 H LYS B 163 62.110 31.257 25.656 1.00 27.82 H new ATOM 0 HA LYS B 163 60.312 29.741 24.317 1.00 28.11 H new ATOM 0 HB2 LYS B 163 63.107 29.217 24.331 1.00 29.90 H new ATOM 0 HB3 LYS B 163 62.069 28.174 23.815 1.00 29.90 H new ATOM 0 HG2 LYS B 163 61.525 29.645 22.055 1.00 33.54 H new ATOM 0 HG3 LYS B 163 62.651 30.606 22.547 1.00 33.54 H new ATOM 0 HD2 LYS B 163 63.034 28.032 21.428 1.00 35.46 H new ATOM 0 HD3 LYS B 163 63.610 29.368 20.866 1.00 35.46 H new ATOM 0 HE2 LYS B 163 64.970 29.453 22.917 1.00 37.46 H new ATOM 0 HE3 LYS B 163 64.577 27.957 23.114 1.00 37.46 H new ATOM 0 HZ1 LYS B 163 66.577 28.096 21.984 1.00 39.05 H new ATOM 0 HZ2 LYS B 163 65.607 27.476 21.096 1.00 39.05 H new ATOM 0 HZ3 LYS B 163 65.973 28.870 20.913 1.00 39.05 H new ATOM 2826 N LEU B 164 60.424 27.901 26.173 1.00 24.01 N ATOM 2827 CA LEU B 164 60.465 27.065 27.361 1.00 22.96 C ATOM 2828 C LEU B 164 60.981 25.686 26.974 1.00 23.45 C ATOM 2829 O LEU B 164 60.480 25.054 26.014 1.00 22.05 O ATOM 2830 CB LEU B 164 59.069 26.879 27.977 1.00 22.25 C ATOM 2831 CG LEU B 164 58.296 28.129 28.418 1.00 21.89 C ATOM 2832 CD1 LEU B 164 57.077 27.652 29.213 1.00 23.27 C ATOM 2833 CD2 LEU B 164 59.139 29.082 29.250 1.00 21.43 C ATOM 0 H LEU B 164 59.870 27.646 25.567 1.00 24.01 H new ATOM 0 HA LEU B 164 61.041 27.501 28.008 1.00 22.96 H new ATOM 0 HB2 LEU B 164 58.522 26.405 27.332 1.00 22.25 H new ATOM 0 HB3 LEU B 164 59.161 26.300 28.750 1.00 22.25 H new ATOM 0 HG LEU B 164 58.031 28.633 27.632 1.00 21.89 H new ATOM 0 HD11 LEU B 164 56.563 28.419 29.509 1.00 23.27 H new ATOM 0 HD12 LEU B 164 56.523 27.090 28.649 1.00 23.27 H new ATOM 0 HD13 LEU B 164 57.372 27.144 29.985 1.00 23.27 H new ATOM 0 HD21 LEU B 164 58.605 29.852 29.501 1.00 21.43 H new ATOM 0 HD22 LEU B 164 59.447 28.628 30.050 1.00 21.43 H new ATOM 0 HD23 LEU B 164 59.904 29.376 28.731 1.00 21.43 H new ATOM 2834 N THR B 165 61.987 25.229 27.694 1.00 22.40 N ATOM 2835 CA THR B 165 62.506 23.893 27.443 1.00 25.16 C ATOM 2836 C THR B 165 61.586 23.007 28.258 1.00 25.33 C ATOM 2837 O THR B 165 60.800 23.523 29.077 1.00 24.41 O ATOM 2838 CB THR B 165 63.893 23.704 28.011 1.00 25.56 C ATOM 2839 OG1 THR B 165 63.853 23.964 29.438 1.00 26.16 O ATOM 2840 CG2 THR B 165 64.877 24.629 27.308 1.00 24.53 C ATOM 0 H THR B 165 62.380 25.664 28.323 1.00 22.40 H new ATOM 0 HA THR B 165 62.546 23.711 26.491 1.00 25.16 H new ATOM 0 HB THR B 165 64.192 22.793 27.865 1.00 25.56 H new ATOM 0 HG1 THR B 165 64.620 23.860 29.764 1.00 26.16 H new ATOM 0 HG21 THR B 165 65.764 24.501 27.679 1.00 24.53 H new ATOM 0 HG22 THR B 165 64.891 24.426 26.360 1.00 24.53 H new ATOM 0 HG23 THR B 165 64.604 25.551 27.437 1.00 24.53 H new ATOM 2841 N LEU B 166 61.677 21.691 28.058 1.00 24.47 N ATOM 2842 CA LEU B 166 60.863 20.758 28.824 1.00 25.66 C ATOM 2843 C LEU B 166 61.106 20.971 30.316 1.00 25.86 C ATOM 2844 O LEU B 166 60.170 20.973 31.107 1.00 25.12 O ATOM 2845 CB LEU B 166 61.191 19.296 28.492 1.00 26.50 C ATOM 2846 CG LEU B 166 60.478 18.248 29.367 1.00 26.40 C ATOM 2847 CD1 LEU B 166 58.981 18.449 29.304 1.00 24.92 C ATOM 2848 CD2 LEU B 166 60.835 16.811 28.886 1.00 27.48 C ATOM 0 H LEU B 166 62.203 21.323 27.485 1.00 24.47 H new ATOM 0 HA LEU B 166 59.937 20.929 28.591 1.00 25.66 H new ATOM 0 HB2 LEU B 166 60.962 19.131 27.564 1.00 26.50 H new ATOM 0 HB3 LEU B 166 62.149 19.168 28.575 1.00 26.50 H new ATOM 0 HG LEU B 166 60.775 18.357 30.284 1.00 26.40 H new ATOM 0 HD11 LEU B 166 58.542 17.785 29.858 1.00 24.92 H new ATOM 0 HD12 LEU B 166 58.760 19.336 29.627 1.00 24.92 H new ATOM 0 HD13 LEU B 166 58.680 18.355 28.387 1.00 24.92 H new ATOM 0 HD21 LEU B 166 60.381 16.161 29.444 1.00 27.48 H new ATOM 0 HD22 LEU B 166 60.554 16.699 27.965 1.00 27.48 H new ATOM 0 HD23 LEU B 166 61.794 16.677 28.949 1.00 27.48 H new ATOM 2849 N GLN B 167 62.364 21.141 30.675 1.00 27.18 N ATOM 2850 CA GLN B 167 62.764 21.383 32.040 1.00 28.31 C ATOM 2851 C GLN B 167 62.125 22.656 32.623 1.00 26.95 C ATOM 2852 O GLN B 167 61.588 22.635 33.741 1.00 26.54 O ATOM 2853 CB GLN B 167 64.278 21.500 32.092 1.00 31.01 C ATOM 2854 CG GLN B 167 64.885 21.125 33.433 1.00 36.59 C ATOM 2855 CD GLN B 167 65.418 22.314 34.203 1.00 40.93 C ATOM 2856 OE1 GLN B 167 66.215 22.149 35.139 1.00 43.58 O ATOM 2857 NE2 GLN B 167 64.990 23.522 33.821 1.00 41.42 N ATOM 0 H GLN B 167 63.020 21.118 30.120 1.00 27.18 H new ATOM 0 HA GLN B 167 62.456 20.638 32.579 1.00 28.31 H new ATOM 0 HB2 GLN B 167 64.660 20.932 31.405 1.00 31.01 H new ATOM 0 HB3 GLN B 167 64.530 22.412 31.878 1.00 31.01 H new ATOM 0 HG2 GLN B 167 64.214 20.674 33.970 1.00 36.59 H new ATOM 0 HG3 GLN B 167 65.605 20.492 33.289 1.00 36.59 H new ATOM 0 HE21 GLN B 167 64.437 23.595 33.167 1.00 41.42 H new ATOM 0 HE22 GLN B 167 65.268 24.226 34.230 1.00 41.42 H new ATOM 2858 N GLU B 168 62.194 23.770 31.901 1.00 26.41 N ATOM 2859 CA GLU B 168 61.590 25.011 32.411 1.00 23.45 C ATOM 2860 C GLU B 168 60.074 24.800 32.563 1.00 22.62 C ATOM 2861 O GLU B 168 59.460 25.283 33.524 1.00 21.97 O ATOM 2862 CB GLU B 168 61.866 26.165 31.454 1.00 23.37 C ATOM 2863 CG GLU B 168 63.324 26.656 31.494 1.00 26.19 C ATOM 2864 CD GLU B 168 63.621 27.680 30.409 1.00 26.02 C ATOM 2865 OE1 GLU B 168 63.322 27.395 29.225 1.00 25.71 O ATOM 2866 OE2 GLU B 168 64.145 28.771 30.733 1.00 27.06 O ATOM 0 H GLU B 168 62.574 23.835 31.132 1.00 26.41 H new ATOM 0 HA GLU B 168 61.978 25.231 33.273 1.00 23.45 H new ATOM 0 HB2 GLU B 168 61.650 25.886 30.550 1.00 23.37 H new ATOM 0 HB3 GLU B 168 61.277 26.904 31.671 1.00 23.37 H new ATOM 0 HG2 GLU B 168 63.507 27.047 32.363 1.00 26.19 H new ATOM 0 HG3 GLU B 168 63.921 25.898 31.392 1.00 26.19 H new ATOM 2867 N PHE B 169 59.478 24.062 31.621 1.00 21.59 N ATOM 2868 CA PHE B 169 58.032 23.782 31.619 1.00 21.64 C ATOM 2869 C PHE B 169 57.581 22.934 32.817 1.00 21.67 C ATOM 2870 O PHE B 169 56.543 23.211 33.458 1.00 20.83 O ATOM 2871 CB PHE B 169 57.639 23.048 30.327 1.00 20.47 C ATOM 2872 CG PHE B 169 56.167 22.834 30.171 1.00 19.60 C ATOM 2873 CD1 PHE B 169 55.315 23.904 29.908 1.00 21.18 C ATOM 2874 CD2 PHE B 169 55.639 21.552 30.233 1.00 19.95 C ATOM 2875 CE1 PHE B 169 53.947 23.696 29.701 1.00 24.04 C ATOM 2876 CE2 PHE B 169 54.279 21.313 30.031 1.00 21.67 C ATOM 2877 CZ PHE B 169 53.421 22.386 29.764 1.00 23.00 C ATOM 0 H PHE B 169 59.901 23.707 30.962 1.00 21.59 H new ATOM 0 HA PHE B 169 57.589 24.643 31.679 1.00 21.64 H new ATOM 0 HB2 PHE B 169 57.965 23.554 29.567 1.00 20.47 H new ATOM 0 HB3 PHE B 169 58.085 22.187 30.307 1.00 20.47 H new ATOM 0 HD1 PHE B 169 55.660 24.767 29.870 1.00 21.18 H new ATOM 0 HD2 PHE B 169 56.204 20.836 30.413 1.00 19.95 H new ATOM 0 HE1 PHE B 169 53.387 24.416 29.523 1.00 24.04 H new ATOM 0 HE2 PHE B 169 53.945 20.446 30.074 1.00 21.67 H new ATOM 0 HZ PHE B 169 52.513 22.238 29.629 1.00 23.00 H new ATOM 2878 N GLN B 170 58.351 21.895 33.111 1.00 22.45 N ATOM 2879 CA GLN B 170 58.037 20.998 34.231 1.00 24.41 C ATOM 2880 C GLN B 170 58.215 21.693 35.595 1.00 23.84 C ATOM 2881 O GLN B 170 57.344 21.614 36.453 1.00 21.53 O ATOM 2882 CB GLN B 170 58.941 19.762 34.199 1.00 27.01 C ATOM 2883 CG GLN B 170 58.542 18.764 33.130 1.00 32.31 C ATOM 2884 CD GLN B 170 59.458 17.565 33.070 1.00 33.86 C ATOM 2885 OE1 GLN B 170 60.666 17.708 32.935 1.00 38.32 O ATOM 2886 NE2 GLN B 170 58.881 16.372 33.146 1.00 36.38 N ATOM 0 H GLN B 170 59.063 21.686 32.677 1.00 22.45 H new ATOM 0 HA GLN B 170 57.107 20.741 34.128 1.00 24.41 H new ATOM 0 HB2 GLN B 170 59.857 20.042 34.048 1.00 27.01 H new ATOM 0 HB3 GLN B 170 58.917 19.327 35.066 1.00 27.01 H new ATOM 0 HG2 GLN B 170 57.635 18.464 33.298 1.00 32.31 H new ATOM 0 HG3 GLN B 170 58.539 19.206 32.267 1.00 32.31 H new ATOM 0 HE21 GLN B 170 58.028 16.312 33.241 1.00 36.38 H new ATOM 0 HE22 GLN B 170 59.360 15.659 33.100 1.00 36.38 H new ATOM 2887 N GLU B 171 59.360 22.337 35.782 1.00 24.43 N ATOM 2888 CA GLU B 171 59.645 23.033 37.038 1.00 25.65 C ATOM 2889 C GLU B 171 58.737 24.246 37.214 1.00 23.16 C ATOM 2890 O GLU B 171 58.273 24.526 38.329 1.00 22.88 O ATOM 2891 CB GLU B 171 61.096 23.485 37.098 1.00 29.05 C ATOM 2892 CG GLU B 171 62.091 22.378 36.865 1.00 34.19 C ATOM 2893 CD GLU B 171 63.491 22.843 37.189 1.00 38.69 C ATOM 2894 OE1 GLU B 171 63.791 24.029 36.895 1.00 39.85 O ATOM 2895 OE2 GLU B 171 64.286 22.026 37.735 1.00 41.61 O ATOM 0 H GLU B 171 59.988 22.385 35.196 1.00 24.43 H new ATOM 0 HA GLU B 171 59.477 22.403 37.756 1.00 25.65 H new ATOM 0 HB2 GLU B 171 61.237 24.179 36.435 1.00 29.05 H new ATOM 0 HB3 GLU B 171 61.266 23.883 37.966 1.00 29.05 H new ATOM 0 HG2 GLU B 171 61.864 21.612 37.415 1.00 34.19 H new ATOM 0 HG3 GLU B 171 62.048 22.087 35.941 1.00 34.19 H new ATOM 2896 N GLY B 172 58.455 24.949 36.126 1.00 20.75 N ATOM 2897 CA GLY B 172 57.567 26.106 36.237 1.00 19.57 C ATOM 2898 C GLY B 172 56.149 25.675 36.561 1.00 17.76 C ATOM 2899 O GLY B 172 55.433 26.334 37.300 1.00 19.61 O ATOM 0 H GLY B 172 58.754 24.784 35.337 1.00 20.75 H new ATOM 0 HA2 GLY B 172 57.893 26.703 36.929 1.00 19.57 H new ATOM 0 HA3 GLY B 172 57.575 26.605 35.405 1.00 19.57 H new ATOM 2900 N SER B 173 55.722 24.562 35.997 1.00 17.94 N ATOM 2901 CA SER B 173 54.388 24.050 36.215 1.00 17.09 C ATOM 2902 C SER B 173 54.203 23.589 37.656 1.00 18.31 C ATOM 2903 O SER B 173 53.143 23.821 38.283 1.00 18.35 O ATOM 2904 CB SER B 173 54.141 22.872 35.282 1.00 16.55 C ATOM 2905 OG SER B 173 53.719 23.330 34.021 1.00 17.28 O ATOM 0 H SER B 173 56.203 24.079 35.473 1.00 17.94 H new ATOM 0 HA SER B 173 53.756 24.764 36.035 1.00 17.09 H new ATOM 0 HB2 SER B 173 54.953 22.349 35.188 1.00 16.55 H new ATOM 0 HB3 SER B 173 53.468 22.286 35.662 1.00 16.55 H new ATOM 0 HG SER B 173 54.386 23.424 33.519 1.00 17.28 H new ATOM 2906 N LYS B 174 55.234 22.924 38.163 1.00 19.35 N ATOM 2907 CA LYS B 174 55.226 22.396 39.528 1.00 20.13 C ATOM 2908 C LYS B 174 55.312 23.503 40.591 1.00 20.46 C ATOM 2909 O LYS B 174 54.941 23.278 41.735 1.00 22.47 O ATOM 2910 CB LYS B 174 56.388 21.400 39.684 1.00 22.57 C ATOM 2911 CG LYS B 174 56.139 20.060 38.957 1.00 23.94 C ATOM 2912 CD LYS B 174 57.439 19.226 38.950 1.00 25.83 C ATOM 2913 CE LYS B 174 57.249 17.886 38.282 1.00 27.37 C ATOM 2914 NZ LYS B 174 58.516 17.108 38.408 1.00 30.18 N ATOM 0 H LYS B 174 55.959 22.765 37.728 1.00 19.35 H new ATOM 0 HA LYS B 174 54.379 21.946 39.673 1.00 20.13 H new ATOM 0 HB2 LYS B 174 57.200 21.803 39.339 1.00 22.57 H new ATOM 0 HB3 LYS B 174 56.535 21.228 40.627 1.00 22.57 H new ATOM 0 HG2 LYS B 174 55.430 19.568 39.400 1.00 23.94 H new ATOM 0 HG3 LYS B 174 55.844 20.225 38.048 1.00 23.94 H new ATOM 0 HD2 LYS B 174 58.136 19.719 38.490 1.00 25.83 H new ATOM 0 HD3 LYS B 174 57.741 19.092 39.862 1.00 25.83 H new ATOM 0 HE2 LYS B 174 56.516 17.404 38.696 1.00 27.37 H new ATOM 0 HE3 LYS B 174 57.019 18.005 37.347 1.00 27.37 H new ATOM 0 HZ1 LYS B 174 58.395 16.289 38.082 1.00 30.18 H new ATOM 0 HZ2 LYS B 174 59.162 17.516 37.951 1.00 30.18 H new ATOM 0 HZ3 LYS B 174 58.748 17.055 39.266 1.00 30.18 H new ATOM 2915 N ALA B 175 55.801 24.681 40.222 1.00 19.97 N ATOM 2916 CA ALA B 175 55.892 25.809 41.164 1.00 19.61 C ATOM 2917 C ALA B 175 54.510 26.447 41.427 1.00 19.78 C ATOM 2918 O ALA B 175 54.265 26.997 42.511 1.00 16.56 O ATOM 2919 CB ALA B 175 56.863 26.893 40.611 1.00 18.81 C ATOM 0 H ALA B 175 56.088 24.855 39.430 1.00 19.97 H new ATOM 0 HA ALA B 175 56.231 25.460 42.003 1.00 19.61 H new ATOM 0 HB1 ALA B 175 56.916 27.631 41.238 1.00 18.81 H new ATOM 0 HB2 ALA B 175 57.745 26.507 40.491 1.00 18.81 H new ATOM 0 HB3 ALA B 175 56.534 27.217 39.758 1.00 18.81 H new ATOM 2920 N ASP B 176 53.625 26.392 40.418 1.00 20.13 N ATOM 2921 CA ASP B 176 52.289 27.001 40.484 1.00 21.33 C ATOM 2922 C ASP B 176 51.266 26.033 41.049 1.00 22.83 C ATOM 2923 O ASP B 176 50.910 25.026 40.405 1.00 20.60 O ATOM 2924 CB ASP B 176 51.824 27.449 39.088 1.00 25.28 C ATOM 2925 CG ASP B 176 50.628 28.417 39.138 1.00 28.37 C ATOM 2926 OD1 ASP B 176 49.723 28.223 39.965 1.00 29.87 O ATOM 2927 OD2 ASP B 176 50.584 29.382 38.335 1.00 32.54 O ATOM 0 H ASP B 176 53.787 25.997 39.672 1.00 20.13 H new ATOM 0 HA ASP B 176 52.357 27.770 41.071 1.00 21.33 H new ATOM 0 HB2 ASP B 176 52.563 27.878 38.628 1.00 25.28 H new ATOM 0 HB3 ASP B 176 51.581 26.668 38.567 1.00 25.28 H new ATOM 2928 N PRO B 177 50.731 26.341 42.246 1.00 21.91 N ATOM 2929 CA PRO B 177 49.734 25.461 42.899 1.00 22.72 C ATOM 2930 C PRO B 177 48.493 25.102 42.060 1.00 24.30 C ATOM 2931 O PRO B 177 48.004 23.954 42.102 1.00 22.79 O ATOM 2932 CB PRO B 177 49.353 26.236 44.172 1.00 22.84 C ATOM 2933 CG PRO B 177 50.639 27.084 44.459 1.00 22.11 C ATOM 2934 CD PRO B 177 51.036 27.529 43.061 1.00 21.48 C ATOM 0 HA PRO B 177 50.119 24.585 43.059 1.00 22.72 H new ATOM 0 HB2 PRO B 177 48.575 26.798 44.032 1.00 22.84 H new ATOM 0 HB3 PRO B 177 49.143 25.639 44.908 1.00 22.84 H new ATOM 0 HG2 PRO B 177 50.456 27.837 45.042 1.00 22.11 H new ATOM 0 HG3 PRO B 177 51.334 26.558 44.885 1.00 22.11 H new ATOM 0 HD2 PRO B 177 50.530 28.304 42.772 1.00 21.48 H new ATOM 0 HD3 PRO B 177 51.975 27.769 43.012 1.00 21.48 H new ATOM 2935 N SER B 178 47.972 26.078 41.332 1.00 23.79 N ATOM 2936 CA SER B 178 46.794 25.809 40.512 1.00 27.51 C ATOM 2937 C SER B 178 47.072 24.815 39.360 1.00 27.39 C ATOM 2938 O SER B 178 46.212 23.976 39.064 1.00 27.17 O ATOM 2939 CB SER B 178 46.171 27.128 39.998 1.00 26.87 C ATOM 2940 OG SER B 178 47.031 27.849 39.130 1.00 32.40 O ATOM 0 H SER B 178 48.273 26.883 41.296 1.00 23.79 H new ATOM 0 HA SER B 178 46.145 25.371 41.085 1.00 27.51 H new ATOM 0 HB2 SER B 178 45.344 26.929 39.532 1.00 26.87 H new ATOM 0 HB3 SER B 178 45.942 27.688 40.756 1.00 26.87 H new ATOM 0 HG SER B 178 47.821 27.796 39.411 1.00 32.40 H new ATOM 2941 N ILE B 179 48.264 24.886 38.761 1.00 24.59 N ATOM 2942 CA ILE B 179 48.652 23.976 37.702 1.00 23.50 C ATOM 2943 C ILE B 179 48.885 22.580 38.283 1.00 26.48 C ATOM 2944 O ILE B 179 48.439 21.569 37.717 1.00 26.60 O ATOM 2945 CB ILE B 179 49.918 24.495 37.001 1.00 21.34 C ATOM 2946 CG1 ILE B 179 49.565 25.824 36.288 1.00 21.71 C ATOM 2947 CG2 ILE B 179 50.470 23.419 36.072 1.00 20.53 C ATOM 2948 CD1 ILE B 179 50.691 26.544 35.646 1.00 19.56 C ATOM 0 H ILE B 179 48.865 25.467 38.963 1.00 24.59 H new ATOM 0 HA ILE B 179 47.941 23.923 37.045 1.00 23.50 H new ATOM 0 HB ILE B 179 50.628 24.686 37.633 1.00 21.34 H new ATOM 0 HG12 ILE B 179 48.897 25.638 35.610 1.00 21.71 H new ATOM 0 HG13 ILE B 179 49.154 26.417 36.936 1.00 21.71 H new ATOM 0 HG21 ILE B 179 51.268 23.750 35.632 1.00 20.53 H new ATOM 0 HG22 ILE B 179 50.690 22.628 36.588 1.00 20.53 H new ATOM 0 HG23 ILE B 179 49.803 23.194 35.405 1.00 20.53 H new ATOM 0 HD11 ILE B 179 50.361 27.357 35.232 1.00 19.56 H new ATOM 0 HD12 ILE B 179 51.355 26.769 36.316 1.00 19.56 H new ATOM 0 HD13 ILE B 179 51.094 25.977 34.970 1.00 19.56 H new ATOM 2949 N VAL B 180 49.569 22.520 39.422 1.00 25.81 N ATOM 2950 CA VAL B 180 49.829 21.240 40.074 1.00 27.67 C ATOM 2951 C VAL B 180 48.498 20.591 40.384 1.00 30.81 C ATOM 2952 O VAL B 180 48.346 19.379 40.225 1.00 30.68 O ATOM 2953 CB VAL B 180 50.555 21.390 41.419 1.00 25.53 C ATOM 2954 CG1 VAL B 180 50.509 20.020 42.177 1.00 25.74 C ATOM 2955 CG2 VAL B 180 51.965 21.860 41.195 1.00 21.93 C ATOM 0 H VAL B 180 49.890 23.205 39.832 1.00 25.81 H new ATOM 0 HA VAL B 180 50.385 20.722 39.471 1.00 27.67 H new ATOM 0 HB VAL B 180 50.114 22.058 41.967 1.00 25.53 H new ATOM 0 HG11 VAL B 180 50.966 20.106 43.028 1.00 25.74 H new ATOM 0 HG12 VAL B 180 49.586 19.765 42.330 1.00 25.74 H new ATOM 0 HG13 VAL B 180 50.947 19.339 41.643 1.00 25.74 H new ATOM 0 HG21 VAL B 180 52.415 21.952 42.049 1.00 21.93 H new ATOM 0 HG22 VAL B 180 52.439 21.214 40.648 1.00 21.93 H new ATOM 0 HG23 VAL B 180 51.952 22.718 40.743 1.00 21.93 H new ATOM 2956 N GLN B 181 47.543 21.403 40.837 1.00 32.91 N ATOM 2957 CA GLN B 181 46.215 20.903 41.180 1.00 37.25 C ATOM 2958 C GLN B 181 45.474 20.376 39.949 1.00 38.31 C ATOM 2959 O GLN B 181 44.811 19.340 40.019 1.00 39.57 O ATOM 2960 CB GLN B 181 45.381 22.003 41.831 1.00 38.35 C ATOM 2961 CG GLN B 181 44.243 21.500 42.714 1.00 43.85 C ATOM 2962 CD GLN B 181 44.711 21.041 44.112 1.00 46.46 C ATOM 2963 OE1 GLN B 181 45.290 19.956 44.273 1.00 47.45 O ATOM 2964 NE2 GLN B 181 44.460 21.880 45.128 1.00 46.77 N ATOM 0 H GLN B 181 47.646 22.249 40.953 1.00 32.91 H new ATOM 0 HA GLN B 181 46.338 20.171 41.804 1.00 37.25 H new ATOM 0 HB2 GLN B 181 45.966 22.563 42.365 1.00 38.35 H new ATOM 0 HB3 GLN B 181 45.009 22.566 41.134 1.00 38.35 H new ATOM 0 HG2 GLN B 181 43.585 22.205 42.816 1.00 43.85 H new ATOM 0 HG3 GLN B 181 43.800 20.761 42.269 1.00 43.85 H new ATOM 0 HE21 GLN B 181 44.056 22.625 44.981 1.00 46.77 H new ATOM 0 HE22 GLN B 181 44.703 21.673 45.927 1.00 46.77 H new ATOM 2965 N ALA B 182 45.586 21.079 38.823 1.00 39.44 N ATOM 2966 CA ALA B 182 44.913 20.651 37.599 1.00 40.12 C ATOM 2967 C ALA B 182 45.479 19.360 37.008 1.00 40.25 C ATOM 2968 O ALA B 182 44.759 18.623 36.354 1.00 40.89 O ATOM 2969 CB ALA B 182 44.962 21.762 36.560 1.00 40.95 C ATOM 0 H ALA B 182 46.044 21.803 38.747 1.00 39.44 H new ATOM 0 HA ALA B 182 43.994 20.461 37.845 1.00 40.12 H new ATOM 0 HB1 ALA B 182 44.513 21.469 35.751 1.00 40.95 H new ATOM 0 HB2 ALA B 182 44.518 22.551 36.908 1.00 40.95 H new ATOM 0 HB3 ALA B 182 45.886 21.975 36.357 1.00 40.95 H new ATOM 2970 N LEU B 183 46.754 19.083 37.257 1.00 39.81 N ATOM 2971 CA LEU B 183 47.425 17.892 36.736 1.00 40.14 C ATOM 2972 C LEU B 183 47.549 16.678 37.664 1.00 41.14 C ATOM 2973 O LEU B 183 48.056 15.634 37.245 1.00 41.59 O ATOM 2974 CB LEU B 183 48.838 18.251 36.309 1.00 40.91 C ATOM 2975 CG LEU B 183 49.007 19.183 35.130 1.00 40.97 C ATOM 2976 CD1 LEU B 183 50.351 19.858 35.235 1.00 41.65 C ATOM 2977 CD2 LEU B 183 48.852 18.405 33.844 1.00 40.87 C ATOM 0 H LEU B 183 47.261 19.585 37.738 1.00 39.81 H new ATOM 0 HA LEU B 183 46.839 17.617 36.014 1.00 40.14 H new ATOM 0 HB2 LEU B 183 49.286 18.651 37.071 1.00 40.91 H new ATOM 0 HB3 LEU B 183 49.306 17.426 36.105 1.00 40.91 H new ATOM 0 HG LEU B 183 48.324 19.872 35.132 1.00 40.97 H new ATOM 0 HD11 LEU B 183 50.471 20.459 34.483 1.00 41.65 H new ATOM 0 HD12 LEU B 183 50.396 20.362 36.062 1.00 41.65 H new ATOM 0 HD13 LEU B 183 51.052 19.187 35.227 1.00 41.65 H new ATOM 0 HD21 LEU B 183 48.961 19.004 33.088 1.00 40.87 H new ATOM 0 HD22 LEU B 183 49.526 17.709 33.804 1.00 40.87 H new ATOM 0 HD23 LEU B 183 47.970 18.003 33.813 1.00 40.87 H new ATOM 2978 N SER B 184 47.124 16.792 38.915 1.00 41.58 N ATOM 2979 CA SER B 184 47.267 15.664 39.815 1.00 43.15 C ATOM 2980 C SER B 184 45.961 14.917 40.067 1.00 43.93 C ATOM 2981 O SER B 184 45.804 14.227 41.070 1.00 45.04 O ATOM 2982 CB SER B 184 47.921 16.126 41.127 1.00 43.74 C ATOM 2983 OG SER B 184 47.424 17.394 41.509 1.00 44.49 O ATOM 0 H SER B 184 46.760 17.494 39.254 1.00 41.58 H new ATOM 0 HA SER B 184 47.846 15.020 39.379 1.00 43.15 H new ATOM 0 HB2 SER B 184 47.745 15.479 41.828 1.00 43.74 H new ATOM 0 HB3 SER B 184 48.884 16.170 41.017 1.00 43.74 H new ATOM 0 HG SER B 184 48.007 17.980 41.361 1.00 44.49 H new ATOM 2984 N LEU B 185 45.035 15.042 39.125 1.00 44.52 N ATOM 2985 CA LEU B 185 43.752 14.347 39.203 1.00 44.69 C ATOM 2986 C LEU B 185 43.860 12.968 38.539 1.00 43.85 C ATOM 2987 O LEU B 185 44.535 12.811 37.522 1.00 43.75 O ATOM 2988 CB LEU B 185 42.677 15.162 38.482 1.00 44.98 C ATOM 2989 CG LEU B 185 42.491 16.578 39.019 1.00 44.96 C ATOM 2990 CD1 LEU B 185 41.553 17.380 38.127 1.00 45.20 C ATOM 2991 CD2 LEU B 185 41.953 16.451 40.421 1.00 45.08 C ATOM 0 H LEU B 185 45.130 15.530 38.423 1.00 44.52 H new ATOM 0 HA LEU B 185 43.512 14.240 40.137 1.00 44.69 H new ATOM 0 HB2 LEU B 185 42.903 15.212 37.540 1.00 44.98 H new ATOM 0 HB3 LEU B 185 41.832 14.690 38.546 1.00 44.98 H new ATOM 0 HG LEU B 185 43.333 17.059 39.026 1.00 44.96 H new ATOM 0 HD11 LEU B 185 41.450 18.275 38.487 1.00 45.20 H new ATOM 0 HD12 LEU B 185 41.924 17.433 37.232 1.00 45.20 H new ATOM 0 HD13 LEU B 185 40.687 16.944 38.093 1.00 45.20 H new ATOM 0 HD21 LEU B 185 41.821 17.335 40.798 1.00 45.08 H new ATOM 0 HD22 LEU B 185 41.106 15.978 40.401 1.00 45.08 H new ATOM 0 HD23 LEU B 185 42.585 15.958 40.967 1.00 45.08 H new ATOM 2992 N TYR B 186 43.211 11.969 39.122 1.00 43.43 N ATOM 2993 CA TYR B 186 43.196 10.621 38.547 1.00 42.57 C ATOM 2994 C TYR B 186 41.723 10.365 38.191 1.00 42.83 C ATOM 2995 O TYR B 186 40.849 10.401 39.065 1.00 42.62 O ATOM 2996 CB TYR B 186 43.702 9.602 39.560 1.00 40.00 C ATOM 2997 CG TYR B 186 43.727 8.178 39.050 1.00 38.98 C ATOM 2998 CD1 TYR B 186 44.914 7.586 38.621 1.00 38.05 C ATOM 2999 CD2 TYR B 186 42.564 7.396 39.060 1.00 38.37 C ATOM 3000 CE1 TYR B 186 44.950 6.238 38.223 1.00 37.86 C ATOM 3001 CE2 TYR B 186 42.584 6.055 38.660 1.00 37.91 C ATOM 3002 CZ TYR B 186 43.780 5.477 38.247 1.00 38.18 C ATOM 3003 OH TYR B 186 43.797 4.139 37.876 1.00 37.98 O ATOM 0 H TYR B 186 42.769 12.047 39.856 1.00 43.43 H new ATOM 0 HA TYR B 186 43.774 10.542 37.772 1.00 42.57 H new ATOM 0 HB2 TYR B 186 44.598 9.852 39.835 1.00 40.00 H new ATOM 0 HB3 TYR B 186 43.142 9.642 40.351 1.00 40.00 H new ATOM 0 HD1 TYR B 186 45.695 8.091 38.598 1.00 38.05 H new ATOM 0 HD2 TYR B 186 41.762 7.776 39.338 1.00 38.37 H new ATOM 0 HE1 TYR B 186 45.750 5.855 37.945 1.00 37.86 H new ATOM 0 HE2 TYR B 186 41.801 5.553 38.670 1.00 37.91 H new ATOM 0 HH TYR B 186 43.023 3.819 37.943 1.00 37.98 H new ATOM 3004 N ASP B 187 41.454 10.126 36.909 1.00 42.80 N ATOM 3005 CA ASP B 187 40.082 9.938 36.419 1.00 43.90 C ATOM 3006 C ASP B 187 39.170 11.125 36.750 1.00 45.83 C ATOM 3007 O ASP B 187 37.992 10.942 37.112 1.00 45.82 O ATOM 3008 CB ASP B 187 39.467 8.661 36.981 1.00 42.60 C ATOM 3009 CG ASP B 187 39.975 7.419 36.271 1.00 40.76 C ATOM 3010 OD1 ASP B 187 40.818 7.566 35.352 1.00 36.89 O ATOM 3011 OD2 ASP B 187 39.523 6.312 36.634 1.00 40.74 O ATOM 0 H ASP B 187 42.057 10.068 36.298 1.00 42.80 H new ATOM 0 HA ASP B 187 40.150 9.870 35.454 1.00 43.90 H new ATOM 0 HB2 ASP B 187 39.669 8.596 37.927 1.00 42.60 H new ATOM 0 HB3 ASP B 187 38.501 8.706 36.900 1.00 42.60 H new ATOM 3012 N GLY B 188 39.718 12.334 36.624 1.00 46.56 N ATOM 3013 CA GLY B 188 38.952 13.531 36.923 1.00 48.95 C ATOM 3014 C GLY B 188 38.865 13.919 38.401 1.00 49.85 C ATOM 3015 O GLY B 188 38.201 14.945 38.698 1.00 49.95 O ATOM 0 H GLY B 188 40.527 12.477 36.368 1.00 46.56 H new ATOM 0 HA2 GLY B 188 39.341 14.273 36.434 1.00 48.95 H new ATOM 0 HA3 GLY B 188 38.051 13.410 36.585 1.00 48.95 H new TER 3016 GLY B 188 HETATM 3017 NA NA A1596 33.358 8.622 -2.770 1.00 12.14 NA HETATM 3018 CA CA A1597 1.644 -9.818 0.858 1.00 23.47 CA HETATM 3019 CA CA A1598 8.649 6.701 -10.041 1.00 12.76 CA HETATM 3020 CA CA A1599 18.158 12.024 -14.290 1.00 15.85 CA HETATM 3021 OH2 1PE A 951 18.604 9.690 3.664 1.00 42.20 O HETATM 3022 C12 1PE A 951 17.521 10.569 3.027 1.00 37.02 C HETATM 3023 C22 1PE A 951 17.483 10.535 1.590 1.00 37.91 C HETATM 3024 OH3 1PE A 951 18.481 9.668 0.992 1.00 35.89 O HETATM 3025 C13 1PE A 951 19.238 8.562 -1.215 1.00 33.06 C HETATM 3026 C23 1PE A 951 18.206 9.299 -0.512 1.00 33.72 C HETATM 3027 OH4 1PE A 951 19.356 7.262 -0.656 1.00 29.95 O HETATM 3028 C14 1PE A 951 20.593 5.051 -0.496 1.00 35.40 C HETATM 3029 C24 1PE A 951 20.449 6.268 -1.277 1.00 33.63 C HETATM 3030 OH5 1PE A 951 20.530 5.421 0.883 1.00 38.15 O HETATM 3031 C15 1PE A 951 21.245 4.540 3.080 1.00 42.08 C HETATM 3032 C25 1PE A 951 20.642 4.255 1.834 1.00 39.91 C HETATM 3033 OH6 1PE A 951 20.232 5.145 3.910 1.00 42.61 O HETATM 3034 C26 1PE A 951 20.824 6.038 5.056 1.00 43.59 C HETATM 0 H252 1PE A 951 19.752 3.904 1.996 1.00 39.91 H new HETATM 0 H251 1PE A 951 21.150 3.552 1.400 1.00 39.91 H new HETATM 0 H242 1PE A 951 20.196 6.039 -2.185 1.00 33.63 H new HETATM 0 H241 1PE A 951 21.305 6.722 -1.326 1.00 33.63 H new HETATM 0 H232 1PE A 951 17.388 8.779 -0.549 1.00 33.72 H new HETATM 0 H231 1PE A 951 18.041 10.122 -0.998 1.00 33.72 H new HETATM 0 H222 1PE A 951 16.603 10.243 1.306 1.00 37.91 H new HETATM 0 H221 1PE A 951 17.606 11.436 1.251 1.00 37.91 H new HETATM 0 H152 1PE A 951 21.586 3.729 3.490 1.00 42.08 H new HETATM 0 H151 1PE A 951 21.999 5.139 2.967 1.00 42.08 H new HETATM 0 H142 1PE A 951 19.889 4.420 -0.713 1.00 35.40 H new HETATM 0 H141 1PE A 951 21.436 4.615 -0.695 1.00 35.40 H new HETATM 0 H132 1PE A 951 19.019 8.500 -2.158 1.00 33.06 H new HETATM 0 H131 1PE A 951 20.085 9.031 -1.150 1.00 33.06 H new HETATM 0 H122 1PE A 951 16.656 10.292 3.367 1.00 37.02 H new HETATM 0 H121 1PE A 951 17.657 11.486 3.313 1.00 37.02 H new HETATM 0 HO2 1PE A 951 19.073 9.342 3.061 1.00 42.20 H new HETATM 3035 OH2 1PE A 952 17.672 6.585 5.213 1.00 51.72 O HETATM 3036 C12 1PE A 952 17.258 5.466 6.217 1.00 50.55 C HETATM 3037 C22 1PE A 952 16.307 4.518 5.704 1.00 50.61 C HETATM 3038 OH3 1PE A 952 15.923 4.806 4.329 1.00 50.22 O HETATM 3039 C13 1PE A 952 16.308 2.652 2.929 1.00 48.37 C HETATM 3040 C23 1PE A 952 16.676 4.019 3.195 1.00 48.61 C HETATM 3041 OH4 1PE A 952 17.491 1.909 2.554 1.00 48.29 O HETATM 3042 C14 1PE A 952 18.232 -0.571 2.901 1.00 49.25 C HETATM 3043 C24 1PE A 952 17.323 0.349 2.205 1.00 48.71 C HETATM 3044 OH5 1PE A 952 18.494 -0.083 4.217 1.00 50.25 O HETATM 3045 C15 1PE A 952 18.924 -1.382 6.285 1.00 52.67 C HETATM 3046 C25 1PE A 952 19.416 -0.976 5.018 1.00 50.15 C HETATM 3047 OH6 1PE A 952 18.897 -0.200 7.098 1.00 54.21 O HETATM 3048 C26 1PE A 952 17.833 -0.235 8.250 1.00 53.41 C HETATM 0 H252 1PE A 952 19.608 -1.769 4.494 1.00 50.15 H new HETATM 0 H251 1PE A 952 20.257 -0.512 5.149 1.00 50.15 H new HETATM 0 H242 1PE A 952 16.411 0.088 2.407 1.00 48.71 H new HETATM 0 H241 1PE A 952 17.446 0.235 1.250 1.00 48.71 H new HETATM 0 H232 1PE A 952 16.566 4.517 2.370 1.00 48.61 H new HETATM 0 H231 1PE A 952 17.622 4.031 3.409 1.00 48.61 H new HETATM 0 H222 1PE A 952 16.685 3.626 5.751 1.00 50.61 H new HETATM 0 H221 1PE A 952 15.516 4.521 6.265 1.00 50.61 H new HETATM 0 H152 1PE A 952 18.038 -1.769 6.205 1.00 52.67 H new HETATM 0 H151 1PE A 952 19.495 -2.060 6.678 1.00 52.67 H new HETATM 0 H142 1PE A 952 17.838 -1.456 2.947 1.00 49.25 H new HETATM 0 H141 1PE A 952 19.062 -0.656 2.406 1.00 49.25 H new HETATM 0 H132 1PE A 952 15.899 2.256 3.715 1.00 48.37 H new HETATM 0 H131 1PE A 952 15.650 2.615 2.218 1.00 48.37 H new HETATM 0 H122 1PE A 952 18.055 4.988 6.495 1.00 50.55 H new HETATM 0 H121 1PE A 952 16.885 5.882 7.010 1.00 50.55 H new HETATM 0 HO2 1PE A 952 17.237 6.497 4.500 1.00 51.72 H new HETATM 3049 O1 P6G A 954 11.099 -4.313 10.275 1.00 50.36 O HETATM 3050 C2 P6G A 954 10.486 -5.581 10.511 1.00 48.83 C HETATM 3051 C3 P6G A 954 10.924 -6.718 11.290 1.00 48.28 C HETATM 3052 O4 P6G A 954 12.442 -6.730 11.638 1.00 46.17 O HETATM 3053 C5 P6G A 954 12.747 -7.417 12.871 1.00 46.68 C HETATM 3054 C6 P6G A 954 14.027 -6.949 13.300 1.00 46.22 C HETATM 3055 O7 P6G A 954 15.178 -7.051 12.297 1.00 46.38 O HETATM 3056 C8 P6G A 954 16.441 -7.400 12.916 1.00 47.25 C HETATM 3057 C9 P6G A 954 17.527 -7.488 11.911 1.00 45.98 C HETATM 3058 O10 P6G A 954 17.793 -8.945 11.282 1.00 46.86 O HETATM 3059 C11 P6G A 954 18.982 -9.663 11.698 1.00 44.35 C HETATM 3060 C12 P6G A 954 19.069 -10.949 11.028 1.00 41.57 C HETATM 3061 O13 P6G A 954 18.687 -12.224 11.883 1.00 40.18 O HETATM 3062 C14 P6G A 954 19.686 -13.241 12.046 1.00 39.38 C HETATM 3063 C15 P6G A 954 19.241 -14.350 12.859 1.00 40.33 C HETATM 3064 O16 P6G A 954 17.778 -14.267 13.420 1.00 43.49 O HETATM 3065 C17 P6G A 954 17.545 -14.792 14.736 1.00 43.63 C HETATM 3066 C18 P6G A 954 16.139 -15.097 14.864 1.00 43.95 C HETATM 3067 O19 P6G A 954 15.420 -14.273 16.017 1.00 44.72 O HETATM 0 H182 P6G A 954 15.697 -14.914 14.020 1.00 43.95 H new HETATM 0 H181 P6G A 954 16.035 -16.045 15.039 1.00 43.95 H new HETATM 0 H172 P6G A 954 18.078 -15.590 14.880 1.00 43.63 H new HETATM 0 H171 P6G A 954 17.813 -14.147 15.409 1.00 43.63 H new HETATM 0 H152 P6G A 954 19.319 -15.162 12.333 1.00 40.33 H new HETATM 0 H151 P6G A 954 19.849 -14.439 13.610 1.00 40.33 H new HETATM 0 H142 P6G A 954 19.948 -13.572 11.173 1.00 39.38 H new HETATM 0 H141 P6G A 954 20.476 -12.849 12.449 1.00 39.38 H new HETATM 0 H122 P6G A 954 18.492 -10.924 10.248 1.00 41.57 H new HETATM 0 H121 P6G A 954 19.977 -11.062 10.706 1.00 41.57 H new HETATM 0 H112 P6G A 954 19.771 -9.135 11.497 1.00 44.35 H new HETATM 0 H111 P6G A 954 18.966 -9.795 12.659 1.00 44.35 H new HETATM 0 H92 P6G A 954 17.323 -6.875 11.187 1.00 45.98 H new HETATM 0 H91 P6G A 954 18.349 -7.178 12.322 1.00 45.98 H new HETATM 0 H82 P6G A 954 16.670 -6.736 13.585 1.00 47.25 H new HETATM 0 H81 P6G A 954 16.354 -8.249 13.377 1.00 47.25 H new HETATM 0 H62 P6G A 954 13.936 -6.019 13.560 1.00 46.22 H new HETATM 0 H61 P6G A 954 14.277 -7.443 14.096 1.00 46.22 H new HETATM 0 H52 P6G A 954 12.071 -7.234 13.543 1.00 46.68 H new HETATM 0 H51 P6G A 954 12.760 -8.377 12.735 1.00 46.68 H new HETATM 0 H32 P6G A 954 10.416 -6.742 12.116 1.00 48.28 H new HETATM 0 H31 P6G A 954 10.711 -7.529 10.802 1.00 48.28 H new HETATM 0 H22 P6G A 954 9.616 -5.361 10.878 1.00 48.83 H new HETATM 0 H21 P6G A 954 10.336 -5.943 9.624 1.00 48.83 H new HETATM 0 H19 P6G A 954 14.608 -14.485 16.049 1.00 44.72 H new HETATM 0 H1 P6G A 954 10.606 -3.852 9.776 1.00 50.36 H new HETATM 3068 C1 EDO A 901 25.864 -16.848 8.512 1.00 29.81 C HETATM 3069 O1 EDO A 901 25.812 -15.489 9.018 1.00 28.87 O HETATM 3070 C2 EDO A 901 25.671 -17.826 9.627 1.00 31.77 C HETATM 3071 O2 EDO A 901 24.565 -17.265 10.572 1.00 31.35 O HETATM 0 HO2 EDO A 901 23.858 -17.143 10.135 1.00 31.35 H new HETATM 0 HO1 EDO A 901 25.533 -14.976 8.414 1.00 28.87 H new HETATM 0 H22 EDO A 901 25.411 -18.693 9.277 1.00 31.77 H new HETATM 0 H21 EDO A 901 26.500 -17.954 10.114 1.00 31.77 H new HETATM 0 H12 EDO A 901 25.177 -16.976 7.839 1.00 29.81 H new HETATM 0 H11 EDO A 901 26.718 -17.006 8.079 1.00 29.81 H new HETATM 3072 NA NA B1595 47.533 -1.603 32.693 1.00 18.63 NA HETATM 3073 CA CA B1600 46.619 7.526 13.550 1.00 24.61 CA HETATM 3074 CA CA B1601 58.293 24.669 19.277 1.00 27.92 CA HETATM 3075 CA CA B1602 63.848 29.581 28.268 1.00 29.72 CA HETATM 3076 OH2 1PE B 953 46.480 22.937 31.996 1.00 32.79 O HETATM 3077 C12 1PE B 953 46.999 21.798 32.884 1.00 33.67 C HETATM 3078 C22 1PE B 953 48.376 21.893 33.251 1.00 35.47 C HETATM 3079 OH3 1PE B 953 49.043 23.070 32.716 1.00 36.94 O HETATM 3080 C13 1PE B 953 51.297 24.023 31.947 1.00 34.24 C HETATM 3081 C23 1PE B 953 50.574 22.881 32.402 1.00 34.44 C HETATM 3082 OH4 1PE B 953 50.410 24.901 31.238 1.00 32.64 O HETATM 3083 C14 1PE B 953 50.104 26.953 29.731 1.00 34.42 C HETATM 3084 C24 1PE B 953 51.034 26.236 30.617 1.00 35.00 C HETATM 3085 OH5 1PE B 953 48.894 27.153 30.450 1.00 33.69 O HETATM 3086 C15 1PE B 953 46.514 27.363 29.854 1.00 38.16 C HETATM 3087 C25 1PE B 953 47.830 27.859 29.658 1.00 35.01 C HETATM 3088 OH6 1PE B 953 45.907 28.214 30.843 1.00 39.92 O HETATM 3089 C26 1PE B 953 45.036 27.451 31.907 1.00 40.26 C HETATM 0 H252 1PE B 953 47.845 28.801 29.888 1.00 35.01 H new HETATM 0 H251 1PE B 953 48.050 27.794 28.715 1.00 35.01 H new HETATM 0 H242 1PE B 953 51.304 26.826 31.338 1.00 35.00 H new HETATM 0 H241 1PE B 953 51.836 26.010 30.120 1.00 35.00 H new HETATM 0 H232 1PE B 953 51.007 22.553 33.206 1.00 34.44 H new HETATM 0 H231 1PE B 953 50.659 22.186 31.731 1.00 34.44 H new HETATM 0 H222 1PE B 953 48.445 21.904 34.218 1.00 35.47 H new HETATM 0 H221 1PE B 953 48.840 21.099 32.942 1.00 35.47 H new HETATM 0 H152 1PE B 953 46.010 27.381 29.025 1.00 38.16 H new HETATM 0 H151 1PE B 953 46.533 26.441 30.155 1.00 38.16 H new HETATM 0 H142 1PE B 953 50.482 27.803 29.457 1.00 34.42 H new HETATM 0 H141 1PE B 953 49.940 26.441 28.923 1.00 34.42 H new HETATM 0 H132 1PE B 953 51.694 24.488 32.700 1.00 34.24 H new HETATM 0 H131 1PE B 953 52.025 23.747 31.369 1.00 34.24 H new HETATM 0 H122 1PE B 953 46.465 21.769 33.693 1.00 33.67 H new HETATM 0 H121 1PE B 953 46.860 20.957 32.421 1.00 33.67 H new HETATM 0 HO2 1PE B 953 46.915 23.637 32.155 1.00 32.79 H new HETATM 3090 C1 EDO B 902 39.519 7.819 31.443 1.00 45.05 C HETATM 3091 O1 EDO B 902 38.705 9.023 31.502 1.00 45.38 O HETATM 3092 C2 EDO B 902 39.365 7.004 32.694 1.00 43.30 C HETATM 3093 O2 EDO B 902 38.766 5.607 32.318 1.00 42.79 O HETATM 0 HO2 EDO B 902 38.428 5.644 31.550 1.00 42.79 H new HETATM 0 HO1 EDO B 902 38.806 9.465 30.795 1.00 45.38 H new HETATM 0 H22 EDO B 902 40.224 6.894 33.131 1.00 43.30 H new HETATM 0 H21 EDO B 902 38.784 7.460 33.322 1.00 43.30 H new HETATM 0 H12 EDO B 902 39.262 7.288 30.673 1.00 45.05 H new HETATM 0 H11 EDO B 902 40.451 8.060 31.323 1.00 45.05 H new HETATM 3094 O HOH A 501 32.138 6.716 -1.849 1.00 8.90 O HETATM 3095 O HOH A 502 9.421 -9.019 0.463 1.00 15.69 O HETATM 3096 O HOH A 504 20.987 30.959 9.869 1.00 15.66 O HETATM 3097 O HOH A 505 31.958 3.261 -3.793 1.00 12.25 O HETATM 3098 O HOH A 506 20.404 -29.464 4.857 1.00 13.18 O HETATM 3099 O HOH A 507 7.651 8.416 -11.221 1.00 20.24 O HETATM 3100 O HOH A 508 18.923 20.052 -6.518 1.00 18.15 O HETATM 3101 O HOH A 509 8.949 15.593 -8.999 1.00 18.27 O HETATM 3102 O HOH A 511 19.133 3.047 -15.241 1.00 13.86 O HETATM 3103 O HOH A 514 24.520 9.671 -10.614 1.00 12.12 O HETATM 3104 O HOH A 516 4.891 -17.397 3.161 1.00 19.40 O HETATM 3105 O HOH A 518 6.323 12.126 -9.233 1.00 26.08 O HETATM 3106 O HOH A 519 20.798 6.682 -16.472 1.00 32.92 O HETATM 3107 O HOH A 520 11.031 0.240 -9.642 1.00 32.48 O HETATM 3108 O HOH A 521 22.473 -20.937 11.948 1.00 17.37 O HETATM 3109 O HOH A 522 22.170 -16.706 13.584 1.00 27.12 O HETATM 3110 O HOH A 523 4.707 8.357 -7.753 1.00 15.56 O HETATM 3111 O HOH A 525 18.303 -24.677 0.556 1.00 24.28 O HETATM 3112 O HOH A 526 25.026 -8.283 -5.789 1.00 30.00 O HETATM 3113 O HOH A 527 14.283 -29.301 6.934 1.00 26.47 O HETATM 3114 O HOH A 528 11.386 -6.882 -0.352 1.00 30.22 O HETATM 3115 O HOH A 529 29.084 -3.771 -8.188 1.00 22.59 O HETATM 3116 O HOH A 530 16.419 -3.923 -9.771 1.00 32.40 O HETATM 3117 O HOH A 531 4.963 2.941 -1.581 1.00 35.57 O HETATM 3118 O HOH A 532 10.549 15.500 -10.977 1.00 39.97 O HETATM 3119 O HOH A 535 11.572 -26.805 -1.915 1.00 25.01 O HETATM 3120 O HOH A 536 21.447 -24.423 6.516 1.00 16.10 O HETATM 3121 O HOH A 537 20.796 -22.971 -0.180 1.00 21.90 O HETATM 3122 O HOH A 538 21.516 -23.148 -2.948 1.00 13.56 O HETATM 3123 O HOH A 539 20.360 -14.600 -1.132 1.00 28.18 O HETATM 3124 O HOH A 540 27.466 -12.343 -1.286 1.00 24.75 O HETATM 3125 O HOH A 541 25.006 -19.443 12.200 1.00 32.77 O HETATM 3126 O HOH A 542 7.708 2.393 -1.557 1.00 35.13 O HETATM 3127 O HOH A 543 7.282 -2.264 -3.801 1.00 32.03 O HETATM 3128 O HOH A 544 9.653 -10.896 -1.657 1.00 30.32 O HETATM 3129 O HOH A 545 4.778 -12.494 -2.385 1.00 42.65 O HETATM 3130 O HOH A 546 18.449 -12.058 0.060 1.00 16.08 O HETATM 3131 O HOH A 547 15.305 -2.151 -7.958 1.00 15.75 O HETATM 3132 O HOH A 548 13.144 -1.264 -9.469 1.00 19.22 O HETATM 3133 O HOH A 549 6.278 15.391 0.396 1.00 49.14 O HETATM 3134 O HOH A 550 22.611 26.963 5.814 1.00 21.60 O HETATM 3135 O HOH A 551 24.940 15.480 -10.347 1.00 19.92 O HETATM 3136 O HOH A 552 26.503 6.248 6.988 1.00 23.14 O HETATM 3137 O HOH A 553 24.644 -15.136 5.058 1.00 16.16 O HETATM 3138 O HOH A 559 23.560 30.495 9.262 1.00 45.42 O HETATM 3139 O HOH A 560 36.089 -1.677 -1.077 1.00 23.58 O HETATM 3140 O HOH A 562 6.138 -19.522 2.913 1.00 33.46 O HETATM 3141 O HOH A 563 7.818 -18.493 -1.408 1.00 39.73 O HETATM 3142 O HOH A 564 3.255 9.676 -1.128 1.00 34.19 O HETATM 3143 O HOH A 565 16.857 10.707 -15.876 1.00 21.58 O HETATM 3144 O HOH A 567 28.747 -5.603 -0.962 1.00 28.24 O HETATM 3145 O HOH A 570 22.360 -2.149 -7.660 1.00 24.45 O HETATM 3146 O HOH A 586 18.879 -26.192 -1.871 1.00 34.55 O HETATM 3147 O HOH A 587 9.827 14.015 -13.815 1.00 48.31 O HETATM 3148 O HOH A 588 13.888 -31.432 2.886 1.00 20.62 O HETATM 3149 O HOH A 589 22.760 -13.389 -5.038 1.00 48.56 O HETATM 3150 O HOH A 591 23.319 -2.020 5.406 1.00 19.45 O HETATM 3151 O HOH A 592 22.515 -5.154 8.477 1.00 20.84 O HETATM 3152 O HOH A 594 33.714 -2.363 -2.234 1.00 21.63 O HETATM 3153 O HOH A 595 21.539 -3.145 7.117 1.00 19.45 O HETATM 3154 O HOH A 596 17.608 -6.473 -3.970 1.00 18.31 O HETATM 3155 O HOH A 598 21.996 1.346 7.723 1.00 29.37 O HETATM 3156 O HOH A 599 26.737 11.201 -4.901 1.00 26.93 O HETATM 3157 O HOH A 600 23.154 28.555 3.683 1.00 20.44 O HETATM 3158 O HOH A 601 22.123 16.546 3.090 1.00 22.48 O HETATM 3159 O HOH A 603 21.234 22.980 2.045 1.00 24.00 O HETATM 3160 O HOH A 604 20.400 21.478 0.067 1.00 22.57 O HETATM 3161 O HOH A 605 25.107 8.622 -13.028 1.00 22.27 O HETATM 3162 O HOH A 606 27.556 -0.602 12.617 1.00 21.55 O HETATM 3163 O HOH A 607 38.390 -3.465 -0.465 1.00 25.61 O HETATM 3164 O HOH A 608 5.811 10.429 -11.288 1.00 30.59 O HETATM 3165 O HOH A 609 9.923 -22.542 13.188 1.00 29.71 O HETATM 3166 O HOH A 610 20.916 -21.767 -5.343 1.00 26.63 O HETATM 3167 O HOH A 612 21.437 19.139 2.607 1.00 26.32 O HETATM 3168 O HOH A 613 29.504 -5.746 5.688 1.00 23.85 O HETATM 3169 O HOH A 616 11.504 -30.973 1.336 1.00 26.85 O HETATM 3170 O HOH A 618 15.128 -5.923 -3.861 1.00 33.31 O HETATM 3171 O HOH A 619 2.833 4.825 -1.859 1.00 33.28 O HETATM 3172 O HOH A 621 8.802 0.383 -6.423 1.00 24.23 O HETATM 3173 O HOH A 626 16.390 -28.516 8.832 1.00 40.55 O HETATM 3174 O HOH A 628 28.626 -6.262 1.569 1.00 32.79 O HETATM 3175 O HOH A 631 20.006 -9.681 -1.358 1.00 26.05 O HETATM 3176 O HOH A 632 6.919 8.473 9.167 1.00 27.64 O HETATM 3177 O HOH A 634 25.772 -12.619 -2.969 1.00 29.93 O HETATM 3178 O HOH A 637 22.136 10.317 -16.508 1.00 27.32 O HETATM 3179 O HOH A 638 9.555 -23.846 10.971 1.00 35.38 O HETATM 3180 O HOH A 639 29.776 -7.889 -1.938 1.00 27.06 O HETATM 3181 O HOH A 640 17.748 17.821 -10.689 1.00 26.02 O HETATM 3182 O HOH A 641 29.071 -10.873 -2.879 1.00 29.58 O HETATM 3183 O HOH A 645 13.888 19.412 -11.407 1.00 44.92 O HETATM 3184 O HOH A 646 13.990 -29.134 4.283 1.00 24.08 O HETATM 3185 O HOH A 647 28.226 15.279 -12.542 1.00 36.71 O HETATM 3186 O HOH A 648 29.125 11.589 2.934 1.00 33.59 O HETATM 3187 O HOH A 651 20.064 8.886 -17.988 1.00 33.93 O HETATM 3188 O HOH A 652 23.619 -0.786 13.087 1.00 36.89 O HETATM 3189 O HOH A 656 2.966 -16.524 6.581 1.00 31.18 O HETATM 3190 O HOH A 657 21.135 -25.501 -3.595 1.00 40.52 O HETATM 3191 O HOH A 658 17.933 28.458 11.069 1.00 49.91 O HETATM 3192 O HOH A 663 3.075 8.718 -10.326 1.00 39.03 O HETATM 3193 O HOH A 664 16.248 -27.566 -4.522 1.00 46.83 O HETATM 3194 O HOH A 665 4.052 -23.417 17.702 1.00 39.13 O HETATM 3195 O HOH A 668 16.695 -5.676 8.083 1.00 31.46 O HETATM 3196 O HOH A 670 20.199 18.346 -9.672 1.00 38.17 O HETATM 3197 O HOH A 672 25.633 3.346 8.894 1.00 34.03 O HETATM 3198 O HOH A 673 9.425 -8.270 -6.903 1.00 47.83 O HETATM 3199 O HOH A 675 7.064 -20.086 0.551 1.00 44.99 O HETATM 3200 O HOH A 676 18.063 6.155 1.811 1.00 34.57 O HETATM 3201 O HOH A 677 8.390 -5.021 -3.241 1.00 45.81 O HETATM 3202 O HOH A 678 5.539 -31.399 3.778 1.00 42.26 O HETATM 3203 O HOH A 681 18.704 23.258 12.267 1.00 36.33 O HETATM 3204 O HOH A 682 19.057 -18.975 -4.939 1.00 47.50 O HETATM 3205 O HOH A 683 -2.692 -3.774 4.850 1.00 40.76 O HETATM 3206 O HOH A 685 12.164 19.584 9.909 1.00 36.74 O HETATM 3207 O HOH A 686 6.179 14.478 -9.405 1.00 37.36 O HETATM 3208 O HOH A 687 0.635 -3.181 -0.107 1.00 29.69 O HETATM 3209 O HOH A 688 15.724 -23.148 14.540 1.00 31.33 O HETATM 3210 O HOH A 692 30.501 -3.615 -1.705 1.00 38.70 O HETATM 3211 O HOH A 693 19.966 -16.721 15.458 1.00 48.74 O HETATM 3212 O HOH A 702 32.086 -0.245 -1.438 1.00 22.35 O HETATM 3213 O HOH A 703 30.886 -1.599 0.311 1.00 24.52 O HETATM 3214 O HOH A 704 23.891 8.669 -15.393 1.00 35.75 O HETATM 3215 O HOH A 706 18.280 -9.187 -3.449 1.00 29.95 O HETATM 3216 O HOH A 707 18.624 -28.409 -5.120 1.00 40.71 O HETATM 3217 O HOH A 708 20.481 -5.581 10.562 1.00 29.37 O HETATM 3218 O HOH A 710 21.078 -0.891 8.486 1.00 28.05 O HETATM 3219 O HOH A 711 -1.958 -2.170 1.949 1.00 34.12 O HETATM 3220 O HOH A 713 19.912 -25.826 2.558 1.00 33.17 O HETATM 3221 O HOH A 714 16.558 -27.760 2.813 1.00 26.07 O HETATM 3222 O HOH A 715 19.388 -31.880 -1.224 1.00 29.67 O HETATM 3223 O HOH A 716 5.830 11.412 -13.343 1.00 43.72 O HETATM 3224 O HOH A 717 4.691 11.043 -7.136 1.00 32.65 O HETATM 3225 O HOH A 720 34.912 -0.863 1.399 1.00 38.66 O HETATM 3226 O HOH A 721 9.859 -27.645 9.586 1.00 46.89 O HETATM 3227 O HOH A 722 25.741 18.279 -11.897 1.00 32.52 O HETATM 3228 O HOH A 723 28.225 -7.173 3.890 1.00 33.63 O HETATM 3229 O HOH A 727 29.575 -1.204 12.016 1.00 29.67 O HETATM 3230 O HOH A 729 9.561 20.867 5.474 1.00 33.62 O HETATM 3231 O HOH A 730 36.678 -4.736 0.640 1.00 41.64 O HETATM 3232 O HOH A 731 17.585 9.362 -18.156 1.00 28.58 O HETATM 3233 O HOH A 732 19.098 -10.754 -6.018 1.00 41.01 O HETATM 3234 O HOH A 733 1.321 -12.108 0.520 1.00 30.07 O HETATM 3235 O HOH A 734 20.016 3.016 7.096 1.00 33.72 O HETATM 3236 O HOH A 735 20.616 8.209 2.256 1.00 32.18 O HETATM 3237 O HOH A 738 22.361 21.052 -2.126 1.00 33.97 O HETATM 3238 O HOH A 739 5.023 -24.250 5.169 1.00 30.49 O HETATM 3239 O HOH A 743 9.041 18.620 -8.813 1.00 33.91 O HETATM 3240 O HOH A 744 4.896 11.038 -4.706 1.00 39.45 O HETATM 3241 O HOH A 745 21.342 -10.666 -6.797 1.00 49.52 O HETATM 3242 O HOH A 746 18.509 -7.330 -6.425 1.00 43.34 O HETATM 3243 O HOH A 747 32.707 -0.669 3.412 1.00 47.29 O HETATM 3244 O HOH A 748 7.130 -14.085 -1.332 1.00 38.68 O HETATM 3245 O HOH A 754 16.058 -6.609 -7.852 1.00 36.37 O HETATM 3246 O HOH A 755 18.176 -9.630 14.686 1.00 33.77 O HETATM 3247 O HOH A 756 24.320 19.050 -9.710 1.00 21.73 O HETATM 3248 O HOH A 758 23.528 -8.147 -7.638 1.00 45.30 O HETATM 3249 O HOH A 761 25.387 -11.047 -5.331 1.00 49.52 O HETATM 3250 O HOH A 763 23.578 2.843 9.592 1.00 35.42 O HETATM 3251 O HOH A 767 18.246 -3.781 9.879 1.00 51.81 O HETATM 3252 O HOH A 768 27.136 2.319 10.924 1.00 41.09 O HETATM 3253 O HOH A 773 11.457 18.578 -11.864 1.00 40.36 O HETATM 3254 O HOH A 774 24.236 24.750 11.102 1.00 35.61 O HETATM 3255 O HOH A 775 4.978 7.434 -14.105 1.00 40.61 O HETATM 3256 O HOH A 776 11.760 20.883 -2.177 1.00 35.48 O HETATM 3257 O HOH A 779 -2.237 -26.415 8.340 1.00 32.81 O HETATM 3258 O HOH A 780 4.262 -0.671 -7.167 1.00 43.31 O HETATM 3259 O HOH A 782 25.184 17.864 -16.585 1.00 40.10 O HETATM 3260 O HOH B 503 38.249 27.428 17.038 1.00 19.26 O HETATM 3261 O HOH B 510 38.026 30.989 14.354 1.00 12.43 O HETATM 3262 O HOH B 512 39.190 26.187 19.724 1.00 18.14 O HETATM 3263 O HOH B 513 37.864 28.108 14.076 1.00 21.86 O HETATM 3264 O HOH B 515 41.573 0.544 38.295 1.00 42.80 O HETATM 3265 O HOH B 517 32.613 27.635 13.720 1.00 26.13 O HETATM 3266 O HOH B 524 48.347 40.025 33.255 1.00 36.10 O HETATM 3267 O HOH B 533 48.515 8.424 21.505 1.00 33.93 O HETATM 3268 O HOH B 534 43.674 38.267 21.600 1.00 34.22 O HETATM 3269 O HOH B 554 49.872 5.636 30.348 1.00 17.86 O HETATM 3270 O HOH B 555 36.952 14.906 9.391 1.00 37.93 O HETATM 3271 O HOH B 556 44.663 24.186 14.892 1.00 34.73 O HETATM 3272 O HOH B 557 57.262 36.438 18.928 1.00 33.74 O HETATM 3273 O HOH B 558 56.356 37.459 30.117 1.00 27.97 O HETATM 3274 O HOH B 561 39.141 -1.704 38.236 1.00 55.77 O HETATM 3275 O HOH B 566 47.004 33.998 34.387 1.00 23.61 O HETATM 3276 O HOH B 568 48.716 -3.265 33.779 1.00 19.72 O HETATM 3277 O HOH B 569 50.376 -5.199 32.398 1.00 28.45 O HETATM 3278 O HOH B 571 44.332 -6.780 33.739 1.00 28.76 O HETATM 3279 O HOH B 572 38.934 -3.345 36.068 1.00 25.46 O HETATM 3280 O HOH B 573 45.340 -9.202 31.106 1.00 38.72 O HETATM 3281 O HOH B 574 33.355 -4.684 28.125 1.00 33.39 O HETATM 3282 O HOH B 575 63.219 20.464 25.825 1.00 30.20 O HETATM 3283 O HOH B 576 58.300 35.901 26.251 1.00 29.14 O HETATM 3284 O HOH B 577 37.840 42.043 31.653 1.00 40.87 O HETATM 3285 O HOH B 578 44.540 44.560 35.430 1.00 36.09 O HETATM 3286 O HOH B 579 60.007 35.350 28.241 1.00 31.82 O HETATM 3287 O HOH B 580 54.863 20.956 43.196 1.00 24.88 O HETATM 3288 O HOH B 581 48.306 29.270 41.759 1.00 35.90 O HETATM 3289 O HOH B 582 48.369 22.588 44.556 1.00 25.31 O HETATM 3290 O HOH B 583 59.321 26.435 18.006 1.00 25.58 O HETATM 3291 O HOH B 584 39.649 27.522 12.554 1.00 32.81 O HETATM 3292 O HOH B 585 42.989 27.231 12.430 1.00 38.78 O HETATM 3293 O HOH B 590 59.996 36.120 17.666 1.00 23.54 O HETATM 3294 O HOH B 593 40.612 1.131 16.214 1.00 21.43 O HETATM 3295 O HOH B 597 40.557 48.677 34.273 1.00 27.18 O HETATM 3296 O HOH B 602 53.899 11.390 29.032 1.00 26.04 O HETATM 3297 O HOH B 611 34.571 31.881 20.359 1.00 31.25 O HETATM 3298 O HOH B 614 31.419 -1.808 13.726 1.00 36.93 O HETATM 3299 O HOH B 615 44.266 0.257 17.478 1.00 26.80 O HETATM 3300 O HOH B 617 46.763 41.883 26.182 1.00 31.75 O HETATM 3301 O HOH B 620 60.828 27.091 35.049 1.00 26.09 O HETATM 3302 O HOH B 622 54.874 17.928 19.932 1.00 31.43 O HETATM 3303 O HOH B 623 38.776 20.298 14.621 1.00 28.32 O HETATM 3304 O HOH B 624 34.791 -5.304 30.283 1.00 31.43 O HETATM 3305 O HOH B 625 42.174 12.572 35.496 1.00 36.67 O HETATM 3306 O HOH B 627 48.356 23.588 29.714 1.00 29.99 O HETATM 3307 O HOH B 629 59.314 33.698 21.744 1.00 37.60 O HETATM 3308 O HOH B 630 57.241 33.548 19.938 1.00 23.80 O HETATM 3309 O HOH B 633 33.131 25.745 22.097 1.00 34.17 O HETATM 3310 O HOH B 635 36.856 32.809 26.084 1.00 35.12 O HETATM 3311 O HOH B 636 49.634 -6.885 30.138 1.00 34.77 O HETATM 3312 O HOH B 642 49.344 19.372 17.562 1.00 31.81 O HETATM 3313 O HOH B 643 66.365 28.017 32.068 1.00 32.12 O HETATM 3314 O HOH B 644 47.224 35.193 36.762 1.00 39.76 O HETATM 3315 O HOH B 649 53.717 19.929 45.413 1.00 37.07 O HETATM 3316 O HOH B 650 45.193 37.296 41.253 1.00 34.49 O HETATM 3317 O HOH B 653 47.992 43.155 32.253 1.00 40.50 O HETATM 3318 O HOH B 654 46.448 27.652 36.178 1.00 42.71 O HETATM 3319 O HOH B 655 39.385 -9.143 22.811 1.00 36.70 O HETATM 3320 O HOH B 659 37.053 0.917 36.184 1.00 42.93 O HETATM 3321 O HOH B 660 39.616 -5.850 36.206 1.00 43.22 O HETATM 3322 O HOH B 661 51.713 12.374 19.280 1.00 39.32 O HETATM 3323 O HOH B 662 45.429 43.602 32.786 1.00 34.79 O HETATM 3324 O HOH B 666 51.023 19.904 19.236 1.00 37.99 O HETATM 3325 O HOH B 667 61.095 33.244 35.627 1.00 39.05 O HETATM 3326 O HOH B 669 54.537 18.198 42.180 1.00 35.47 O HETATM 3327 O HOH B 671 49.447 10.427 22.632 1.00 49.78 O HETATM 3328 O HOH B 674 49.576 32.847 38.436 1.00 42.17 O HETATM 3329 O HOH B 679 63.319 26.222 35.898 1.00 40.22 O HETATM 3330 O HOH B 680 51.431 7.574 31.491 1.00 32.53 O HETATM 3331 O HOH B 684 47.758 19.901 44.916 1.00 47.01 O HETATM 3332 O HOH B 689 45.816 2.543 37.320 1.00 32.09 O HETATM 3333 O HOH B 690 41.146 13.626 10.223 1.00 31.32 O HETATM 3334 O HOH B 691 48.317 32.557 17.197 1.00 36.44 O HETATM 3335 O HOH B 694 48.626 16.166 30.158 1.00 33.48 O HETATM 3336 O HOH B 695 31.448 22.379 16.817 1.00 37.07 O HETATM 3337 O HOH B 696 45.820 5.191 13.037 1.00 28.89 O HETATM 3338 O HOH B 697 36.651 7.982 6.221 1.00 46.05 O HETATM 3339 O HOH B 698 53.556 8.609 29.568 1.00 26.41 O HETATM 3340 O HOH B 699 56.262 36.903 27.140 1.00 37.99 O HETATM 3341 O HOH B 700 49.108 45.401 33.794 1.00 27.15 O HETATM 3342 O HOH B 701 65.246 27.985 26.979 1.00 31.93 O HETATM 3343 O HOH B 705 49.242 43.830 29.955 1.00 37.92 O HETATM 3344 O HOH B 709 42.383 -0.644 15.556 1.00 40.94 O HETATM 3345 O HOH B 712 43.143 15.410 10.046 1.00 37.82 O HETATM 3346 O HOH B 718 35.866 32.512 18.135 1.00 43.81 O HETATM 3347 O HOH B 719 35.346 23.372 11.368 1.00 40.89 O HETATM 3348 O HOH B 724 47.135 -10.114 29.212 1.00 42.12 O HETATM 3349 O HOH B 725 58.572 38.369 31.078 1.00 39.35 O HETATM 3350 O HOH B 726 54.212 12.002 26.385 1.00 39.49 O HETATM 3351 O HOH B 728 43.165 14.561 34.080 1.00 39.59 O HETATM 3352 O HOH B 736 35.063 9.078 12.457 1.00 36.31 O HETATM 3353 O HOH B 737 47.928 25.837 32.541 1.00 35.14 O HETATM 3354 O HOH B 740 33.739 32.351 17.269 1.00 39.17 O HETATM 3355 O HOH B 741 41.703 18.661 26.964 1.00 43.31 O HETATM 3356 O HOH B 742 46.519 1.051 39.823 1.00 34.00 O HETATM 3357 O HOH B 749 43.455 44.079 26.581 1.00 39.96 O HETATM 3358 O HOH B 750 48.716 20.410 15.211 1.00 34.13 O HETATM 3359 O HOH B 751 35.732 -5.169 24.249 1.00 44.27 O HETATM 3360 O HOH B 752 60.320 36.805 34.881 1.00 35.11 O HETATM 3361 O HOH B 753 62.526 34.837 36.789 1.00 50.42 O HETATM 3362 O HOH B 757 32.758 -5.942 12.270 1.00 32.70 O HETATM 3363 O HOH B 759 39.598 17.730 15.175 1.00 37.31 O HETATM 3364 O HOH B 760 31.823 0.060 27.631 1.00 38.24 O HETATM 3365 O HOH B 762 40.162 -5.200 14.884 1.00 45.62 O HETATM 3366 O HOH B 764 29.859 -0.956 15.928 1.00 38.63 O HETATM 3367 O HOH B 765 60.809 35.607 32.000 1.00 43.77 O HETATM 3368 O HOH B 766 68.774 32.579 35.517 1.00 49.81 O HETATM 3369 O HOH B 769 41.038 -3.119 16.478 1.00 39.81 O HETATM 3370 O HOH B 770 48.283 29.686 36.810 1.00 40.95 O HETATM 3371 O HOH B 771 44.519 18.101 26.808 1.00 38.59 O HETATM 3372 O HOH B 772 42.091 14.781 27.036 1.00 38.14 O HETATM 3373 O HOH B 777 45.499 12.227 42.606 1.00 34.43 O HETATM 3374 O HOH B 778 48.681 30.415 44.336 1.00 38.08 O HETATM 3375 O HOH B 781 46.443 15.669 31.812 1.00 34.60 O HETATM 3376 O HOH B 783 45.864 25.213 34.567 1.00 39.25 O CONECT 585 3018 CONECT 602 3018 CONECT 619 3018 CONECT 628 3018 CONECT 678 3018 CONECT 679 3018 CONECT 890 3019 CONECT 907 3019 CONECT 922 3019 CONECT 931 3019 CONECT 985 3019 CONECT 986 3019 CONECT 1248 3020 CONECT 1265 3020 CONECT 1278 3020 CONECT 1287 3020 CONECT 1332 3020 CONECT 1333 3020 CONECT 1385 3017 CONECT 1611 3072 CONECT 1638 3072 CONECT 1657 3072 CONECT 2088 3073 CONECT 2105 3073 CONECT 2123 3073 CONECT 2131 3073 CONECT 2180 3073 CONECT 2181 3073 CONECT 2391 3074 CONECT 2407 3074 CONECT 2423 3074 CONECT 2432 3074 CONECT 2482 3074 CONECT 2483 3074 CONECT 2781 3075 CONECT 2798 3075 CONECT 2811 3075 CONECT 2820 3075 CONECT 2865 3075 CONECT 2866 3075 CONECT 3017 1385 3094 CONECT 3018 585 602 619 628 CONECT 3018 678 679 3234 CONECT 3019 890 907 922 931 CONECT 3019 985 986 3099 CONECT 3020 1248 1265 1278 1287 CONECT 3020 1332 1333 3143 CONECT 3021 3022 CONECT 3022 3021 3023 CONECT 3023 3022 3024 CONECT 3024 3023 3026 CONECT 3025 3026 3027 CONECT 3026 3024 3025 CONECT 3027 3025 3029 CONECT 3028 3029 3030 CONECT 3029 3027 3028 CONECT 3030 3028 3032 CONECT 3031 3032 3033 CONECT 3032 3030 3031 CONECT 3033 3031 3034 CONECT 3034 3033 CONECT 3035 3036 CONECT 3036 3035 3037 CONECT 3037 3036 3038 CONECT 3038 3037 3040 CONECT 3039 3040 3041 CONECT 3040 3038 3039 CONECT 3041 3039 3043 CONECT 3042 3043 3044 CONECT 3043 3041 3042 CONECT 3044 3042 3046 CONECT 3045 3046 3047 CONECT 3046 3044 3045 CONECT 3047 3045 3048 CONECT 3048 3047 CONECT 3049 3050 CONECT 3050 3049 3051 CONECT 3051 3050 3052 CONECT 3052 3051 3053 CONECT 3053 3052 3054 CONECT 3054 3053 3055 CONECT 3055 3054 3056 CONECT 3056 3055 3057 CONECT 3057 3056 3058 CONECT 3058 3057 3059 CONECT 3059 3058 3060 CONECT 3060 3059 3061 CONECT 3061 3060 3062 CONECT 3062 3061 3063 CONECT 3063 3062 3064 CONECT 3064 3063 3065 CONECT 3065 3064 3066 CONECT 3066 3065 3067 CONECT 3067 3066 CONECT 3068 3069 3070 CONECT 3069 3068 CONECT 3070 3068 3071 CONECT 3071 3070 CONECT 3072 1611 1638 1657 3276 CONECT 3073 2088 2105 2123 2131 CONECT 3073 2180 2181 3337 CONECT 3074 2391 2407 2423 2432 CONECT 3074 2482 2483 3290 CONECT 3075 2781 2798 2811 2820 CONECT 3075 2865 2866 3342 CONECT 3076 3077 CONECT 3077 3076 3078 CONECT 3078 3077 3079 CONECT 3079 3078 3081 CONECT 3080 3081 3082 CONECT 3081 3079 3080 CONECT 3082 3080 3084 CONECT 3083 3084 3085 CONECT 3084 3082 3083 CONECT 3085 3083 3087 CONECT 3086 3087 3088 CONECT 3087 3085 3086 CONECT 3088 3086 3089 CONECT 3089 3088 CONECT 3090 3091 3092 CONECT 3091 3090 CONECT 3092 3090 3093 CONECT 3093 3092 CONECT 3094 3017 CONECT 3099 3019 CONECT 3143 3020 CONECT 3234 3018 CONECT 3276 3072 CONECT 3290 3074 CONECT 3337 3073 CONECT 3342 3075 END