HEADER LIGASE 19-MAR-05 1Z5S TITLE CRYSTAL STRUCTURE OF A COMPLEX BETWEEN UBC9, SUMO-1, TITLE 2 RANGAP1 AND NUP358/RANBP2 COMPND MOL_ID: 1; COMPND 2 MOLECULE: UBIQUITIN-CONJUGATING ENZYME E2 I; COMPND 3 CHAIN: A; COMPND 4 SYNONYM: UBIQUITIN-PROTEIN LIGASE I, UBIQUITIN CARRIER COMPND 5 PROTEIN I, SUMO-1-PROTEIN LIGASE, SUMO- 1 CONJUGATING COMPND 6 ENZYME, UBIQUITIN CARRIER PROTEIN 9, P18; COMPND 7 EC: 6.3.2.19; COMPND 8 ENGINEERED: YES; COMPND 9 MOL_ID: 2; COMPND 10 MOLECULE: UBIQUITIN-LIKE PROTEIN SMT3C; COMPND 11 CHAIN: B; COMPND 12 SYNONYM: UBIQUITIN-HOMOLOGY DOMAIN PROTEIN PIC1, UBIQUITIN- COMPND 13 LIKE PROTEIN UBL1, UBIQUITIN-RELATED PROTEIN SUMO-1, GAP COMPND 14 MODIFYING PROTEIN 1, GMP1, SENTRIN, OK/SW-CL.43; COMPND 15 ENGINEERED: YES; COMPND 16 MOL_ID: 3; COMPND 17 MOLECULE: RAN GTPASE-ACTIVATING PROTEIN 1; COMPND 18 CHAIN: C; COMPND 19 FRAGMENT: C-TERMINAL DOMAIN; COMPND 20 ENGINEERED: YES; COMPND 21 MOL_ID: 4; COMPND 22 MOLECULE: RAN-BINDING PROTEIN 2; COMPND 23 CHAIN: D; COMPND 24 FRAGMENT: IR1-M DOMAIN; COMPND 25 SYNONYM: RANBP2, NUCLEAR PORE COMPLEX PROTEIN NUP358, COMPND 26 NUCLEOPORIN NUP358, 358 KDA NUCLEOPORIN, P270; COMPND 27 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 3 ORGANISM_COMMON: HUMAN; SOURCE 4 ORGANISM_TAXID: 9606; SOURCE 5 GENE: UBE2I, UBC9, UBCE9; SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21(DE3); SOURCE 7 EXPRESSION_SYSTEM_TAXID: 469008; SOURCE 8 EXPRESSION_SYSTEM_STRAIN: BL21DE3; SOURCE 9 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 10 EXPRESSION_SYSTEM_PLASMID: PET28B; SOURCE 11 MOL_ID: 2; SOURCE 12 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 13 ORGANISM_COMMON: HUMAN; SOURCE 14 ORGANISM_TAXID: 9606; SOURCE 15 GENE: UBL1, SMT3C, SMT3H3; SOURCE 16 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21(DE3); SOURCE 17 EXPRESSION_SYSTEM_TAXID: 469008; SOURCE 18 EXPRESSION_SYSTEM_STRAIN: BL21DE3; SOURCE 19 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 20 EXPRESSION_SYSTEM_PLASMID: PET28B; SOURCE 21 MOL_ID: 3; SOURCE 22 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 23 ORGANISM_COMMON: HUMAN; SOURCE 24 ORGANISM_TAXID: 9606; SOURCE 25 GENE: RANGAP1; SOURCE 26 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21(DE3); SOURCE 27 EXPRESSION_SYSTEM_TAXID: 469008; SOURCE 28 EXPRESSION_SYSTEM_STRAIN: BL21DE3; SOURCE 29 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 30 EXPRESSION_SYSTEM_PLASMID: PSMT3; SOURCE 31 MOL_ID: 4; SOURCE 32 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 33 ORGANISM_COMMON: HUMAN; SOURCE 34 ORGANISM_TAXID: 9606; SOURCE 35 GENE: RANBP2, NUP358; SOURCE 36 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21(DE3); SOURCE 37 EXPRESSION_SYSTEM_TAXID: 469008; SOURCE 38 EXPRESSION_SYSTEM_STRAIN: BL21DE3; SOURCE 39 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 40 EXPRESSION_SYSTEM_PLASMID: PSMT3 KEYWDS E3, LIGASE, SUMO, UBC9, NUCLEAR PORE COMPLEX EXPDTA X-RAY DIFFRACTION AUTHOR D.REVERTER,C.D.LIMA REVDAT 2 24-FEB-09 1Z5S 1 VERSN REVDAT 1 07-JUN-05 1Z5S 0 JRNL AUTH D.REVERTER,C.D.LIMA JRNL TITL INSIGHTS INTO E3 LIGASE ACTIVITY REVEALED BY A JRNL TITL 2 SUMO-RANGAP1-UBC9-NUP358 COMPLEX. JRNL REF NATURE V. 435 687 2005 JRNL REFN ISSN 0028-0836 JRNL PMID 15931224 JRNL DOI 10.1038/NATURE03588 REMARK 1 REMARK 2 REMARK 2 RESOLUTION. 3.01 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : CNS 1.1 REMARK 3 AUTHORS : BRUNGER,ADAMS,CLORE,DELANO,GROS,GROSSE- REMARK 3 : KUNSTLEVE,JIANG,KUSZEWSKI,NILGES, PANNU, REMARK 3 : READ,RICE,SIMONSON,WARREN REMARK 3 REMARK 3 REFINEMENT TARGET : ENGH & HUBER REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 3.01 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 29.69 REMARK 3 DATA CUTOFF (SIGMA(F)) : 0.000 REMARK 3 DATA CUTOFF HIGH (ABS(F)) : 2281669.870 REMARK 3 DATA CUTOFF LOW (ABS(F)) : 0.0000 REMARK 3 COMPLETENESS (WORKING+TEST) (%) : 96.5 REMARK 3 NUMBER OF REFLECTIONS : 16461 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) : 0.247 REMARK 3 FREE R VALUE : 0.290 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 5.100 REMARK 3 FREE R VALUE TEST SET COUNT : 832 REMARK 3 ESTIMATED ERROR OF FREE R VALUE : 0.010 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) : 3.01 REMARK 3 BIN RESOLUTION RANGE LOW (A) : 3.19 REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : 86.20 REMARK 3 REFLECTIONS IN BIN (WORKING SET) : 2299 REMARK 3 BIN R VALUE (WORKING SET) : 0.4250 REMARK 3 BIN FREE R VALUE : 0.4320 REMARK 3 BIN FREE R VALUE TEST SET SIZE (%) : 5.00 REMARK 3 BIN FREE R VALUE TEST SET COUNT : 122 REMARK 3 ESTIMATED ERROR OF BIN FREE R VALUE : 0.039 REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 3564 REMARK 3 NUCLEIC ACID ATOMS : 0 REMARK 3 HETEROGEN ATOMS : 0 REMARK 3 SOLVENT ATOMS : 28 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : 74.00 REMARK 3 MEAN B VALUE (OVERALL, A**2) : 90.00 REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : -15.45000 REMARK 3 B22 (A**2) : -15.45000 REMARK 3 B33 (A**2) : 30.91000 REMARK 3 B12 (A**2) : 17.61000 REMARK 3 B13 (A**2) : 0.00000 REMARK 3 B23 (A**2) : 0.00000 REMARK 3 REMARK 3 ESTIMATED COORDINATE ERROR. REMARK 3 ESD FROM LUZZATI PLOT (A) : 0.47 REMARK 3 ESD FROM SIGMAA (A) : 0.99 REMARK 3 LOW RESOLUTION CUTOFF (A) : 8.00 REMARK 3 REMARK 3 CROSS-VALIDATED ESTIMATED COORDINATE ERROR. REMARK 3 ESD FROM C-V LUZZATI PLOT (A) : 0.57 REMARK 3 ESD FROM C-V SIGMAA (A) : 1.16 REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES. REMARK 3 BOND LENGTHS (A) : 0.006 REMARK 3 BOND ANGLES (DEGREES) : 1.20 REMARK 3 DIHEDRAL ANGLES (DEGREES) : 21.40 REMARK 3 IMPROPER ANGLES (DEGREES) : 0.84 REMARK 3 REMARK 3 ISOTROPIC THERMAL MODEL : RESTRAINED REMARK 3 REMARK 3 ISOTROPIC THERMAL FACTOR RESTRAINTS. RMS SIGMA REMARK 3 MAIN-CHAIN BOND (A**2) : 2.270 ; 2.000 REMARK 3 MAIN-CHAIN ANGLE (A**2) : 3.980 ; 3.500 REMARK 3 SIDE-CHAIN BOND (A**2) : 2.800 ; 2.500 REMARK 3 SIDE-CHAIN ANGLE (A**2) : 4.720 ; 4.000 REMARK 3 REMARK 3 BULK SOLVENT MODELING. REMARK 3 METHOD USED : FLAT MODEL REMARK 3 KSOL : 0.27 REMARK 3 BSOL : 13.94 REMARK 3 REMARK 3 NCS MODEL : NULL REMARK 3 REMARK 3 NCS RESTRAINTS. RMS SIGMA/WEIGHT REMARK 3 GROUP 1 POSITIONAL (A) : NULL ; NULL REMARK 3 GROUP 1 B-FACTOR (A**2) : NULL ; NULL REMARK 3 REMARK 3 PARAMETER FILE 1 : PROTEIN_REP.PARAM REMARK 3 PARAMETER FILE 2 : DNA-RNA_REP.PARAM REMARK 3 PARAMETER FILE 3 : WATER_REP.PARAM REMARK 3 PARAMETER FILE 4 : ION.PARAM REMARK 3 PARAMETER FILE 5 : NULL REMARK 3 TOPOLOGY FILE 1 : PROTEIN.TOP REMARK 3 TOPOLOGY FILE 2 : DNA-RNA.TOP REMARK 3 TOPOLOGY FILE 3 : WATER.TOP REMARK 3 TOPOLOGY FILE 4 : ION.TOP REMARK 3 TOPOLOGY FILE 5 : NULL REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: BULK SOLVENT MODEL USED REMARK 4 REMARK 4 1Z5S COMPLIES WITH FORMAT V. 3.15, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 30-MAR-05. REMARK 100 THE RCSB ID CODE IS RCSB032333. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 24-AUG-04 REMARK 200 TEMPERATURE (KELVIN) : 100 REMARK 200 PH : 5.0 REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : Y REMARK 200 RADIATION SOURCE : APS REMARK 200 BEAMLINE : 31-ID REMARK 200 X-RAY GENERATOR MODEL : NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 0.9793 REMARK 200 MONOCHROMATOR : DIAMOND REMARK 200 OPTICS : NULL REMARK 200 REMARK 200 DETECTOR TYPE : CCD REMARK 200 DETECTOR MANUFACTURER : MARRESEARCH REMARK 200 INTENSITY-INTEGRATION SOFTWARE : DENZO REMARK 200 DATA SCALING SOFTWARE : SCALEPACK REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 16464 REMARK 200 RESOLUTION RANGE HIGH (A) : 3.000 REMARK 200 RESOLUTION RANGE LOW (A) : 50.000 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : 0.000 REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 97.0 REMARK 200 DATA REDUNDANCY : NULL REMARK 200 R MERGE (I) : 0.07500 REMARK 200 R SYM (I) : NULL REMARK 200 FOR THE DATA SET : 15.1000 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 3.00 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 3.11 REMARK 200 COMPLETENESS FOR SHELL (%) : 91.8 REMARK 200 DATA REDUNDANCY IN SHELL : NULL REMARK 200 R MERGE FOR SHELL (I) : 0.46400 REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200 FOR SHELL : 2.100 REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REPLACEMENT REMARK 200 SOFTWARE USED: MOLREP REMARK 200 STARTING MODEL: RANGAP1-UBC9 COMPLEX REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 67.73 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 3.81 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: 18% PEG4000 (W/V), 0.1 M SODIUM REMARK 280 CITRATE, 0.2 M AMMONIUM ACETATE, PH 5.0, VAPOR DIFFUSION, REMARK 280 HANGING DROP, TEMPERATURE 291K REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 32 2 1 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -Y,X-Y,Z+2/3 REMARK 290 3555 -X+Y,-X,Z+1/3 REMARK 290 4555 Y,X,-Z REMARK 290 5555 X-Y,-Y,-Z+1/3 REMARK 290 6555 -X,-X+Y,-Z+2/3 REMARK 290 REMARK 290 WHERE NNN -> OPERATOR NUMBER REMARK 290 MMM -> TRANSLATION VECTOR REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY REMARK 290 RELATED MOLECULES. REMARK 290 SMTRY1 1 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 1 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 1 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 2 -0.500000 -0.866025 0.000000 0.00000 REMARK 290 SMTRY2 2 0.866025 -0.500000 0.000000 0.00000 REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 39.74200 REMARK 290 SMTRY1 3 -0.500000 0.866025 0.000000 0.00000 REMARK 290 SMTRY2 3 -0.866025 -0.500000 0.000000 0.00000 REMARK 290 SMTRY3 3 0.000000 0.000000 1.000000 19.87100 REMARK 290 SMTRY1 4 -0.500000 0.866025 0.000000 0.00000 REMARK 290 SMTRY2 4 0.866025 0.500000 0.000000 0.00000 REMARK 290 SMTRY3 4 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY1 5 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 5 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 5 0.000000 0.000000 -1.000000 19.87100 REMARK 290 SMTRY1 6 -0.500000 -0.866025 0.000000 0.00000 REMARK 290 SMTRY2 6 -0.866025 0.500000 0.000000 0.00000 REMARK 290 SMTRY3 6 0.000000 0.000000 -1.000000 39.74200 REMARK 290 REMARK 290 REMARK: NULL REMARK 300 REMARK 300 BIOMOLECULE: 1 REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON REMARK 300 BURIED SURFACE AREA. REMARK 350 REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. REMARK 350 REMARK 350 BIOMOLECULE: 1 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: TETRAMERIC REMARK 350 APPLY THE FOLLOWING TO CHAINS: A, B, C, D REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 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 SER A 158 REMARK 465 MET B 16 REMARK 465 GLY B 17 REMARK 465 GLU B 18 REMARK 465 GLY B 19 REMARK 465 SER C 416 REMARK 465 LEU C 417 REMARK 465 ASN C 418 REMARK 465 THR C 419 REMARK 465 GLY C 420 REMARK 465 GLU C 421 REMARK 465 PRO C 422 REMARK 465 ALA C 423 REMARK 465 PRO C 424 REMARK 465 VAL C 425 REMARK 465 LEU C 426 REMARK 465 SER C 427 REMARK 465 SER C 428 REMARK 465 PRO C 429 REMARK 465 PRO C 430 REMARK 465 PRO C 431 REMARK 465 GLU D 2694 REMARK 465 LYS D 2695 REMARK 465 CYS D 2696 REMARK 465 ARG D 2697 REMARK 465 PRO D 2698 REMARK 465 LEU D 2699 REMARK 465 GLU D 2700 REMARK 465 GLU D 2701 REMARK 465 ASN D 2702 REMARK 465 THR D 2703 REMARK 465 ALA D 2704 REMARK 465 ASP D 2705 REMARK 465 ASN D 2706 REMARK 465 GLU D 2707 REMARK 465 LYS D 2708 REMARK 465 GLU D 2709 REMARK 465 CYS D 2710 REMARK 465 ILE D 2711 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 SER A 2 CB OG REMARK 470 LYS A 18 CG CD CE NZ REMARK 470 LYS A 49 CG CD CE NZ REMARK 470 GLU B 83 CG CD OE1 OE2 REMARK 470 LYS C 452 CG CD CE NZ REMARK 470 LYS C 553 CG CD CE NZ REMARK 470 LYS C 586 CG CD CE NZ REMARK 470 LYS D2650 CD CE NZ REMARK 470 ARG D2663 CD NE CZ NH1 NH2 REMARK 470 ASP D2665 OD1 OD2 REMARK 470 TYR D2666 CD1 CD2 CE1 CE2 CZ OH REMARK 470 GLU D2669 CD OE1 OE2 REMARK 470 GLU D2670 CD OE1 OE2 REMARK 470 LYS D2683 CG CD CE NZ 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 PRO A 28 -174.63 -63.89 REMARK 500 THR A 29 -164.26 -111.71 REMARK 500 ASP A 33 -7.93 -48.76 REMARK 500 THR A 35 -171.71 -56.25 REMARK 500 TYR A 68 143.62 -29.38 REMARK 500 PRO A 84 -34.88 -35.87 REMARK 500 TYR A 87 162.92 -49.41 REMARK 500 LYS A 101 -90.01 -136.46 REMARK 500 GLU A 122 67.87 -119.45 REMARK 500 ASN A 124 63.57 -107.83 REMARK 500 ILE A 125 -17.78 -49.80 REMARK 500 ASP A 127 79.63 178.40 REMARK 500 ASP B 30 27.84 -166.34 REMARK 500 MET B 40 23.01 -68.20 REMARK 500 GLN B 55 -5.54 -144.84 REMARK 500 MET B 59 -34.00 -39.55 REMARK 500 SER B 61 -41.91 -20.73 REMARK 500 ARG B 63 133.53 -171.33 REMARK 500 THR B 76 145.81 -178.64 REMARK 500 PRO B 77 -12.96 -46.04 REMARK 500 GLU B 83 -152.79 -73.50 REMARK 500 GLU B 85 -0.73 67.23 REMARK 500 ASP B 86 174.38 -49.61 REMARK 500 PRO C 441 174.39 -46.34 REMARK 500 SER C 442 136.08 178.79 REMARK 500 ARG C 448 32.65 -68.54 REMARK 500 LYS C 452 30.87 -91.86 REMARK 500 SER C 454 2.98 -55.66 REMARK 500 VAL C 455 -20.09 -148.58 REMARK 500 ALA C 458 44.85 -69.09 REMARK 500 GLN C 459 -47.72 -166.21 REMARK 500 ASP C 462 82.70 -68.40 REMARK 500 THR C 463 2.96 -63.74 REMARK 500 SER C 464 -81.21 -61.18 REMARK 500 SER C 478 6.59 -56.14 REMARK 500 ASP C 482 -2.93 -52.41 REMARK 500 GLU C 483 172.26 -47.27 REMARK 500 LYS C 500 -71.26 -66.23 REMARK 500 SER C 504 83.80 167.31 REMARK 500 SER C 505 -25.27 -29.95 REMARK 500 SER C 506 44.34 -72.22 REMARK 500 LEU C 513 -35.53 -39.16 REMARK 500 MET C 520 32.67 -90.33 REMARK 500 ASP C 527 -158.91 -141.67 REMARK 500 ALA C 533 -81.57 -53.56 REMARK 500 TYR C 550 4.95 -58.49 REMARK 500 LYS C 553 8.55 -58.04 REMARK 500 SER C 568 -72.75 -30.12 REMARK 500 LEU C 570 12.09 -65.44 REMARK 500 CYS C 573 46.80 -153.06 REMARK 500 PHE C 575 -72.87 -57.97 REMARK 500 PRO D2655 -35.18 -32.18 REMARK 500 THR D2656 52.22 -94.57 REMARK 500 ASP D2665 -145.49 -60.17 REMARK 500 TYR D2666 99.24 -46.22 REMARK 500 SER D2668 -124.74 -163.17 REMARK 500 GLU D2669 49.75 -171.41 REMARK 500 GLU D2670 125.83 -172.04 REMARK 500 GLU D2671 137.23 176.29 REMARK 500 ASP D2674 -31.22 -161.38 REMARK 500 GLU D2675 139.14 -32.83 REMARK 500 ASN D2685 -75.16 18.02 REMARK 500 LYS D2687 173.59 -47.89 REMARK 500 ASP D2691 108.30 -44.98 REMARK 500 REMARK 500 REMARK: NULL REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 1KPS RELATED DB: PDB REMARK 900 PUTATIVE SUBSTRATE COMPLEX BETWEEN UBC9 AND RANGAP1 REMARK 999 REMARK 999 SEQUENCE REMARK 999 COVALENT ISOPEPTIDE BOND BETWEEN RANGAP1 LYS524 AND REMARK 999 SUMO C-TERMINUS GLY97. DBREF 1Z5S A 1 158 UNP P63279 UBE2I_HUMAN 1 158 DBREF 1Z5S B 18 97 UNP P63165 SUMO1_HUMAN 18 97 DBREF 1Z5S C 418 587 UNP P46060 RGP1_HUMAN 418 587 DBREF 1Z5S D 2631 2711 UNP P49792 RBP2_HUMAN 2631 2711 SEQADV 1Z5S MET B 16 UNP P63165 CLONING ARTIFACT SEQADV 1Z5S GLY B 17 UNP P63165 CLONING ARTIFACT SEQADV 1Z5S SER C 416 UNP P46060 CLONING ARTIFACT SEQADV 1Z5S LEU C 417 UNP P46060 CLONING ARTIFACT SEQADV 1Z5S SER D 2629 UNP P49792 CLONING ARTIFACT SEQADV 1Z5S LEU D 2630 UNP P49792 CLONING ARTIFACT SEQRES 1 A 158 MET SER GLY ILE ALA LEU SER ARG LEU ALA GLN GLU ARG SEQRES 2 A 158 LYS ALA TRP ARG LYS ASP HIS PRO PHE GLY PHE VAL ALA SEQRES 3 A 158 VAL PRO THR LYS ASN PRO ASP GLY THR MET ASN LEU MET SEQRES 4 A 158 ASN TRP GLU CYS ALA ILE PRO GLY LYS LYS GLY THR PRO SEQRES 5 A 158 TRP GLU GLY GLY LEU PHE LYS LEU ARG MET LEU PHE LYS SEQRES 6 A 158 ASP ASP TYR PRO SER SER PRO PRO LYS CYS LYS PHE GLU SEQRES 7 A 158 PRO PRO LEU PHE HIS PRO ASN VAL TYR PRO SER GLY THR SEQRES 8 A 158 VAL CYS LEU SER ILE LEU GLU GLU ASP LYS ASP TRP ARG SEQRES 9 A 158 PRO ALA ILE THR ILE LYS GLN ILE LEU LEU GLY ILE GLN SEQRES 10 A 158 GLU LEU LEU ASN GLU PRO ASN ILE GLN ASP PRO ALA GLN SEQRES 11 A 158 ALA GLU ALA TYR THR ILE TYR CYS GLN ASN ARG VAL GLU SEQRES 12 A 158 TYR GLU LYS ARG VAL ARG ALA GLN ALA LYS LYS PHE ALA SEQRES 13 A 158 PRO SER SEQRES 1 B 82 MET GLY GLU GLY GLU TYR ILE LYS LEU LYS VAL ILE GLY SEQRES 2 B 82 GLN ASP SER SER GLU ILE HIS PHE LYS VAL LYS MET THR SEQRES 3 B 82 THR HIS LEU LYS LYS LEU LYS GLU SER TYR CYS GLN ARG SEQRES 4 B 82 GLN GLY VAL PRO MET ASN SER LEU ARG PHE LEU PHE GLU SEQRES 5 B 82 GLY GLN ARG ILE ALA ASP ASN HIS THR PRO LYS GLU LEU SEQRES 6 B 82 GLY MET GLU GLU GLU ASP VAL ILE GLU VAL TYR GLN GLU SEQRES 7 B 82 GLN THR GLY GLY SEQRES 1 C 172 SER LEU ASN THR GLY GLU PRO ALA PRO VAL LEU SER SER SEQRES 2 C 172 PRO PRO PRO ALA ASP VAL SER THR PHE LEU ALA PHE PRO SEQRES 3 C 172 SER PRO GLU LYS LEU LEU ARG LEU GLY PRO LYS SER SER SEQRES 4 C 172 VAL LEU ILE ALA GLN GLN THR ASP THR SER ASP PRO GLU SEQRES 5 C 172 LYS VAL VAL SER ALA PHE LEU LYS VAL SER SER VAL PHE SEQRES 6 C 172 LYS ASP GLU ALA THR VAL ARG MET ALA VAL GLN ASP ALA SEQRES 7 C 172 VAL ASP ALA LEU MET GLN LYS ALA PHE ASN SER SER SER SEQRES 8 C 172 PHE ASN SER ASN THR PHE LEU THR ARG LEU LEU VAL HIS SEQRES 9 C 172 MET GLY LEU LEU LYS SER GLU ASP LYS VAL LYS ALA ILE SEQRES 10 C 172 ALA ASN LEU TYR GLY PRO LEU MET ALA LEU ASN HIS MET SEQRES 11 C 172 VAL GLN GLN ASP TYR PHE PRO LYS ALA LEU ALA PRO LEU SEQRES 12 C 172 LEU LEU ALA PHE VAL THR LYS PRO ASN SER ALA LEU GLU SEQRES 13 C 172 SER CYS SER PHE ALA ARG HIS SER LEU LEU GLN THR LEU SEQRES 14 C 172 TYR LYS VAL SEQRES 1 D 83 SER LEU ASP VAL LEU ILE VAL TYR GLU LEU THR PRO THR SEQRES 2 D 83 ALA GLU GLN LYS ALA LEU ALA THR LYS LEU LYS LEU PRO SEQRES 3 D 83 PRO THR PHE PHE CYS TYR LYS ASN ARG PRO ASP TYR VAL SEQRES 4 D 83 SER GLU GLU GLU GLU ASP ASP GLU ASP PHE GLU THR ALA SEQRES 5 D 83 VAL LYS LYS LEU ASN GLY LYS LEU TYR LEU ASP GLY SER SEQRES 6 D 83 GLU LYS CYS ARG PRO LEU GLU GLU ASN THR ALA ASP ASN SEQRES 7 D 83 GLU LYS GLU CYS ILE FORMUL 5 HOH *28(H2 O) HELIX 69 69 ILE A 4 ASP A 19 1 16 HELIX 70 70 LEU A 94 GLU A 98 1 5 HELIX 71 71 THR A 108 GLU A 122 1 15 HELIX 72 72 GLN A 130 LYS A 154 1 25 HELIX 73 73 HIS B 43 ARG B 54 1 12 HELIX 74 74 THR B 76 GLY B 81 1 6 HELIX 75 75 ALA C 432 PHE C 440 1 9 HELIX 76 76 LEU C 446 SER C 454 1 9 HELIX 77 77 LEU C 456 THR C 461 1 6 HELIX 78 78 ASP C 465 SER C 478 1 14 HELIX 79 79 ALA C 484 PHE C 502 1 19 HELIX 80 80 ASN C 508 MET C 520 1 13 HELIX 81 81 LEU C 535 VAL C 546 1 12 HELIX 82 82 LEU C 555 LYS C 565 1 11 HELIX 83 83 SER C 568 VAL C 587 1 20 HELIX 84 84 THR D 2641 LEU D 2651 1 11 HELIX 85 85 ASP D 2676 LEU D 2684 1 9 SHEET 41 41 1 VAL A 25 LYS A 30 0 SHEET 42 42 1 MET A 36 PRO A 46 0 SHEET 43 43 1 LEU A 57 LEU A 63 0 SHEET 44 44 1 LYS A 74 PHE A 77 0 SHEET 45 45 1 ILE B 22 ILE B 27 0 SHEET 46 46 1 GLU B 33 VAL B 38 0 SHEET 47 47 1 PHE B 64 PHE B 66 0 SHEET 48 48 1 GLN B 69 ARG B 70 0 SHEET 49 49 1 VAL B 87 VAL B 90 0 SHEET 50 50 1 VAL D2632 GLU D2637 0 LINK C GLY B 97 NZ LYS C 524 1555 1555 1.33 CISPEP 1 TYR A 68 PRO A 69 0 -0.05 CISPEP 2 GLU A 78 PRO A 79 0 -0.09 CRYST1 157.123 157.123 59.613 90.00 90.00 120.00 P 32 2 1 6 ORIGX1 1.000000 0.000000 0.000000 0.00000 ORIGX2 0.000000 1.000000 0.000000 0.00000 ORIGX3 0.000000 0.000000 1.000000 0.00000 SCALE1 0.006364 0.003675 0.000000 0.00000 SCALE2 0.000000 0.007349 0.000000 0.00000 SCALE3 0.000000 0.000000 0.016775 0.00000 TER 1954 GLY B 97 ATOM 1955 N ALA C 432 71.992 101.695 -26.777 1.00113.52 N ATOM 1956 CA ALA C 432 71.911 100.869 -25.576 1.00115.15 C ATOM 1957 C ALA C 432 70.745 99.884 -25.661 1.00116.12 C ATOM 1958 O ALA C 432 70.769 98.827 -25.025 1.00113.78 O ATOM 1959 CB ALA C 432 71.763 101.757 -24.342 1.00113.97 C ATOM 1960 N ASP C 433 69.728 100.241 -26.444 1.00119.02 N ATOM 1961 CA ASP C 433 68.549 99.393 -26.629 1.00120.72 C ATOM 1962 C ASP C 433 68.825 98.347 -27.694 1.00120.47 C ATOM 1963 O ASP C 433 68.657 97.149 -27.459 1.00120.26 O ATOM 1964 CB ASP C 433 67.330 100.221 -27.054 1.00122.25 C ATOM 1965 CG ASP C 433 66.711 100.988 -25.902 1.00123.24 C ATOM 1966 OD1 ASP C 433 66.411 100.360 -24.863 1.00122.31 O ATOM 1967 OD2 ASP C 433 66.516 102.214 -26.039 1.00124.68 O ATOM 1968 N VAL C 434 69.233 98.811 -28.872 1.00119.59 N ATOM 1969 CA VAL C 434 69.549 97.905 -29.967 1.00118.63 C ATOM 1970 C VAL C 434 70.500 96.837 -29.434 1.00117.49 C ATOM 1971 O VAL C 434 70.320 95.643 -29.689 1.00118.21 O ATOM 1972 CB VAL C 434 70.216 98.652 -31.153 1.00117.28 C ATOM 1973 CG1 VAL C 434 69.166 99.380 -31.969 1.00115.60 C ATOM 1974 CG2 VAL C 434 71.241 99.643 -30.632 1.00117.96 C ATOM 1975 N SER C 435 71.500 97.277 -28.675 1.00114.26 N ATOM 1976 CA SER C 435 72.475 96.370 -28.093 1.00110.17 C ATOM 1977 C SER C 435 71.769 95.173 -27.465 1.00108.32 C ATOM 1978 O SER C 435 71.854 94.057 -27.980 1.00108.99 O ATOM 1979 CB SER C 435 73.301 97.098 -27.033 1.00109.26 C ATOM 1980 OG SER C 435 74.214 96.211 -26.412 1.00109.94 O ATOM 1981 N THR C 436 71.061 95.414 -26.365 1.00105.53 N ATOM 1982 CA THR C 436 70.339 94.355 -25.664 1.00102.75 C ATOM 1983 C THR C 436 69.331 93.612 -26.541 1.00102.10 C ATOM 1984 O THR C 436 69.031 92.444 -26.289 1.00102.13 O ATOM 1985 CB THR C 436 69.607 94.909 -24.433 1.00101.40 C ATOM 1986 OG1 THR C 436 69.029 96.178 -24.759 1.00102.63 O ATOM 1987 CG2 THR C 436 70.565 95.063 -23.261 1.00 99.93 C ATOM 1988 N PHE C 437 68.804 94.278 -27.565 1.00 99.85 N ATOM 1989 CA PHE C 437 67.851 93.626 -28.456 1.00 96.96 C ATOM 1990 C PHE C 437 68.546 92.543 -29.260 1.00 96.63 C ATOM 1991 O PHE C 437 67.974 91.483 -29.514 1.00 95.07 O ATOM 1992 CB PHE C 437 67.228 94.625 -29.425 1.00 95.28 C ATOM 1993 CG PHE C 437 66.534 93.976 -30.589 1.00 94.31 C ATOM 1994 CD1 PHE C 437 65.534 93.034 -30.381 1.00 93.77 C ATOM 1995 CD2 PHE C 437 66.883 94.303 -31.893 1.00 94.69 C ATOM 1996 CE1 PHE C 437 64.892 92.427 -31.457 1.00 93.53 C ATOM 1997 CE2 PHE C 437 66.246 93.702 -32.975 1.00 93.85 C ATOM 1998 CZ PHE C 437 65.250 92.763 -32.755 1.00 93.23 C ATOM 1999 N LEU C 438 69.780 92.827 -29.665 1.00 97.49 N ATOM 2000 CA LEU C 438 70.573 91.889 -30.446 1.00 99.53 C ATOM 2001 C LEU C 438 71.035 90.711 -29.616 1.00 99.85 C ATOM 2002 O LEU C 438 71.227 89.615 -30.142 1.00 99.61 O ATOM 2003 CB LEU C 438 71.787 92.590 -31.048 1.00102.32 C ATOM 2004 CG LEU C 438 71.453 93.592 -32.154 1.00106.32 C ATOM 2005 CD1 LEU C 438 72.739 94.207 -32.691 1.00108.07 C ATOM 2006 CD2 LEU C 438 70.683 92.889 -33.270 1.00105.47 C ATOM 2007 N ALA C 439 71.222 90.937 -28.320 1.00101.45 N ATOM 2008 CA ALA C 439 71.647 89.869 -27.422 1.00103.90 C ATOM 2009 C ALA C 439 70.547 88.807 -27.373 1.00106.03 C ATOM 2010 O ALA C 439 70.787 87.629 -27.662 1.00108.00 O ATOM 2011 CB ALA C 439 71.913 90.427 -26.027 1.00101.12 C ATOM 2012 N PHE C 440 69.340 89.232 -27.014 1.00104.17 N ATOM 2013 CA PHE C 440 68.203 88.325 -26.940 1.00100.25 C ATOM 2014 C PHE C 440 67.046 88.917 -27.721 1.00 97.87 C ATOM 2015 O PHE C 440 66.258 89.694 -27.192 1.00 96.99 O ATOM 2016 CB PHE C 440 67.798 88.104 -25.488 1.00 99.83 C ATOM 2017 CG PHE C 440 68.915 87.609 -24.626 1.00101.22 C ATOM 2018 CD1 PHE C 440 69.974 88.446 -24.291 1.00100.73 C ATOM 2019 CD2 PHE C 440 68.929 86.295 -24.172 1.00103.65 C ATOM 2020 CE1 PHE C 440 71.033 87.983 -23.519 1.00102.16 C ATOM 2021 CE2 PHE C 440 69.986 85.818 -23.396 1.00104.49 C ATOM 2022 CZ PHE C 440 71.040 86.665 -23.070 1.00104.33 C ATOM 2023 N PRO C 441 66.940 88.559 -29.005 1.00 97.43 N ATOM 2024 CA PRO C 441 65.880 89.048 -29.888 1.00 97.69 C ATOM 2025 C PRO C 441 64.499 88.984 -29.254 1.00 98.22 C ATOM 2026 O PRO C 441 64.332 88.462 -28.150 1.00 98.22 O ATOM 2027 CB PRO C 441 66.003 88.138 -31.101 1.00 97.12 C ATOM 2028 CG PRO C 441 67.481 87.909 -31.168 1.00 99.12 C ATOM 2029 CD PRO C 441 67.837 87.636 -29.723 1.00 97.51 C ATOM 2030 N SER C 442 63.517 89.523 -29.968 1.00 97.59 N ATOM 2031 CA SER C 442 62.134 89.555 -29.514 1.00 94.83 C ATOM 2032 C SER C 442 61.278 90.264 -30.548 1.00 96.19 C ATOM 2033 O SER C 442 61.660 91.305 -31.082 1.00 96.45 O ATOM 2034 CB SER C 442 62.018 90.295 -28.183 1.00 91.51 C ATOM 2035 OG SER C 442 60.659 90.447 -27.816 1.00 87.15 O ATOM 2036 N PRO C 443 60.102 89.705 -30.849 1.00 98.07 N ATOM 2037 CA PRO C 443 59.193 90.302 -31.832 1.00 99.08 C ATOM 2038 C PRO C 443 58.675 91.633 -31.311 1.00 99.85 C ATOM 2039 O PRO C 443 58.195 92.471 -32.072 1.00 99.76 O ATOM 2040 CB PRO C 443 58.072 89.269 -31.943 1.00 98.65 C ATOM 2041 CG PRO C 443 58.734 87.981 -31.519 1.00 99.59 C ATOM 2042 CD PRO C 443 59.584 88.415 -30.367 1.00 98.25 C ATOM 2043 N GLU C 444 58.791 91.811 -29.998 1.00101.27 N ATOM 2044 CA GLU C 444 58.316 93.010 -29.323 1.00101.47 C ATOM 2045 C GLU C 444 59.417 94.018 -29.039 1.00 99.53 C ATOM 2046 O GLU C 444 59.312 95.176 -29.438 1.00 98.19 O ATOM 2047 CB GLU C 444 57.632 92.609 -28.018 1.00104.85 C ATOM 2048 CG GLU C 444 56.624 91.487 -28.208 1.00111.33 C ATOM 2049 CD GLU C 444 55.996 91.033 -26.911 1.00115.55 C ATOM 2050 OE1 GLU C 444 56.756 90.691 -25.979 1.00117.85 O ATOM 2051 OE2 GLU C 444 54.746 91.012 -26.830 1.00116.48 O ATOM 2052 N LYS C 445 60.466 93.577 -28.345 1.00 98.14 N ATOM 2053 CA LYS C 445 61.586 94.451 -28.009 1.00 97.35 C ATOM 2054 C LYS C 445 61.996 95.306 -29.202 1.00 99.39 C ATOM 2055 O LYS C 445 62.460 96.437 -29.034 1.00 99.40 O ATOM 2056 CB LYS C 445 62.777 93.625 -27.520 1.00 94.38 C ATOM 2057 CG LYS C 445 62.536 92.971 -26.173 1.00 94.83 C ATOM 2058 CD LYS C 445 63.725 92.145 -25.700 1.00 94.20 C ATOM 2059 CE LYS C 445 63.405 91.469 -24.369 1.00 93.33 C ATOM 2060 NZ LYS C 445 64.491 90.584 -23.872 1.00 90.43 N ATOM 2061 N LEU C 446 61.816 94.760 -30.403 1.00100.45 N ATOM 2062 CA LEU C 446 62.144 95.468 -31.640 1.00 99.75 C ATOM 2063 C LEU C 446 61.266 96.713 -31.735 1.00100.17 C ATOM 2064 O LEU C 446 61.752 97.827 -31.942 1.00 99.67 O ATOM 2065 CB LEU C 446 61.885 94.567 -32.855 1.00 97.31 C ATOM 2066 CG LEU C 446 62.138 95.194 -34.232 1.00 95.50 C ATOM 2067 CD1 LEU C 446 63.632 95.427 -34.396 1.00 95.41 C ATOM 2068 CD2 LEU C 446 61.609 94.293 -35.345 1.00 91.47 C ATOM 2069 N LEU C 447 59.965 96.501 -31.579 1.00100.57 N ATOM 2070 CA LEU C 447 58.980 97.573 -31.637 1.00101.04 C ATOM 2071 C LEU C 447 59.244 98.629 -30.565 1.00101.85 C ATOM 2072 O LEU C 447 59.085 99.827 -30.809 1.00101.41 O ATOM 2073 CB LEU C 447 57.583 96.985 -31.440 1.00 99.65 C ATOM 2074 CG LEU C 447 57.150 95.918 -32.446 1.00 97.23 C ATOM 2075 CD1 LEU C 447 56.054 95.062 -31.836 1.00 95.88 C ATOM 2076 CD2 LEU C 447 56.691 96.585 -33.738 1.00 94.62 C ATOM 2077 N ARG C 448 59.649 98.174 -29.382 1.00101.80 N ATOM 2078 CA ARG C 448 59.922 99.065 -28.262 1.00102.56 C ATOM 2079 C ARG C 448 61.159 99.938 -28.488 1.00103.43 C ATOM 2080 O ARG C 448 61.873 100.278 -27.543 1.00103.24 O ATOM 2081 CB ARG C 448 60.087 98.247 -26.978 1.00103.12 C ATOM 2082 CG ARG C 448 59.905 99.053 -25.699 1.00108.34 C ATOM 2083 CD ARG C 448 58.536 99.731 -25.678 1.00114.05 C ATOM 2084 NE ARG C 448 58.326 100.562 -24.492 1.00117.10 N ATOM 2085 CZ ARG C 448 57.355 101.465 -24.376 1.00117.57 C ATOM 2086 NH1 ARG C 448 56.503 101.658 -25.377 1.00117.05 N ATOM 2087 NH2 ARG C 448 57.235 102.179 -23.262 1.00117.14 N ATOM 2088 N LEU C 449 61.406 100.303 -29.743 1.00103.17 N ATOM 2089 CA LEU C 449 62.549 101.140 -30.092 1.00101.29 C ATOM 2090 C LEU C 449 62.057 102.355 -30.865 1.00 98.77 C ATOM 2091 O LEU C 449 62.849 103.175 -31.332 1.00 98.70 O ATOM 2092 CB LEU C 449 63.546 100.358 -30.953 1.00103.77 C ATOM 2093 CG LEU C 449 64.109 99.036 -30.418 1.00104.91 C ATOM 2094 CD1 LEU C 449 65.020 98.438 -31.472 1.00104.91 C ATOM 2095 CD2 LEU C 449 64.868 99.252 -29.114 1.00104.04 C ATOM 2096 N GLY C 450 60.741 102.463 -30.999 1.00 96.08 N ATOM 2097 CA GLY C 450 60.168 103.586 -31.713 1.00 94.24 C ATOM 2098 C GLY C 450 60.412 103.435 -33.193 1.00 93.61 C ATOM 2099 O GLY C 450 60.975 102.429 -33.614 1.00 90.81 O ATOM 2100 N PRO C 451 59.995 104.412 -34.013 1.00 97.10 N ATOM 2101 CA PRO C 451 60.198 104.332 -35.465 1.00 98.97 C ATOM 2102 C PRO C 451 61.667 104.519 -35.825 1.00101.10 C ATOM 2103 O PRO C 451 62.066 104.360 -36.980 1.00 99.36 O ATOM 2104 CB PRO C 451 59.312 105.458 -35.999 1.00 96.58 C ATOM 2105 CG PRO C 451 59.396 106.488 -34.909 1.00 95.90 C ATOM 2106 CD PRO C 451 59.288 105.653 -33.642 1.00 96.81 C ATOM 2107 N LYS C 452 62.463 104.847 -34.811 1.00104.16 N ATOM 2108 CA LYS C 452 63.890 105.077 -34.980 1.00106.41 C ATOM 2109 C LYS C 452 64.716 103.812 -34.757 1.00108.78 C ATOM 2110 O LYS C 452 65.859 103.880 -34.303 1.00109.65 O ATOM 2111 CB LYS C 452 64.354 106.170 -34.014 1.00106.01 C ATOM 2112 N SER C 453 64.132 102.659 -35.074 1.00109.35 N ATOM 2113 CA SER C 453 64.813 101.374 -34.924 1.00106.41 C ATOM 2114 C SER C 453 65.284 100.946 -36.306 1.00103.38 C ATOM 2115 O SER C 453 66.366 100.375 -36.472 1.00101.74 O ATOM 2116 CB SER C 453 63.851 100.329 -34.362 1.00106.41 C ATOM 2117 OG SER C 453 62.702 100.224 -35.184 1.00108.57 O ATOM 2118 N SER C 454 64.452 101.242 -37.298 1.00100.71 N ATOM 2119 CA SER C 454 64.755 100.915 -38.678 1.00100.51 C ATOM 2120 C SER C 454 66.097 101.513 -39.095 1.00100.86 C ATOM 2121 O SER C 454 66.503 101.400 -40.253 1.00102.67 O ATOM 2122 CB SER C 454 63.649 101.442 -39.590 1.00 99.70 C ATOM 2123 OG SER C 454 63.976 101.224 -40.949 1.00 99.44 O ATOM 2124 N VAL C 455 66.778 102.158 -38.149 1.00 98.53 N ATOM 2125 CA VAL C 455 68.074 102.769 -38.411 1.00 94.91 C ATOM 2126 C VAL C 455 68.940 102.732 -37.159 1.00 92.63 C ATOM 2127 O VAL C 455 70.158 102.848 -37.233 1.00 91.55 O ATOM 2128 CB VAL C 455 67.932 104.239 -38.888 1.00 93.20 C ATOM 2129 CG1 VAL C 455 69.297 104.803 -39.238 1.00 92.96 C ATOM 2130 CG2 VAL C 455 67.020 104.315 -40.108 1.00 90.78 C ATOM 2131 N LEU C 456 68.316 102.572 -36.001 1.00 93.39 N ATOM 2132 CA LEU C 456 69.085 102.507 -34.769 1.00 97.41 C ATOM 2133 C LEU C 456 69.892 101.216 -34.841 1.00 98.78 C ATOM 2134 O LEU C 456 71.011 101.130 -34.329 1.00 97.34 O ATOM 2135 CB LEU C 456 68.157 102.478 -33.550 1.00 99.87 C ATOM 2136 CG LEU C 456 68.636 103.153 -32.255 1.00100.82 C ATOM 2137 CD1 LEU C 456 67.580 102.962 -31.182 1.00102.11 C ATOM 2138 CD2 LEU C 456 69.969 102.576 -31.794 1.00102.17 C ATOM 2139 N ILE C 457 69.311 100.210 -35.488 1.00101.30 N ATOM 2140 CA ILE C 457 69.977 98.925 -35.641 1.00104.19 C ATOM 2141 C ILE C 457 70.830 98.978 -36.898 1.00105.59 C ATOM 2142 O ILE C 457 72.004 98.606 -36.880 1.00105.00 O ATOM 2143 CB ILE C 457 68.976 97.770 -35.804 1.00105.17 C ATOM 2144 CG1 ILE C 457 67.837 97.901 -34.794 1.00107.02 C ATOM 2145 CG2 ILE C 457 69.694 96.445 -35.588 1.00104.59 C ATOM 2146 CD1 ILE C 457 66.786 96.801 -34.916 1.00107.36 C ATOM 2147 N ALA C 458 70.228 99.441 -37.990 1.00107.60 N ATOM 2148 CA ALA C 458 70.930 99.553 -39.266 1.00109.87 C ATOM 2149 C ALA C 458 71.992 100.652 -39.201 1.00112.09 C ATOM 2150 O ALA C 458 72.118 101.474 -40.111 1.00112.41 O ATOM 2151 CB ALA C 458 69.937 99.843 -40.387 1.00106.84 C ATOM 2152 N GLN C 459 72.746 100.659 -38.107 1.00113.39 N ATOM 2153 CA GLN C 459 73.808 101.631 -37.891 1.00114.71 C ATOM 2154 C GLN C 459 74.670 101.148 -36.736 1.00114.43 C ATOM 2155 O GLN C 459 75.896 101.136 -36.823 1.00115.26 O ATOM 2156 CB GLN C 459 73.235 103.007 -37.542 1.00116.17 C ATOM 2157 CG GLN C 459 74.315 104.058 -37.316 1.00120.19 C ATOM 2158 CD GLN C 459 73.827 105.267 -36.534 1.00123.02 C ATOM 2159 OE1 GLN C 459 73.412 105.152 -35.379 1.00122.96 O ATOM 2160 NE2 GLN C 459 73.883 106.436 -37.161 1.00125.66 N ATOM 2161 N GLN C 460 74.016 100.752 -35.651 1.00114.03 N ATOM 2162 CA GLN C 460 74.719 100.267 -34.476 1.00114.55 C ATOM 2163 C GLN C 460 75.447 98.981 -34.850 1.00115.80 C ATOM 2164 O GLN C 460 76.332 98.520 -34.127 1.00115.36 O ATOM 2165 CB GLN C 460 73.719 100.018 -33.343 1.00114.81 C ATOM 2166 CG GLN C 460 74.343 99.881 -31.958 1.00117.05 C ATOM 2167 CD GLN C 460 74.824 98.474 -31.648 1.00117.82 C ATOM 2168 OE1 GLN C 460 75.394 98.221 -30.585 1.00116.69 O ATOM 2169 NE2 GLN C 460 74.586 97.549 -32.569 1.00119.95 N ATOM 2170 N THR C 461 75.076 98.417 -35.997 1.00117.36 N ATOM 2171 CA THR C 461 75.679 97.179 -36.488 1.00117.81 C ATOM 2172 C THR C 461 76.887 97.450 -37.382 1.00116.94 C ATOM 2173 O THR C 461 76.850 98.324 -38.252 1.00117.71 O ATOM 2174 CB THR C 461 74.670 96.351 -37.302 1.00118.55 C ATOM 2175 OG1 THR C 461 73.460 96.195 -36.555 1.00121.10 O ATOM 2176 CG2 THR C 461 75.241 94.981 -37.602 1.00119.94 C ATOM 2177 N ASP C 462 77.952 96.684 -37.168 1.00114.23 N ATOM 2178 CA ASP C 462 79.180 96.828 -37.944 1.00111.32 C ATOM 2179 C ASP C 462 78.962 96.391 -39.395 1.00107.58 C ATOM 2180 O ASP C 462 79.282 95.264 -39.769 1.00106.57 O ATOM 2181 CB ASP C 462 80.287 95.987 -37.303 1.00113.10 C ATOM 2182 CG ASP C 462 81.627 96.178 -37.974 1.00115.03 C ATOM 2183 OD1 ASP C 462 81.679 96.094 -39.216 1.00114.71 O ATOM 2184 OD2 ASP C 462 82.630 96.402 -37.262 1.00116.99 O ATOM 2185 N THR C 463 78.424 97.293 -40.208 1.00104.64 N ATOM 2186 CA THR C 463 78.141 97.007 -41.613 1.00104.33 C ATOM 2187 C THR C 463 79.383 96.713 -42.456 1.00105.63 C ATOM 2188 O THR C 463 79.288 96.499 -43.667 1.00103.94 O ATOM 2189 CB THR C 463 77.373 98.181 -42.253 1.00104.30 C ATOM 2190 OG1 THR C 463 77.286 97.992 -43.673 1.00103.52 O ATOM 2191 CG2 THR C 463 78.075 99.490 -41.947 1.00105.04 C ATOM 2192 N SER C 464 80.544 96.692 -41.810 1.00108.43 N ATOM 2193 CA SER C 464 81.802 96.438 -42.508 1.00108.67 C ATOM 2194 C SER C 464 81.850 95.067 -43.180 1.00108.49 C ATOM 2195 O SER C 464 81.611 94.953 -44.386 1.00108.45 O ATOM 2196 CB SER C 464 82.990 96.560 -41.542 1.00108.15 C ATOM 2197 OG SER C 464 82.976 97.789 -40.833 1.00106.75 O ATOM 2198 N ASP C 465 82.154 94.037 -42.385 1.00107.57 N ATOM 2199 CA ASP C 465 82.282 92.662 -42.875 1.00105.89 C ATOM 2200 C ASP C 465 80.990 91.842 -42.906 1.00100.67 C ATOM 2201 O ASP C 465 80.153 91.927 -42.005 1.00 98.76 O ATOM 2202 CB ASP C 465 83.342 91.909 -42.058 1.00109.85 C ATOM 2203 CG ASP C 465 82.824 91.444 -40.708 1.00112.29 C ATOM 2204 OD1 ASP C 465 82.262 92.277 -39.964 1.00112.47 O ATOM 2205 OD2 ASP C 465 82.987 90.243 -40.394 1.00112.80 O ATOM 2206 N PRO C 466 80.833 91.014 -43.952 1.00 95.72 N ATOM 2207 CA PRO C 466 79.667 90.160 -44.153 1.00 91.24 C ATOM 2208 C PRO C 466 79.228 89.381 -42.929 1.00 87.82 C ATOM 2209 O PRO C 466 78.059 89.410 -42.567 1.00 89.01 O ATOM 2210 CB PRO C 466 80.109 89.248 -45.291 1.00 92.29 C ATOM 2211 CG PRO C 466 80.976 90.149 -46.107 1.00 92.07 C ATOM 2212 CD PRO C 466 81.808 90.820 -45.042 1.00 94.55 C ATOM 2213 N GLU C 467 80.162 88.694 -42.285 1.00 85.82 N ATOM 2214 CA GLU C 467 79.819 87.884 -41.122 1.00 88.05 C ATOM 2215 C GLU C 467 78.905 88.596 -40.127 1.00 88.94 C ATOM 2216 O GLU C 467 77.914 88.021 -39.672 1.00 89.94 O ATOM 2217 CB GLU C 467 81.088 87.402 -40.414 1.00 90.49 C ATOM 2218 CG GLU C 467 80.842 86.400 -39.273 1.00 93.44 C ATOM 2219 CD GLU C 467 80.284 85.049 -39.738 1.00 94.61 C ATOM 2220 OE1 GLU C 467 80.101 84.157 -38.879 1.00 94.92 O ATOM 2221 OE2 GLU C 467 80.026 84.870 -40.950 1.00 92.60 O ATOM 2222 N LYS C 468 79.225 89.840 -39.787 1.00 88.98 N ATOM 2223 CA LYS C 468 78.400 90.585 -38.841 1.00 87.66 C ATOM 2224 C LYS C 468 77.058 90.968 -39.458 1.00 83.64 C ATOM 2225 O LYS C 468 76.029 90.939 -38.786 1.00 81.03 O ATOM 2226 CB LYS C 468 79.145 91.829 -38.343 1.00 90.70 C ATOM 2227 CG LYS C 468 80.266 91.510 -37.345 1.00 92.25 C ATOM 2228 CD LYS C 468 81.091 92.745 -36.995 1.00 93.51 C ATOM 2229 CE LYS C 468 82.268 92.402 -36.089 1.00 93.18 C ATOM 2230 NZ LYS C 468 83.231 93.538 -35.973 1.00 92.63 N ATOM 2231 N VAL C 469 77.067 91.324 -40.737 1.00 81.23 N ATOM 2232 CA VAL C 469 75.829 91.668 -41.421 1.00 80.44 C ATOM 2233 C VAL C 469 74.903 90.463 -41.283 1.00 84.94 C ATOM 2234 O VAL C 469 73.750 90.596 -40.874 1.00 89.63 O ATOM 2235 CB VAL C 469 76.055 91.925 -42.922 1.00 76.55 C ATOM 2236 CG1 VAL C 469 74.751 92.336 -43.577 1.00 71.39 C ATOM 2237 CG2 VAL C 469 77.107 92.990 -43.116 1.00 76.56 C ATOM 2238 N VAL C 470 75.424 89.287 -41.626 1.00 84.80 N ATOM 2239 CA VAL C 470 74.670 88.041 -41.540 1.00 83.31 C ATOM 2240 C VAL C 470 74.073 87.859 -40.151 1.00 82.77 C ATOM 2241 O VAL C 470 72.894 87.535 -40.019 1.00 83.32 O ATOM 2242 CB VAL C 470 75.566 86.826 -41.848 1.00 84.15 C ATOM 2243 CG1 VAL C 470 74.804 85.533 -41.599 1.00 84.39 C ATOM 2244 CG2 VAL C 470 76.035 86.886 -43.287 1.00 86.53 C ATOM 2245 N SER C 471 74.888 88.065 -39.120 1.00 81.19 N ATOM 2246 CA SER C 471 74.424 87.924 -37.745 1.00 81.05 C ATOM 2247 C SER C 471 73.229 88.834 -37.463 1.00 80.80 C ATOM 2248 O SER C 471 72.205 88.391 -36.933 1.00 81.31 O ATOM 2249 CB SER C 471 75.550 88.251 -36.769 1.00 82.39 C ATOM 2250 OG SER C 471 75.095 88.129 -35.430 1.00 85.59 O ATOM 2251 N ALA C 472 73.366 90.110 -37.809 1.00 78.67 N ATOM 2252 CA ALA C 472 72.288 91.068 -37.604 1.00 75.68 C ATOM 2253 C ALA C 472 71.054 90.587 -38.361 1.00 73.77 C ATOM 2254 O ALA C 472 70.044 90.215 -37.757 1.00 72.97 O ATOM 2255 CB ALA C 472 72.706 92.452 -38.108 1.00 72.13 C ATOM 2256 N PHE C 473 71.155 90.583 -39.686 1.00 70.34 N ATOM 2257 CA PHE C 473 70.058 90.163 -40.543 1.00 68.99 C ATOM 2258 C PHE C 473 69.239 88.995 -40.015 1.00 69.68 C ATOM 2259 O PHE C 473 68.009 89.045 -40.009 1.00 67.87 O ATOM 2260 CB PHE C 473 70.565 89.803 -41.937 1.00 67.47 C ATOM 2261 CG PHE C 473 69.548 89.081 -42.755 1.00 66.35 C ATOM 2262 CD1 PHE C 473 69.381 87.708 -42.622 1.00 66.26 C ATOM 2263 CD2 PHE C 473 68.685 89.781 -43.582 1.00 66.44 C ATOM 2264 CE1 PHE C 473 68.367 87.047 -43.292 1.00 67.33 C ATOM 2265 CE2 PHE C 473 67.668 89.130 -44.255 1.00 68.32 C ATOM 2266 CZ PHE C 473 67.506 87.760 -44.110 1.00 68.37 C ATOM 2267 N LEU C 474 69.916 87.928 -39.607 1.00 72.43 N ATOM 2268 CA LEU C 474 69.217 86.762 -39.088 1.00 74.00 C ATOM 2269 C LEU C 474 68.536 87.119 -37.779 1.00 75.66 C ATOM 2270 O LEU C 474 67.353 86.826 -37.597 1.00 78.03 O ATOM 2271 CB LEU C 474 70.185 85.598 -38.877 1.00 71.52 C ATOM 2272 CG LEU C 474 70.808 85.046 -40.161 1.00 71.68 C ATOM 2273 CD1 LEU C 474 71.796 83.955 -39.803 1.00 74.30 C ATOM 2274 CD2 LEU C 474 69.726 84.509 -41.088 1.00 68.91 C ATOM 2275 N LYS C 475 69.282 87.761 -36.879 1.00 72.98 N ATOM 2276 CA LYS C 475 68.741 88.168 -35.588 1.00 70.15 C ATOM 2277 C LYS C 475 67.423 88.916 -35.738 1.00 70.01 C ATOM 2278 O LYS C 475 66.430 88.571 -35.099 1.00 71.03 O ATOM 2279 CB LYS C 475 69.748 89.035 -34.840 1.00 68.43 C ATOM 2280 CG LYS C 475 70.896 88.234 -34.285 1.00 71.75 C ATOM 2281 CD LYS C 475 71.679 89.005 -33.246 1.00 73.32 C ATOM 2282 CE LYS C 475 72.567 88.057 -32.458 1.00 73.59 C ATOM 2283 NZ LYS C 475 71.756 86.966 -31.843 1.00 72.78 N ATOM 2284 N VAL C 476 67.415 89.939 -36.584 1.00 68.26 N ATOM 2285 CA VAL C 476 66.208 90.717 -36.825 1.00 67.41 C ATOM 2286 C VAL C 476 65.097 89.828 -37.365 1.00 68.57 C ATOM 2287 O VAL C 476 63.961 89.881 -36.902 1.00 67.54 O ATOM 2288 CB VAL C 476 66.480 91.835 -37.838 1.00 67.78 C ATOM 2289 CG1 VAL C 476 65.186 92.255 -38.534 1.00 66.41 C ATOM 2290 CG2 VAL C 476 67.113 93.015 -37.122 1.00 68.22 C ATOM 2291 N SER C 477 65.440 89.011 -38.350 1.00 72.30 N ATOM 2292 CA SER C 477 64.489 88.105 -38.978 1.00 75.85 C ATOM 2293 C SER C 477 63.874 87.110 -37.993 1.00 75.99 C ATOM 2294 O SER C 477 62.694 86.770 -38.096 1.00 75.63 O ATOM 2295 CB SER C 477 65.184 87.340 -40.105 1.00 77.97 C ATOM 2296 OG SER C 477 65.841 88.233 -40.987 1.00 81.15 O ATOM 2297 N SER C 478 64.681 86.651 -37.040 1.00 74.79 N ATOM 2298 CA SER C 478 64.239 85.676 -36.049 1.00 73.58 C ATOM 2299 C SER C 478 63.012 86.100 -35.248 1.00 74.47 C ATOM 2300 O SER C 478 62.622 85.419 -34.299 1.00 77.09 O ATOM 2301 CB SER C 478 65.381 85.345 -35.080 1.00 72.03 C ATOM 2302 OG SER C 478 65.668 86.439 -34.230 1.00 67.84 O ATOM 2303 N VAL C 479 62.403 87.220 -35.615 1.00 72.98 N ATOM 2304 CA VAL C 479 61.218 87.672 -34.906 1.00 72.47 C ATOM 2305 C VAL C 479 60.167 88.202 -35.863 1.00 73.72 C ATOM 2306 O VAL C 479 59.343 89.029 -35.485 1.00 74.74 O ATOM 2307 CB VAL C 479 61.549 88.769 -33.883 1.00 74.22 C ATOM 2308 CG1 VAL C 479 62.545 88.240 -32.853 1.00 75.24 C ATOM 2309 CG2 VAL C 479 62.089 89.996 -34.597 1.00 75.85 C ATOM 2310 N PHE C 480 60.205 87.726 -37.103 1.00 76.05 N ATOM 2311 CA PHE C 480 59.235 88.130 -38.116 1.00 78.44 C ATOM 2312 C PHE C 480 57.915 87.395 -37.897 1.00 82.82 C ATOM 2313 O PHE C 480 57.864 86.164 -37.963 1.00 82.67 O ATOM 2314 CB PHE C 480 59.751 87.796 -39.519 1.00 78.41 C ATOM 2315 CG PHE C 480 58.708 87.939 -40.609 1.00 76.88 C ATOM 2316 CD1 PHE C 480 58.763 89.001 -41.510 1.00 77.86 C ATOM 2317 CD2 PHE C 480 57.667 87.016 -40.728 1.00 73.51 C ATOM 2318 CE1 PHE C 480 57.801 89.144 -42.507 1.00 76.43 C ATOM 2319 CE2 PHE C 480 56.703 87.150 -41.716 1.00 73.83 C ATOM 2320 CZ PHE C 480 56.769 88.215 -42.608 1.00 76.74 C ATOM 2321 N LYS C 481 56.851 88.150 -37.643 1.00 87.32 N ATOM 2322 CA LYS C 481 55.527 87.572 -37.445 1.00 90.21 C ATOM 2323 C LYS C 481 54.669 88.166 -38.546 1.00 93.65 C ATOM 2324 O LYS C 481 54.713 89.370 -38.782 1.00 92.82 O ATOM 2325 CB LYS C 481 54.966 87.945 -36.067 1.00 88.84 C ATOM 2326 CG LYS C 481 55.970 87.779 -34.931 1.00 90.44 C ATOM 2327 CD LYS C 481 56.694 86.434 -35.007 1.00 92.63 C ATOM 2328 CE LYS C 481 58.014 86.470 -34.236 1.00 93.60 C ATOM 2329 NZ LYS C 481 58.842 85.235 -34.389 1.00 92.59 N ATOM 2330 N ASP C 482 53.902 87.323 -39.229 1.00 99.78 N ATOM 2331 CA ASP C 482 53.062 87.785 -40.326 1.00104.48 C ATOM 2332 C ASP C 482 52.167 88.956 -39.923 1.00105.37 C ATOM 2333 O ASP C 482 51.434 89.508 -40.751 1.00104.58 O ATOM 2334 CB ASP C 482 52.205 86.636 -40.859 1.00107.11 C ATOM 2335 CG ASP C 482 51.606 86.948 -42.214 1.00111.93 C ATOM 2336 OD1 ASP C 482 52.387 87.172 -43.167 1.00113.73 O ATOM 2337 OD2 ASP C 482 50.361 86.976 -42.326 1.00114.23 O ATOM 2338 N GLU C 483 52.242 89.328 -38.647 1.00105.55 N ATOM 2339 CA GLU C 483 51.465 90.433 -38.096 1.00105.18 C ATOM 2340 C GLU C 483 51.564 91.660 -39.018 1.00105.40 C ATOM 2341 O GLU C 483 52.334 91.666 -39.977 1.00106.75 O ATOM 2342 CB GLU C 483 51.983 90.755 -36.687 1.00103.49 C ATOM 2343 CG GLU C 483 51.018 91.512 -35.788 1.00103.16 C ATOM 2344 CD GLU C 483 50.872 92.966 -36.180 1.00104.86 C ATOM 2345 OE1 GLU C 483 51.913 93.644 -36.310 1.00104.86 O ATOM 2346 OE2 GLU C 483 49.724 93.432 -36.356 1.00104.54 O ATOM 2347 N ALA C 484 50.780 92.692 -38.727 1.00103.94 N ATOM 2348 CA ALA C 484 50.757 93.903 -39.540 1.00100.64 C ATOM 2349 C ALA C 484 51.933 94.853 -39.331 1.00 97.58 C ATOM 2350 O ALA C 484 52.666 95.152 -40.267 1.00 94.28 O ATOM 2351 CB ALA C 484 49.445 94.647 -39.305 1.00101.88 C ATOM 2352 N THR C 485 52.106 95.334 -38.106 1.00 99.01 N ATOM 2353 CA THR C 485 53.183 96.271 -37.805 1.00100.06 C ATOM 2354 C THR C 485 54.512 95.614 -37.452 1.00101.10 C ATOM 2355 O THR C 485 55.566 96.222 -37.618 1.00102.97 O ATOM 2356 CB THR C 485 52.800 97.213 -36.641 1.00 98.71 C ATOM 2357 OG1 THR C 485 52.634 96.447 -35.440 1.00 97.14 O ATOM 2358 CG2 THR C 485 51.502 97.958 -36.958 1.00 97.79 C ATOM 2359 N VAL C 486 54.472 94.379 -36.965 1.00 99.79 N ATOM 2360 CA VAL C 486 55.706 93.704 -36.593 1.00 97.75 C ATOM 2361 C VAL C 486 56.533 93.291 -37.793 1.00 97.44 C ATOM 2362 O VAL C 486 57.753 93.414 -37.767 1.00 98.91 O ATOM 2363 CB VAL C 486 55.438 92.467 -35.722 1.00 97.55 C ATOM 2364 CG1 VAL C 486 56.749 91.749 -35.410 1.00 93.73 C ATOM 2365 CG2 VAL C 486 54.758 92.895 -34.431 1.00 98.94 C ATOM 2366 N ARG C 487 55.891 92.801 -38.846 1.00 98.42 N ATOM 2367 CA ARG C 487 56.653 92.397 -40.022 1.00102.33 C ATOM 2368 C ARG C 487 57.143 93.650 -40.735 1.00102.44 C ATOM 2369 O ARG C 487 58.165 93.630 -41.420 1.00102.04 O ATOM 2370 CB ARG C 487 55.802 91.558 -40.980 1.00105.86 C ATOM 2371 CG ARG C 487 54.942 92.372 -41.922 1.00111.56 C ATOM 2372 CD ARG C 487 54.186 91.492 -42.898 1.00115.49 C ATOM 2373 NE ARG C 487 53.247 92.283 -43.685 1.00120.24 N ATOM 2374 CZ ARG C 487 52.364 91.772 -44.535 1.00123.62 C ATOM 2375 NH1 ARG C 487 52.298 90.458 -44.713 1.00125.84 N ATOM 2376 NH2 ARG C 487 51.542 92.576 -45.198 1.00123.90 N ATOM 2377 N MET C 488 56.407 94.742 -40.565 1.00103.33 N ATOM 2378 CA MET C 488 56.779 95.998 -41.193 1.00104.59 C ATOM 2379 C MET C 488 58.018 96.535 -40.494 1.00103.51 C ATOM 2380 O MET C 488 58.855 97.179 -41.117 1.00107.56 O ATOM 2381 CB MET C 488 55.638 97.007 -41.089 1.00109.40 C ATOM 2382 CG MET C 488 55.754 98.171 -42.061 1.00115.93 C ATOM 2383 SD MET C 488 54.299 99.248 -42.031 1.00123.56 S ATOM 2384 CE MET C 488 53.131 98.297 -43.047 1.00120.47 C ATOM 2385 N ALA C 489 58.133 96.264 -39.197 1.00100.01 N ATOM 2386 CA ALA C 489 59.290 96.708 -38.424 1.00 96.14 C ATOM 2387 C ALA C 489 60.488 95.879 -38.860 1.00 94.33 C ATOM 2388 O ALA C 489 61.552 96.415 -39.176 1.00 96.00 O ATOM 2389 CB ALA C 489 59.040 96.514 -36.940 1.00 95.58 C ATOM 2390 N VAL C 490 60.300 94.564 -38.874 1.00 90.35 N ATOM 2391 CA VAL C 490 61.345 93.638 -39.283 1.00 85.43 C ATOM 2392 C VAL C 490 61.794 93.959 -40.704 1.00 81.75 C ATOM 2393 O VAL C 490 62.987 94.121 -40.957 1.00 78.03 O ATOM 2394 CB VAL C 490 60.846 92.174 -39.222 1.00 84.70 C ATOM 2395 CG1 VAL C 490 61.864 91.246 -39.857 1.00 86.44 C ATOM 2396 CG2 VAL C 490 60.606 91.770 -37.776 1.00 82.45 C ATOM 2397 N GLN C 491 60.833 94.060 -41.622 1.00 80.82 N ATOM 2398 CA GLN C 491 61.131 94.359 -43.020 1.00 81.47 C ATOM 2399 C GLN C 491 62.022 95.572 -43.187 1.00 82.98 C ATOM 2400 O GLN C 491 63.083 95.486 -43.799 1.00 86.46 O ATOM 2401 CB GLN C 491 59.851 94.588 -43.820 1.00 81.16 C ATOM 2402 CG GLN C 491 59.101 93.325 -44.166 1.00 85.67 C ATOM 2403 CD GLN C 491 57.921 93.584 -45.085 1.00 88.95 C ATOM 2404 OE1 GLN C 491 58.085 94.083 -46.202 1.00 85.51 O ATOM 2405 NE2 GLN C 491 56.722 93.244 -44.617 1.00 91.42 N ATOM 2406 N ASP C 492 61.590 96.705 -42.652 1.00 82.80 N ATOM 2407 CA ASP C 492 62.371 97.923 -42.776 1.00 85.20 C ATOM 2408 C ASP C 492 63.738 97.799 -42.129 1.00 84.66 C ATOM 2409 O ASP C 492 64.718 98.344 -42.638 1.00 84.22 O ATOM 2410 CB ASP C 492 61.606 99.097 -42.185 1.00 91.02 C ATOM 2411 CG ASP C 492 60.337 99.395 -42.954 1.00 97.94 C ATOM 2412 OD1 ASP C 492 60.405 99.462 -44.202 1.00101.04 O ATOM 2413 OD2 ASP C 492 59.274 99.564 -42.316 1.00102.87 O ATOM 2414 N ALA C 493 63.809 97.086 -41.010 1.00 83.72 N ATOM 2415 CA ALA C 493 65.089 96.889 -40.340 1.00 82.68 C ATOM 2416 C ALA C 493 66.041 96.289 -41.378 1.00 81.66 C ATOM 2417 O ALA C 493 67.099 96.849 -41.675 1.00 78.31 O ATOM 2418 CB ALA C 493 64.922 95.938 -39.155 1.00 79.13 C ATOM 2419 N VAL C 494 65.637 95.150 -41.932 1.00 82.05 N ATOM 2420 CA VAL C 494 66.409 94.451 -42.949 1.00 79.90 C ATOM 2421 C VAL C 494 66.634 95.361 -44.146 1.00 80.69 C ATOM 2422 O VAL C 494 67.749 95.473 -44.643 1.00 81.75 O ATOM 2423 CB VAL C 494 65.673 93.174 -43.409 1.00 79.06 C ATOM 2424 CG1 VAL C 494 66.220 92.695 -44.748 1.00 80.76 C ATOM 2425 CG2 VAL C 494 65.824 92.086 -42.350 1.00 76.82 C ATOM 2426 N ASP C 495 65.569 96.008 -44.605 1.00 81.26 N ATOM 2427 CA ASP C 495 65.661 96.918 -45.737 1.00 83.57 C ATOM 2428 C ASP C 495 66.802 97.912 -45.544 1.00 84.46 C ATOM 2429 O ASP C 495 67.551 98.196 -46.475 1.00 84.64 O ATOM 2430 CB ASP C 495 64.344 97.677 -45.913 1.00 87.29 C ATOM 2431 CG ASP C 495 63.261 96.832 -46.561 1.00 92.35 C ATOM 2432 OD1 ASP C 495 63.448 96.417 -47.725 1.00 93.92 O ATOM 2433 OD2 ASP C 495 62.223 96.586 -45.909 1.00 94.84 O ATOM 2434 N ALA C 496 66.931 98.435 -44.330 1.00 85.43 N ATOM 2435 CA ALA C 496 67.983 99.401 -44.022 1.00 85.34 C ATOM 2436 C ALA C 496 69.347 98.719 -43.942 1.00 85.57 C ATOM 2437 O ALA C 496 70.217 98.952 -44.787 1.00 82.98 O ATOM 2438 CB ALA C 496 67.673 100.101 -42.705 1.00 85.03 C ATOM 2439 N LEU C 497 69.516 97.882 -42.918 1.00 85.20 N ATOM 2440 CA LEU C 497 70.753 97.142 -42.690 1.00 80.99 C ATOM 2441 C LEU C 497 71.411 96.752 -44.005 1.00 81.59 C ATOM 2442 O LEU C 497 72.611 96.935 -44.176 1.00 81.80 O ATOM 2443 CB LEU C 497 70.471 95.877 -41.875 1.00 76.71 C ATOM 2444 CG LEU C 497 71.690 95.092 -41.380 1.00 75.61 C ATOM 2445 CD1 LEU C 497 72.384 95.856 -40.256 1.00 71.84 C ATOM 2446 CD2 LEU C 497 71.250 93.728 -40.880 1.00 75.77 C ATOM 2447 N MET C 498 70.619 96.225 -44.935 1.00 83.87 N ATOM 2448 CA MET C 498 71.134 95.805 -46.237 1.00 86.97 C ATOM 2449 C MET C 498 71.361 96.968 -47.190 1.00 88.54 C ATOM 2450 O MET C 498 72.370 97.012 -47.890 1.00 88.51 O ATOM 2451 CB MET C 498 70.184 94.804 -46.887 1.00 89.37 C ATOM 2452 CG MET C 498 69.932 93.558 -46.057 1.00 95.88 C ATOM 2453 SD MET C 498 71.415 92.596 -45.681 1.00 98.46 S ATOM 2454 CE MET C 498 71.603 91.690 -47.184 1.00 97.69 C ATOM 2455 N GLN C 499 70.420 97.903 -47.230 1.00 91.83 N ATOM 2456 CA GLN C 499 70.558 99.065 -48.102 1.00 96.14 C ATOM 2457 C GLN C 499 71.943 99.653 -47.868 1.00 96.52 C ATOM 2458 O GLN C 499 72.603 100.119 -48.796 1.00 94.95 O ATOM 2459 CB GLN C 499 69.491 100.113 -47.763 1.00100.05 C ATOM 2460 CG GLN C 499 69.591 101.415 -48.559 1.00101.78 C ATOM 2461 CD GLN C 499 69.119 101.273 -49.991 1.00103.07 C ATOM 2462 OE1 GLN C 499 67.944 101.007 -50.245 1.00102.03 O ATOM 2463 NE2 GLN C 499 70.033 101.453 -50.938 1.00104.79 N ATOM 2464 N LYS C 500 72.371 99.610 -46.611 1.00 98.12 N ATOM 2465 CA LYS C 500 73.666 100.131 -46.197 1.00 99.96 C ATOM 2466 C LYS C 500 74.829 99.340 -46.789 1.00102.21 C ATOM 2467 O LYS C 500 75.538 99.827 -47.671 1.00103.80 O ATOM 2468 CB LYS C 500 73.761 100.112 -44.671 1.00 98.92 C ATOM 2469 CG LYS C 500 74.936 100.878 -44.106 1.00 99.40 C ATOM 2470 CD LYS C 500 74.864 100.929 -42.592 1.00102.12 C ATOM 2471 CE LYS C 500 75.821 101.961 -42.026 1.00105.13 C ATOM 2472 NZ LYS C 500 75.777 102.009 -40.538 1.00107.80 N ATOM 2473 N ALA C 501 75.016 98.119 -46.298 1.00102.53 N ATOM 2474 CA ALA C 501 76.095 97.251 -46.756 1.00104.06 C ATOM 2475 C ALA C 501 76.179 97.044 -48.276 1.00106.41 C ATOM 2476 O ALA C 501 77.260 97.151 -48.856 1.00107.33 O ATOM 2477 CB ALA C 501 75.998 95.908 -46.053 1.00102.36 C ATOM 2478 N PHE C 502 75.058 96.743 -48.927 1.00107.94 N ATOM 2479 CA PHE C 502 75.078 96.529 -50.373 1.00110.52 C ATOM 2480 C PHE C 502 75.518 97.766 -51.146 1.00112.81 C ATOM 2481 O PHE C 502 75.751 97.701 -52.351 1.00112.19 O ATOM 2482 CB PHE C 502 73.708 96.071 -50.887 1.00112.09 C ATOM 2483 CG PHE C 502 73.484 94.583 -50.788 1.00113.88 C ATOM 2484 CD1 PHE C 502 74.439 93.687 -51.258 1.00114.41 C ATOM 2485 CD2 PHE C 502 72.310 94.076 -50.241 1.00115.09 C ATOM 2486 CE1 PHE C 502 74.227 92.313 -51.183 1.00113.44 C ATOM 2487 CE2 PHE C 502 72.092 92.703 -50.165 1.00114.24 C ATOM 2488 CZ PHE C 502 73.052 91.822 -50.635 1.00113.54 C ATOM 2489 N ASN C 503 75.621 98.895 -50.454 1.00116.92 N ATOM 2490 CA ASN C 503 76.054 100.132 -51.090 1.00120.21 C ATOM 2491 C ASN C 503 77.309 100.662 -50.406 1.00120.70 C ATOM 2492 O ASN C 503 77.248 101.548 -49.548 1.00120.22 O ATOM 2493 CB ASN C 503 74.941 101.186 -51.054 1.00123.01 C ATOM 2494 CG ASN C 503 73.787 100.852 -51.990 1.00125.00 C ATOM 2495 OD1 ASN C 503 73.021 99.919 -51.744 1.00126.71 O ATOM 2496 ND2 ASN C 503 73.664 101.612 -53.076 1.00124.61 N ATOM 2497 N SER C 504 78.440 100.082 -50.800 1.00121.23 N ATOM 2498 CA SER C 504 79.767 100.425 -50.292 1.00120.86 C ATOM 2499 C SER C 504 80.712 99.324 -50.761 1.00120.17 C ATOM 2500 O SER C 504 80.978 98.377 -50.021 1.00121.03 O ATOM 2501 CB SER C 504 79.775 100.499 -48.758 1.00120.51 C ATOM 2502 OG SER C 504 79.525 99.233 -48.170 1.00117.72 O ATOM 2503 N SER C 505 81.199 99.456 -51.996 1.00118.46 N ATOM 2504 CA SER C 505 82.106 98.483 -52.617 1.00115.92 C ATOM 2505 C SER C 505 83.018 97.728 -51.646 1.00113.79 C ATOM 2506 O SER C 505 83.470 96.619 -51.940 1.00113.03 O ATOM 2507 CB SER C 505 82.952 99.174 -53.691 1.00115.01 C ATOM 2508 OG SER C 505 82.136 99.651 -54.748 1.00113.33 O ATOM 2509 N SER C 506 83.289 98.340 -50.496 1.00109.99 N ATOM 2510 CA SER C 506 84.115 97.741 -49.454 1.00105.78 C ATOM 2511 C SER C 506 83.331 96.609 -48.780 1.00105.27 C ATOM 2512 O SER C 506 83.330 96.476 -47.550 1.00102.95 O ATOM 2513 CB SER C 506 84.460 98.814 -48.429 1.00103.87 C ATOM 2514 OG SER C 506 83.296 99.550 -48.094 1.00101.17 O ATOM 2515 N PHE C 507 82.676 95.789 -49.602 1.00105.22 N ATOM 2516 CA PHE C 507 81.849 94.682 -49.121 1.00102.13 C ATOM 2517 C PHE C 507 81.629 93.639 -50.227 1.00101.19 C ATOM 2518 O PHE C 507 81.148 93.979 -51.311 1.00102.24 O ATOM 2519 CB PHE C 507 80.497 95.239 -48.680 1.00 97.99 C ATOM 2520 CG PHE C 507 79.655 94.269 -47.918 1.00 93.31 C ATOM 2521 CD1 PHE C 507 80.036 93.849 -46.651 1.00 90.09 C ATOM 2522 CD2 PHE C 507 78.461 93.797 -48.454 1.00 91.00 C ATOM 2523 CE1 PHE C 507 79.242 92.977 -45.926 1.00 89.26 C ATOM 2524 CE2 PHE C 507 77.658 92.921 -47.736 1.00 88.22 C ATOM 2525 CZ PHE C 507 78.049 92.510 -46.469 1.00 88.46 C ATOM 2526 N ASN C 508 81.977 92.380 -49.954 1.00 98.21 N ATOM 2527 CA ASN C 508 81.794 91.306 -50.935 1.00 94.26 C ATOM 2528 C ASN C 508 80.430 90.656 -50.750 1.00 90.98 C ATOM 2529 O ASN C 508 80.192 89.947 -49.772 1.00 89.62 O ATOM 2530 CB ASN C 508 82.884 90.235 -50.798 1.00 96.16 C ATOM 2531 CG ASN C 508 82.804 89.171 -51.894 1.00 96.42 C ATOM 2532 OD1 ASN C 508 81.779 88.511 -52.067 1.00 97.53 O ATOM 2533 ND2 ASN C 508 83.893 89.003 -52.634 1.00 96.28 N ATOM 2534 N SER C 509 79.545 90.906 -51.706 1.00 88.43 N ATOM 2535 CA SER C 509 78.190 90.376 -51.692 1.00 85.50 C ATOM 2536 C SER C 509 78.132 88.844 -51.639 1.00 84.74 C ATOM 2537 O SER C 509 77.301 88.268 -50.930 1.00 83.42 O ATOM 2538 CB SER C 509 77.452 90.892 -52.927 1.00 84.73 C ATOM 2539 OG SER C 509 78.306 90.867 -54.060 1.00 83.58 O ATOM 2540 N ASN C 510 79.015 88.190 -52.390 1.00 82.36 N ATOM 2541 CA ASN C 510 79.063 86.733 -52.430 1.00 78.42 C ATOM 2542 C ASN C 510 79.446 86.133 -51.087 1.00 77.99 C ATOM 2543 O ASN C 510 78.876 85.126 -50.672 1.00 78.21 O ATOM 2544 CB ASN C 510 80.034 86.285 -53.516 1.00 78.13 C ATOM 2545 CG ASN C 510 79.533 86.629 -54.907 1.00 82.60 C ATOM 2546 OD1 ASN C 510 78.922 85.799 -55.589 1.00 82.90 O ATOM 2547 ND2 ASN C 510 79.765 87.869 -55.328 1.00 83.05 N ATOM 2548 N THR C 511 80.403 86.759 -50.408 1.00 78.43 N ATOM 2549 CA THR C 511 80.852 86.296 -49.095 1.00 76.66 C ATOM 2550 C THR C 511 79.676 86.298 -48.130 1.00 74.81 C ATOM 2551 O THR C 511 79.614 85.499 -47.195 1.00 73.55 O ATOM 2552 CB THR C 511 81.943 87.213 -48.516 1.00 77.88 C ATOM 2553 OG1 THR C 511 83.077 87.222 -49.393 1.00 79.62 O ATOM 2554 CG2 THR C 511 82.370 86.727 -47.132 1.00 76.74 C ATOM 2555 N PHE C 512 78.750 87.217 -48.360 1.00 75.33 N ATOM 2556 CA PHE C 512 77.561 87.329 -47.531 1.00 76.39 C ATOM 2557 C PHE C 512 76.653 86.142 -47.820 1.00 74.81 C ATOM 2558 O PHE C 512 76.468 85.259 -46.977 1.00 73.92 O ATOM 2559 CB PHE C 512 76.820 88.626 -47.854 1.00 77.79 C ATOM 2560 CG PHE C 512 75.476 88.731 -47.202 1.00 77.07 C ATOM 2561 CD1 PHE C 512 75.368 88.799 -45.814 1.00 76.84 C ATOM 2562 CD2 PHE C 512 74.317 88.735 -47.976 1.00 73.72 C ATOM 2563 CE1 PHE C 512 74.124 88.866 -45.202 1.00 77.43 C ATOM 2564 CE2 PHE C 512 73.070 88.801 -47.384 1.00 73.41 C ATOM 2565 CZ PHE C 512 72.969 88.867 -45.989 1.00 78.26 C ATOM 2566 N LEU C 513 76.093 86.140 -49.026 1.00 72.46 N ATOM 2567 CA LEU C 513 75.201 85.084 -49.479 1.00 70.45 C ATOM 2568 C LEU C 513 75.705 83.730 -48.995 1.00 67.32 C ATOM 2569 O LEU C 513 74.918 82.853 -48.652 1.00 66.10 O ATOM 2570 CB LEU C 513 75.108 85.117 -51.013 1.00 71.52 C ATOM 2571 CG LEU C 513 74.262 84.093 -51.781 1.00 73.21 C ATOM 2572 CD1 LEU C 513 75.040 82.794 -51.924 1.00 74.68 C ATOM 2573 CD2 LEU C 513 72.923 83.870 -51.079 1.00 72.29 C ATOM 2574 N THR C 514 77.022 83.575 -48.953 1.00 65.51 N ATOM 2575 CA THR C 514 77.626 82.328 -48.507 1.00 65.81 C ATOM 2576 C THR C 514 77.467 82.125 -46.996 1.00 66.15 C ATOM 2577 O THR C 514 76.752 81.225 -46.549 1.00 65.04 O ATOM 2578 CB THR C 514 79.125 82.284 -48.885 1.00 63.29 C ATOM 2579 OG1 THR C 514 79.252 82.274 -50.310 1.00 60.22 O ATOM 2580 CG2 THR C 514 79.796 81.039 -48.319 1.00 62.78 C ATOM 2581 N ARG C 515 78.130 82.964 -46.212 1.00 66.31 N ATOM 2582 CA ARG C 515 78.057 82.862 -44.766 1.00 69.49 C ATOM 2583 C ARG C 515 76.614 82.903 -44.271 1.00 73.60 C ATOM 2584 O ARG C 515 76.318 82.569 -43.117 1.00 74.84 O ATOM 2585 CB ARG C 515 78.878 83.983 -44.146 1.00 68.78 C ATOM 2586 CG ARG C 515 80.354 83.839 -44.453 1.00 69.17 C ATOM 2587 CD ARG C 515 80.890 82.528 -43.891 1.00 67.72 C ATOM 2588 NE ARG C 515 80.823 82.510 -42.432 1.00 66.36 N ATOM 2589 CZ ARG C 515 81.085 81.445 -41.684 1.00 67.02 C ATOM 2590 NH1 ARG C 515 81.431 80.296 -42.251 1.00 67.82 N ATOM 2591 NH2 ARG C 515 81.010 81.531 -40.366 1.00 66.58 N ATOM 2592 N LEU C 516 75.716 83.316 -45.156 1.00 73.69 N ATOM 2593 CA LEU C 516 74.308 83.375 -44.819 1.00 73.47 C ATOM 2594 C LEU C 516 73.793 81.947 -44.926 1.00 73.96 C ATOM 2595 O LEU C 516 73.231 81.411 -43.972 1.00 75.76 O ATOM 2596 CB LEU C 516 73.579 84.304 -45.797 1.00 74.93 C ATOM 2597 CG LEU C 516 72.085 84.617 -45.628 1.00 75.28 C ATOM 2598 CD1 LEU C 516 71.256 83.528 -46.278 1.00 77.04 C ATOM 2599 CD2 LEU C 516 71.738 84.780 -44.151 1.00 73.86 C ATOM 2600 N LEU C 517 74.014 81.330 -46.085 1.00 72.97 N ATOM 2601 CA LEU C 517 73.586 79.955 -46.328 1.00 72.89 C ATOM 2602 C LEU C 517 74.218 79.014 -45.315 1.00 75.04 C ATOM 2603 O LEU C 517 73.621 78.010 -44.923 1.00 74.45 O ATOM 2604 CB LEU C 517 73.988 79.506 -47.734 1.00 71.61 C ATOM 2605 CG LEU C 517 73.289 80.154 -48.928 1.00 73.04 C ATOM 2606 CD1 LEU C 517 73.887 79.619 -50.221 1.00 72.19 C ATOM 2607 CD2 LEU C 517 71.800 79.862 -48.866 1.00 73.65 C ATOM 2608 N VAL C 518 75.437 79.339 -44.901 1.00 77.16 N ATOM 2609 CA VAL C 518 76.150 78.523 -43.933 1.00 79.19 C ATOM 2610 C VAL C 518 75.510 78.614 -42.561 1.00 80.94 C ATOM 2611 O VAL C 518 75.491 77.631 -41.822 1.00 82.64 O ATOM 2612 CB VAL C 518 77.618 78.944 -43.840 1.00 81.13 C ATOM 2613 CG1 VAL C 518 78.238 78.404 -42.567 1.00 81.98 C ATOM 2614 CG2 VAL C 518 78.366 78.417 -45.050 1.00 83.37 C ATOM 2615 N HIS C 519 74.991 79.791 -42.219 1.00 82.25 N ATOM 2616 CA HIS C 519 74.325 79.979 -40.934 1.00 84.54 C ATOM 2617 C HIS C 519 72.902 79.422 -40.959 1.00 83.81 C ATOM 2618 O HIS C 519 72.345 79.059 -39.921 1.00 84.26 O ATOM 2619 CB HIS C 519 74.311 81.454 -40.550 1.00 87.28 C ATOM 2620 CG HIS C 519 75.475 81.857 -39.705 1.00 90.21 C ATOM 2621 ND1 HIS C 519 75.739 81.273 -38.485 1.00 89.58 N ATOM 2622 CD2 HIS C 519 76.450 82.776 -39.902 1.00 91.83 C ATOM 2623 CE1 HIS C 519 76.827 81.816 -37.967 1.00 90.67 C ATOM 2624 NE2 HIS C 519 77.277 82.731 -38.807 1.00 91.16 N ATOM 2625 N MET C 520 72.320 79.358 -42.152 1.00 81.17 N ATOM 2626 CA MET C 520 70.985 78.806 -42.328 1.00 78.10 C ATOM 2627 C MET C 520 71.102 77.300 -42.605 1.00 79.28 C ATOM 2628 O MET C 520 70.300 76.731 -43.347 1.00 79.22 O ATOM 2629 CB MET C 520 70.283 79.483 -43.502 1.00 74.12 C ATOM 2630 CG MET C 520 69.869 80.908 -43.249 1.00 71.85 C ATOM 2631 SD MET C 520 68.913 81.536 -44.648 1.00 75.04 S ATOM 2632 CE MET C 520 67.320 80.777 -44.371 1.00 71.85 C ATOM 2633 N GLY C 521 72.115 76.670 -42.011 1.00 78.26 N ATOM 2634 CA GLY C 521 72.348 75.245 -42.188 1.00 74.58 C ATOM 2635 C GLY C 521 72.103 74.683 -43.581 1.00 72.17 C ATOM 2636 O GLY C 521 71.754 73.510 -43.722 1.00 73.11 O ATOM 2637 N LEU C 522 72.299 75.495 -44.616 1.00 68.23 N ATOM 2638 CA LEU C 522 72.067 75.034 -45.982 1.00 65.74 C ATOM 2639 C LEU C 522 73.338 74.627 -46.724 1.00 64.62 C ATOM 2640 O LEU C 522 73.280 73.959 -47.759 1.00 62.60 O ATOM 2641 CB LEU C 522 71.344 76.124 -46.778 1.00 63.92 C ATOM 2642 CG LEU C 522 70.064 76.698 -46.168 1.00 60.39 C ATOM 2643 CD1 LEU C 522 69.382 77.585 -47.185 1.00 60.37 C ATOM 2644 CD2 LEU C 522 69.139 75.581 -45.754 1.00 59.42 C ATOM 2645 N LEU C 523 74.482 75.033 -46.188 1.00 66.37 N ATOM 2646 CA LEU C 523 75.774 74.736 -46.800 1.00 66.99 C ATOM 2647 C LEU C 523 76.838 74.493 -45.738 1.00 68.55 C ATOM 2648 O LEU C 523 76.894 75.202 -44.732 1.00 70.39 O ATOM 2649 CB LEU C 523 76.201 75.899 -47.693 1.00 63.47 C ATOM 2650 CG LEU C 523 77.641 75.887 -48.192 1.00 59.57 C ATOM 2651 CD1 LEU C 523 77.912 74.587 -48.928 1.00 60.86 C ATOM 2652 CD2 LEU C 523 77.866 77.080 -49.094 1.00 56.76 C ATOM 2653 N LYS C 524 77.692 73.502 -45.971 1.00 69.56 N ATOM 2654 CA LYS C 524 78.734 73.168 -45.011 1.00 72.65 C ATOM 2655 C LYS C 524 79.813 74.218 -44.849 1.00 74.44 C ATOM 2656 O LYS C 524 80.392 74.682 -45.825 1.00 75.94 O ATOM 2657 CB LYS C 524 79.388 71.840 -45.374 1.00 74.61 C ATOM 2658 CG LYS C 524 80.074 71.766 -46.733 1.00 71.55 C ATOM 2659 CD LYS C 524 80.804 70.431 -46.808 1.00 71.87 C ATOM 2660 CE LYS C 524 81.409 70.153 -48.154 1.00 71.78 C ATOM 2661 NZ LYS C 524 82.009 68.821 -48.208 1.00 71.07 N ATOM 2662 N SER C 525 80.089 74.584 -43.605 1.00 76.02 N ATOM 2663 CA SER C 525 81.117 75.575 -43.324 1.00 79.92 C ATOM 2664 C SER C 525 82.395 74.820 -43.009 1.00 82.11 C ATOM 2665 O SER C 525 82.364 73.606 -42.800 1.00 82.59 O ATOM 2666 CB SER C 525 80.721 76.436 -42.123 1.00 81.95 C ATOM 2667 OG SER C 525 80.606 75.657 -40.944 1.00 86.03 O ATOM 2668 N GLU C 526 83.515 75.534 -42.977 1.00 82.63 N ATOM 2669 CA GLU C 526 84.794 74.910 -42.680 1.00 83.61 C ATOM 2670 C GLU C 526 85.040 74.892 -41.174 1.00 84.62 C ATOM 2671 O GLU C 526 86.141 74.613 -40.709 1.00 82.25 O ATOM 2672 CB GLU C 526 85.922 75.656 -43.391 1.00 84.35 C ATOM 2673 CG GLU C 526 87.256 74.939 -43.300 1.00 88.36 C ATOM 2674 CD GLU C 526 88.319 75.570 -44.164 1.00 90.17 C ATOM 2675 OE1 GLU C 526 89.443 75.029 -44.205 1.00 90.70 O ATOM 2676 OE2 GLU C 526 88.027 76.603 -44.803 1.00 92.95 O ATOM 2677 N ASP C 527 83.996 75.187 -40.415 1.00 89.28 N ATOM 2678 CA ASP C 527 84.081 75.204 -38.964 1.00 95.89 C ATOM 2679 C ASP C 527 82.791 74.634 -38.381 1.00101.14 C ATOM 2680 O ASP C 527 82.060 73.906 -39.061 1.00101.13 O ATOM 2681 CB ASP C 527 84.279 76.637 -38.475 1.00 96.93 C ATOM 2682 CG ASP C 527 83.263 77.595 -39.069 1.00101.29 C ATOM 2683 OD1 ASP C 527 83.379 77.929 -40.267 1.00101.50 O ATOM 2684 OD2 ASP C 527 82.336 78.005 -38.342 1.00104.75 O ATOM 2685 N LYS C 528 82.518 74.967 -37.120 1.00105.02 N ATOM 2686 CA LYS C 528 81.311 74.500 -36.443 1.00106.89 C ATOM 2687 C LYS C 528 80.409 75.684 -36.132 1.00107.17 C ATOM 2688 O LYS C 528 80.667 76.451 -35.206 1.00105.83 O ATOM 2689 CB LYS C 528 81.659 73.768 -35.139 1.00107.50 C ATOM 2690 CG LYS C 528 80.456 73.108 -34.452 1.00108.56 C ATOM 2691 CD LYS C 528 80.864 72.319 -33.205 1.00106.90 C ATOM 2692 CE LYS C 528 79.696 71.514 -32.620 1.00105.07 C ATOM 2693 NZ LYS C 528 78.596 72.349 -32.052 1.00100.86 N ATOM 2694 N VAL C 529 79.352 75.829 -36.920 1.00109.61 N ATOM 2695 CA VAL C 529 78.405 76.916 -36.732 1.00112.22 C ATOM 2696 C VAL C 529 77.123 76.364 -36.120 1.00111.82 C ATOM 2697 O VAL C 529 76.706 75.249 -36.436 1.00112.51 O ATOM 2698 CB VAL C 529 78.065 77.599 -38.083 1.00113.84 C ATOM 2699 CG1 VAL C 529 79.346 78.027 -38.786 1.00113.45 C ATOM 2700 CG2 VAL C 529 77.270 76.647 -38.971 1.00115.20 C ATOM 2701 N LYS C 530 76.504 77.132 -35.231 1.00111.17 N ATOM 2702 CA LYS C 530 75.260 76.689 -34.621 1.00111.96 C ATOM 2703 C LYS C 530 74.104 76.988 -35.569 1.00112.90 C ATOM 2704 O LYS C 530 73.639 78.127 -35.655 1.00113.57 O ATOM 2705 CB LYS C 530 75.010 77.401 -33.287 1.00111.93 C ATOM 2706 CG LYS C 530 73.638 77.078 -32.697 1.00110.33 C ATOM 2707 CD LYS C 530 73.344 77.826 -31.412 1.00107.02 C ATOM 2708 CE LYS C 530 71.983 77.413 -30.869 1.00105.66 C ATOM 2709 NZ LYS C 530 71.665 78.038 -29.558 1.00104.81 N ATOM 2710 N ALA C 531 73.646 75.969 -36.288 1.00112.47 N ATOM 2711 CA ALA C 531 72.535 76.157 -37.209 1.00111.58 C ATOM 2712 C ALA C 531 71.328 76.659 -36.416 1.00110.57 C ATOM 2713 O ALA C 531 70.972 76.102 -35.373 1.00108.91 O ATOM 2714 CB ALA C 531 72.205 74.847 -37.916 1.00110.40 C ATOM 2715 N ILE C 532 70.718 77.730 -36.910 1.00108.67 N ATOM 2716 CA ILE C 532 69.558 78.324 -36.265 1.00104.97 C ATOM 2717 C ILE C 532 68.364 77.379 -36.327 1.00104.50 C ATOM 2718 O ILE C 532 68.213 76.613 -37.278 1.00103.80 O ATOM 2719 CB ILE C 532 69.169 79.649 -36.944 1.00103.58 C ATOM 2720 CG1 ILE C 532 68.539 79.375 -38.315 1.00105.31 C ATOM 2721 CG2 ILE C 532 70.393 80.537 -37.072 1.00100.54 C ATOM 2722 CD1 ILE C 532 69.408 78.574 -39.277 1.00108.23 C ATOM 2723 N ALA C 533 67.514 77.452 -35.310 1.00105.23 N ATOM 2724 CA ALA C 533 66.330 76.606 -35.219 1.00103.99 C ATOM 2725 C ALA C 533 65.437 76.666 -36.456 1.00101.40 C ATOM 2726 O ALA C 533 65.506 75.795 -37.321 1.00100.60 O ATOM 2727 CB ALA C 533 65.523 76.981 -33.977 1.00105.99 C ATOM 2728 N ASN C 534 64.600 77.697 -36.530 1.00 98.33 N ATOM 2729 CA ASN C 534 63.677 77.855 -37.646 1.00 94.55 C ATOM 2730 C ASN C 534 64.078 78.889 -38.687 1.00 89.47 C ATOM 2731 O ASN C 534 64.469 80.003 -38.350 1.00 88.40 O ATOM 2732 CB ASN C 534 62.295 78.213 -37.128 1.00 97.63 C ATOM 2733 CG ASN C 534 61.473 78.926 -38.168 1.00102.34 C ATOM 2734 OD1 ASN C 534 61.283 78.420 -39.272 1.00104.07 O ATOM 2735 ND2 ASN C 534 60.988 80.115 -37.830 1.00104.58 N ATOM 2736 N LEU C 535 63.930 78.521 -39.955 1.00 84.79 N ATOM 2737 CA LEU C 535 64.277 79.399 -41.067 1.00 84.26 C ATOM 2738 C LEU C 535 63.106 80.211 -41.581 1.00 83.81 C ATOM 2739 O LEU C 535 63.178 80.778 -42.672 1.00 81.47 O ATOM 2740 CB LEU C 535 64.836 78.587 -42.234 1.00 85.12 C ATOM 2741 CG LEU C 535 66.261 78.038 -42.154 1.00 87.03 C ATOM 2742 CD1 LEU C 535 66.457 77.238 -40.869 1.00 87.62 C ATOM 2743 CD2 LEU C 535 66.526 77.181 -43.392 1.00 85.19 C ATOM 2744 N TYR C 536 62.030 80.268 -40.806 1.00 85.97 N ATOM 2745 CA TYR C 536 60.846 81.008 -41.229 1.00 87.22 C ATOM 2746 C TYR C 536 61.126 82.503 -41.317 1.00 84.41 C ATOM 2747 O TYR C 536 60.958 83.113 -42.379 1.00 81.20 O ATOM 2748 CB TYR C 536 59.672 80.747 -40.273 1.00 91.07 C ATOM 2749 CG TYR C 536 58.397 81.446 -40.683 1.00 96.39 C ATOM 2750 CD1 TYR C 536 57.865 81.266 -41.960 1.00 99.16 C ATOM 2751 CD2 TYR C 536 57.748 82.330 -39.816 1.00 98.71 C ATOM 2752 CE1 TYR C 536 56.724 81.953 -42.372 1.00101.39 C ATOM 2753 CE2 TYR C 536 56.603 83.026 -40.219 1.00100.75 C ATOM 2754 CZ TYR C 536 56.100 82.833 -41.502 1.00102.03 C ATOM 2755 OH TYR C 536 54.994 83.532 -41.931 1.00104.32 O ATOM 2756 N GLY C 537 61.554 83.084 -40.198 1.00 82.79 N ATOM 2757 CA GLY C 537 61.854 84.505 -40.169 1.00 80.14 C ATOM 2758 C GLY C 537 62.752 84.885 -41.330 1.00 76.86 C ATOM 2759 O GLY C 537 62.432 85.793 -42.103 1.00 74.63 O ATOM 2760 N PRO C 538 63.900 84.202 -41.470 1.00 73.94 N ATOM 2761 CA PRO C 538 64.836 84.482 -42.556 1.00 71.48 C ATOM 2762 C PRO C 538 64.176 84.267 -43.912 1.00 70.28 C ATOM 2763 O PRO C 538 64.136 85.169 -44.744 1.00 69.66 O ATOM 2764 CB PRO C 538 65.965 83.494 -42.289 1.00 70.22 C ATOM 2765 CG PRO C 538 65.972 83.413 -40.801 1.00 67.93 C ATOM 2766 CD PRO C 538 64.503 83.270 -40.500 1.00 71.25 C ATOM 2767 N LEU C 539 63.647 83.072 -44.131 1.00 69.42 N ATOM 2768 CA LEU C 539 63.000 82.782 -45.396 1.00 71.87 C ATOM 2769 C LEU C 539 61.944 83.814 -45.755 1.00 75.40 C ATOM 2770 O LEU C 539 61.596 83.959 -46.927 1.00 79.82 O ATOM 2771 CB LEU C 539 62.380 81.394 -45.363 1.00 73.15 C ATOM 2772 CG LEU C 539 63.347 80.275 -45.739 1.00 74.06 C ATOM 2773 CD1 LEU C 539 62.822 78.970 -45.202 1.00 76.21 C ATOM 2774 CD2 LEU C 539 63.523 80.218 -47.253 1.00 71.43 C ATOM 2775 N MET C 540 61.424 84.524 -44.757 1.00 75.07 N ATOM 2776 CA MET C 540 60.423 85.555 -45.017 1.00 73.20 C ATOM 2777 C MET C 540 61.127 86.886 -45.211 1.00 71.20 C ATOM 2778 O MET C 540 60.765 87.678 -46.084 1.00 68.32 O ATOM 2779 CB MET C 540 59.427 85.645 -43.863 1.00 74.46 C ATOM 2780 CG MET C 540 58.399 84.536 -43.892 1.00 76.88 C ATOM 2781 SD MET C 540 57.529 84.522 -45.480 1.00 82.18 S ATOM 2782 CE MET C 540 55.799 84.672 -44.937 1.00 80.27 C ATOM 2783 N ALA C 541 62.143 87.119 -44.387 1.00 71.41 N ATOM 2784 CA ALA C 541 62.927 88.337 -44.478 1.00 71.25 C ATOM 2785 C ALA C 541 63.566 88.354 -45.864 1.00 72.24 C ATOM 2786 O ALA C 541 63.535 89.371 -46.549 1.00 72.67 O ATOM 2787 CB ALA C 541 63.994 88.357 -43.393 1.00 68.06 C ATOM 2788 N LEU C 542 64.130 87.216 -46.269 1.00 73.93 N ATOM 2789 CA LEU C 542 64.764 87.071 -47.581 1.00 75.24 C ATOM 2790 C LEU C 542 63.713 87.292 -48.649 1.00 76.61 C ATOM 2791 O LEU C 542 63.945 87.973 -49.644 1.00 75.49 O ATOM 2792 CB LEU C 542 65.332 85.659 -47.768 1.00 76.06 C ATOM 2793 CG LEU C 542 66.590 85.192 -47.034 1.00 76.82 C ATOM 2794 CD1 LEU C 542 66.936 83.778 -47.473 1.00 74.78 C ATOM 2795 CD2 LEU C 542 67.740 86.118 -47.353 1.00 77.28 C ATOM 2796 N ASN C 543 62.556 86.682 -48.422 1.00 80.57 N ATOM 2797 CA ASN C 543 61.419 86.759 -49.328 1.00 86.09 C ATOM 2798 C ASN C 543 61.145 88.197 -49.759 1.00 86.30 C ATOM 2799 O ASN C 543 60.791 88.464 -50.912 1.00 84.36 O ATOM 2800 CB ASN C 543 60.194 86.147 -48.633 1.00 89.32 C ATOM 2801 CG ASN C 543 58.908 86.374 -49.396 1.00 93.75 C ATOM 2802 OD1 ASN C 543 58.901 86.454 -50.630 1.00 96.25 O ATOM 2803 ND2 ASN C 543 57.801 86.461 -48.664 1.00 92.30 N ATOM 2804 N HIS C 544 61.330 89.114 -48.817 1.00 85.82 N ATOM 2805 CA HIS C 544 61.116 90.534 -49.045 1.00 86.32 C ATOM 2806 C HIS C 544 62.302 91.163 -49.775 1.00 84.56 C ATOM 2807 O HIS C 544 62.145 91.767 -50.833 1.00 84.93 O ATOM 2808 CB HIS C 544 60.899 91.219 -47.689 1.00 89.32 C ATOM 2809 CG HIS C 544 60.791 92.713 -47.758 1.00 92.53 C ATOM 2810 ND1 HIS C 544 59.882 93.362 -48.565 1.00 93.49 N ATOM 2811 CD2 HIS C 544 61.444 93.682 -47.072 1.00 91.50 C ATOM 2812 CE1 HIS C 544 59.977 94.665 -48.370 1.00 93.09 C ATOM 2813 NE2 HIS C 544 60.917 94.886 -47.469 1.00 91.66 N ATOM 2814 N MET C 545 63.486 90.996 -49.194 1.00 82.71 N ATOM 2815 CA MET C 545 64.732 91.545 -49.718 1.00 79.15 C ATOM 2816 C MET C 545 64.977 91.324 -51.197 1.00 77.37 C ATOM 2817 O MET C 545 65.422 92.227 -51.899 1.00 74.85 O ATOM 2818 CB MET C 545 65.909 90.969 -48.938 1.00 81.35 C ATOM 2819 CG MET C 545 67.260 91.493 -49.381 1.00 85.81 C ATOM 2820 SD MET C 545 68.599 90.560 -48.624 1.00 92.30 S ATOM 2821 CE MET C 545 68.254 90.831 -46.877 1.00 84.73 C ATOM 2822 N VAL C 546 64.706 90.117 -51.668 1.00 80.22 N ATOM 2823 CA VAL C 546 64.925 89.795 -53.069 1.00 84.30 C ATOM 2824 C VAL C 546 64.067 90.668 -53.979 1.00 87.38 C ATOM 2825 O VAL C 546 64.384 90.861 -55.156 1.00 86.64 O ATOM 2826 CB VAL C 546 64.610 88.311 -53.346 1.00 85.13 C ATOM 2827 CG1 VAL C 546 64.883 87.989 -54.802 1.00 86.13 C ATOM 2828 CG2 VAL C 546 65.448 87.416 -52.434 1.00 84.04 C ATOM 2829 N GLN C 547 62.985 91.199 -53.419 1.00 91.76 N ATOM 2830 CA GLN C 547 62.065 92.048 -54.167 1.00 94.99 C ATOM 2831 C GLN C 547 62.561 93.490 -54.231 1.00 95.42 C ATOM 2832 O GLN C 547 62.397 94.168 -55.247 1.00 94.56 O ATOM 2833 CB GLN C 547 60.676 91.993 -53.531 1.00 97.67 C ATOM 2834 CG GLN C 547 60.174 90.575 -53.313 1.00102.68 C ATOM 2835 CD GLN C 547 58.722 90.519 -52.889 1.00105.99 C ATOM 2836 OE1 GLN C 547 57.827 90.894 -53.650 1.00107.71 O ATOM 2837 NE2 GLN C 547 58.477 90.048 -51.668 1.00105.61 N ATOM 2838 N GLN C 548 63.169 93.955 -53.143 1.00 97.52 N ATOM 2839 CA GLN C 548 63.706 95.309 -53.097 1.00 99.55 C ATOM 2840 C GLN C 548 64.669 95.433 -54.269 1.00101.47 C ATOM 2841 O GLN C 548 65.016 94.431 -54.897 1.00103.38 O ATOM 2842 CB GLN C 548 64.450 95.546 -51.779 1.00 98.71 C ATOM 2843 CG GLN C 548 63.660 95.122 -50.550 1.00 97.31 C ATOM 2844 CD GLN C 548 62.288 95.759 -50.492 1.00 95.58 C ATOM 2845 OE1 GLN C 548 62.153 96.938 -50.168 1.00 96.66 O ATOM 2846 NE2 GLN C 548 61.261 94.982 -50.821 1.00 92.47 N ATOM 2847 N ASP C 549 65.109 96.649 -54.572 1.00101.13 N ATOM 2848 CA ASP C 549 66.012 96.827 -55.694 1.00 97.79 C ATOM 2849 C ASP C 549 67.463 96.837 -55.267 1.00 94.67 C ATOM 2850 O ASP C 549 68.334 96.385 -56.005 1.00 92.96 O ATOM 2851 CB ASP C 549 65.691 98.115 -56.439 1.00 99.01 C ATOM 2852 CG ASP C 549 65.994 98.009 -57.912 1.00102.31 C ATOM 2853 OD1 ASP C 549 67.118 97.588 -58.257 1.00103.31 O ATOM 2854 OD2 ASP C 549 65.109 98.340 -58.728 1.00105.62 O ATOM 2855 N TYR C 550 67.722 97.345 -54.070 1.00 93.98 N ATOM 2856 CA TYR C 550 69.082 97.409 -53.557 1.00 96.07 C ATOM 2857 C TYR C 550 69.717 96.026 -53.491 1.00 96.86 C ATOM 2858 O TYR C 550 70.831 95.865 -52.991 1.00 97.66 O ATOM 2859 CB TYR C 550 69.088 98.045 -52.167 1.00 98.07 C ATOM 2860 CG TYR C 550 68.382 97.233 -51.098 1.00100.48 C ATOM 2861 CD1 TYR C 550 68.942 96.057 -50.599 1.00 99.09 C ATOM 2862 CD2 TYR C 550 67.168 97.662 -50.559 1.00102.44 C ATOM 2863 CE1 TYR C 550 68.316 95.333 -49.590 1.00 99.91 C ATOM 2864 CE2 TYR C 550 66.533 96.943 -49.547 1.00101.85 C ATOM 2865 CZ TYR C 550 67.114 95.783 -49.066 1.00101.80 C ATOM 2866 OH TYR C 550 66.507 95.087 -48.042 1.00102.51 O ATOM 2867 N PHE C 551 69.004 95.024 -53.989 1.00 96.00 N ATOM 2868 CA PHE C 551 69.514 93.666 -53.971 1.00 94.88 C ATOM 2869 C PHE C 551 70.206 93.315 -55.278 1.00 93.87 C ATOM 2870 O PHE C 551 69.635 93.497 -56.353 1.00 92.52 O ATOM 2871 CB PHE C 551 68.378 92.674 -53.733 1.00 97.19 C ATOM 2872 CG PHE C 551 68.843 91.254 -53.608 1.00 98.63 C ATOM 2873 CD1 PHE C 551 69.501 90.825 -52.458 1.00 98.08 C ATOM 2874 CD2 PHE C 551 68.665 90.356 -54.659 1.00 98.30 C ATOM 2875 CE1 PHE C 551 69.979 89.523 -52.355 1.00 97.88 C ATOM 2876 CE2 PHE C 551 69.139 89.050 -54.568 1.00 97.88 C ATOM 2877 CZ PHE C 551 69.798 88.633 -53.414 1.00 98.37 C ATOM 2878 N PRO C 552 71.452 92.810 -55.198 1.00 93.87 N ATOM 2879 CA PRO C 552 72.249 92.416 -56.369 1.00 92.57 C ATOM 2880 C PRO C 552 71.584 91.250 -57.100 1.00 91.73 C ATOM 2881 O PRO C 552 71.701 90.099 -56.677 1.00 91.88 O ATOM 2882 CB PRO C 552 73.585 92.010 -55.755 1.00 91.32 C ATOM 2883 CG PRO C 552 73.666 92.864 -54.528 1.00 90.40 C ATOM 2884 CD PRO C 552 72.273 92.758 -53.975 1.00 91.25 C ATOM 2885 N LYS C 553 70.886 91.551 -58.191 1.00 90.45 N ATOM 2886 CA LYS C 553 70.191 90.531 -58.968 1.00 89.10 C ATOM 2887 C LYS C 553 71.140 89.445 -59.471 1.00 90.57 C ATOM 2888 O LYS C 553 70.753 88.586 -60.265 1.00 92.13 O ATOM 2889 CB LYS C 553 69.463 91.179 -60.151 1.00 84.93 C ATOM 2890 N ALA C 554 72.381 89.481 -58.998 1.00 90.63 N ATOM 2891 CA ALA C 554 73.393 88.507 -59.397 1.00 90.07 C ATOM 2892 C ALA C 554 73.440 87.283 -58.473 1.00 87.79 C ATOM 2893 O ALA C 554 73.737 86.167 -58.910 1.00 86.81 O ATOM 2894 CB ALA C 554 74.755 89.183 -59.435 1.00 91.71 C ATOM 2895 N LEU C 555 73.151 87.503 -57.194 1.00 84.47 N ATOM 2896 CA LEU C 555 73.158 86.434 -56.203 1.00 78.96 C ATOM 2897 C LEU C 555 71.867 85.652 -56.349 1.00 77.30 C ATOM 2898 O LEU C 555 71.634 84.683 -55.632 1.00 76.23 O ATOM 2899 CB LEU C 555 73.230 87.028 -54.798 1.00 75.69 C ATOM 2900 CG LEU C 555 74.148 88.243 -54.652 1.00 72.68 C ATOM 2901 CD1 LEU C 555 73.774 89.000 -53.399 1.00 70.71 C ATOM 2902 CD2 LEU C 555 75.605 87.811 -54.632 1.00 69.77 C ATOM 2903 N ALA C 556 71.037 86.091 -57.290 1.00 77.09 N ATOM 2904 CA ALA C 556 69.740 85.481 -57.556 1.00 78.42 C ATOM 2905 C ALA C 556 69.735 83.954 -57.650 1.00 78.03 C ATOM 2906 O ALA C 556 69.118 83.279 -56.824 1.00 77.39 O ATOM 2907 CB ALA C 556 69.135 86.088 -58.831 1.00 79.23 C ATOM 2908 N PRO C 557 70.419 83.387 -58.656 1.00 76.68 N ATOM 2909 CA PRO C 557 70.437 81.927 -58.788 1.00 75.84 C ATOM 2910 C PRO C 557 71.106 81.164 -57.638 1.00 73.89 C ATOM 2911 O PRO C 557 70.720 80.039 -57.326 1.00 71.78 O ATOM 2912 CB PRO C 557 71.144 81.721 -60.124 1.00 77.59 C ATOM 2913 CG PRO C 557 72.099 82.883 -60.173 1.00 77.53 C ATOM 2914 CD PRO C 557 71.236 84.021 -59.706 1.00 75.63 C ATOM 2915 N LEU C 558 72.099 81.778 -57.006 1.00 73.76 N ATOM 2916 CA LEU C 558 72.812 81.142 -55.904 1.00 74.25 C ATOM 2917 C LEU C 558 71.943 80.919 -54.678 1.00 75.37 C ATOM 2918 O LEU C 558 72.225 80.043 -53.864 1.00 76.88 O ATOM 2919 CB LEU C 558 74.033 81.971 -55.526 1.00 75.61 C ATOM 2920 CG LEU C 558 75.193 81.880 -56.519 1.00 80.01 C ATOM 2921 CD1 LEU C 558 74.735 82.235 -57.942 1.00 78.72 C ATOM 2922 CD2 LEU C 558 76.305 82.813 -56.049 1.00 82.76 C ATOM 2923 N LEU C 559 70.897 81.723 -54.536 1.00 76.55 N ATOM 2924 CA LEU C 559 69.975 81.577 -53.413 1.00 75.88 C ATOM 2925 C LEU C 559 68.937 80.566 -53.883 1.00 76.58 C ATOM 2926 O LEU C 559 68.570 79.638 -53.160 1.00 77.71 O ATOM 2927 CB LEU C 559 69.282 82.907 -53.099 1.00 73.09 C ATOM 2928 CG LEU C 559 69.161 83.302 -51.625 1.00 70.06 C ATOM 2929 CD1 LEU C 559 68.127 84.416 -51.488 1.00 67.02 C ATOM 2930 CD2 LEU C 559 68.761 82.098 -50.793 1.00 68.02 C ATOM 2931 N LEU C 560 68.478 80.765 -55.116 1.00 74.76 N ATOM 2932 CA LEU C 560 67.493 79.892 -55.735 1.00 71.31 C ATOM 2933 C LEU C 560 67.952 78.449 -55.619 1.00 74.77 C ATOM 2934 O LEU C 560 67.161 77.560 -55.300 1.00 78.31 O ATOM 2935 CB LEU C 560 67.322 80.263 -57.207 1.00 61.90 C ATOM 2936 CG LEU C 560 66.596 79.243 -58.078 1.00 58.53 C ATOM 2937 CD1 LEU C 560 65.287 78.825 -57.431 1.00 57.69 C ATOM 2938 CD2 LEU C 560 66.361 79.849 -59.445 1.00 56.83 C ATOM 2939 N ALA C 561 69.241 78.233 -55.867 1.00 74.04 N ATOM 2940 CA ALA C 561 69.839 76.905 -55.806 1.00 70.31 C ATOM 2941 C ALA C 561 69.863 76.327 -54.398 1.00 66.44 C ATOM 2942 O ALA C 561 69.546 75.157 -54.194 1.00 66.21 O ATOM 2943 CB ALA C 561 71.249 76.947 -56.366 1.00 68.49 C ATOM 2944 N PHE C 562 70.231 77.137 -53.420 1.00 62.80 N ATOM 2945 CA PHE C 562 70.284 76.624 -52.070 1.00 65.36 C ATOM 2946 C PHE C 562 68.997 76.623 -51.281 1.00 67.81 C ATOM 2947 O PHE C 562 68.991 76.261 -50.103 1.00 67.64 O ATOM 2948 CB PHE C 562 71.370 77.326 -51.282 1.00 66.93 C ATOM 2949 CG PHE C 562 72.682 76.645 -51.386 1.00 67.44 C ATOM 2950 CD1 PHE C 562 73.491 76.848 -52.490 1.00 65.60 C ATOM 2951 CD2 PHE C 562 73.074 75.728 -50.412 1.00 67.80 C ATOM 2952 CE1 PHE C 562 74.670 76.147 -52.628 1.00 68.63 C ATOM 2953 CE2 PHE C 562 74.250 75.019 -50.537 1.00 65.84 C ATOM 2954 CZ PHE C 562 75.053 75.226 -51.648 1.00 68.99 C ATOM 2955 N VAL C 563 67.907 77.026 -51.921 1.00 69.66 N ATOM 2956 CA VAL C 563 66.616 77.015 -51.253 1.00 70.12 C ATOM 2957 C VAL C 563 65.868 75.796 -51.769 1.00 70.79 C ATOM 2958 O VAL C 563 65.100 75.162 -51.044 1.00 71.16 O ATOM 2959 CB VAL C 563 65.809 78.278 -51.547 1.00 69.09 C ATOM 2960 CG1 VAL C 563 64.466 78.196 -50.855 1.00 68.19 C ATOM 2961 CG2 VAL C 563 66.566 79.492 -51.054 1.00 70.61 C ATOM 2962 N THR C 564 66.104 75.468 -53.034 1.00 69.84 N ATOM 2963 CA THR C 564 65.484 74.302 -53.640 1.00 68.83 C ATOM 2964 C THR C 564 66.262 73.092 -53.139 1.00 71.39 C ATOM 2965 O THR C 564 65.774 71.964 -53.154 1.00 73.54 O ATOM 2966 CB THR C 564 65.573 74.364 -55.169 1.00 66.22 C ATOM 2967 OG1 THR C 564 66.748 75.090 -55.538 1.00 64.37 O ATOM 2968 CG2 THR C 564 64.354 75.048 -55.757 1.00 68.48 C ATOM 2969 N LYS C 565 67.483 73.346 -52.685 1.00 73.46 N ATOM 2970 CA LYS C 565 68.345 72.293 -52.168 1.00 74.28 C ATOM 2971 C LYS C 565 67.655 71.513 -51.056 1.00 72.22 C ATOM 2972 O LYS C 565 67.444 72.036 -49.961 1.00 74.35 O ATOM 2973 CB LYS C 565 69.641 72.894 -51.616 1.00 77.66 C ATOM 2974 CG LYS C 565 70.599 71.879 -50.980 1.00 79.34 C ATOM 2975 CD LYS C 565 71.357 71.072 -52.031 1.00 77.83 C ATOM 2976 CE LYS C 565 72.304 70.078 -51.381 1.00 75.97 C ATOM 2977 NZ LYS C 565 73.155 70.731 -50.353 1.00 75.77 N ATOM 2978 N PRO C 566 67.297 70.249 -51.325 1.00 68.26 N ATOM 2979 CA PRO C 566 66.636 69.387 -50.346 1.00 65.99 C ATOM 2980 C PRO C 566 67.281 69.514 -48.967 1.00 66.00 C ATOM 2981 O PRO C 566 68.445 69.164 -48.783 1.00 67.20 O ATOM 2982 CB PRO C 566 66.828 68.007 -50.950 1.00 62.94 C ATOM 2983 CG PRO C 566 66.667 68.290 -52.402 1.00 61.56 C ATOM 2984 CD PRO C 566 67.506 69.527 -52.593 1.00 64.92 C ATOM 2985 N ASN C 567 66.529 70.028 -48.002 1.00 66.94 N ATOM 2986 CA ASN C 567 67.054 70.188 -46.653 1.00 70.21 C ATOM 2987 C ASN C 567 65.988 70.203 -45.563 1.00 70.39 C ATOM 2988 O ASN C 567 65.037 70.982 -45.618 1.00 67.81 O ATOM 2989 CB ASN C 567 67.871 71.469 -46.542 1.00 73.82 C ATOM 2990 CG ASN C 567 67.983 71.950 -45.109 1.00 78.84 C ATOM 2991 OD1 ASN C 567 68.620 71.313 -44.270 1.00 82.23 O ATOM 2992 ND2 ASN C 567 67.339 73.068 -44.815 1.00 81.76 N ATOM 2993 N SER C 568 66.184 69.347 -44.565 1.00 71.46 N ATOM 2994 CA SER C 568 65.283 69.209 -43.424 1.00 71.62 C ATOM 2995 C SER C 568 64.517 70.464 -42.997 1.00 71.98 C ATOM 2996 O SER C 568 63.310 70.560 -43.204 1.00 71.21 O ATOM 2997 CB SER C 568 66.068 68.681 -42.228 1.00 73.02 C ATOM 2998 OG SER C 568 65.312 68.824 -41.042 1.00 75.95 O ATOM 2999 N ALA C 569 65.217 71.417 -42.386 1.00 72.64 N ATOM 3000 CA ALA C 569 64.596 72.655 -41.914 1.00 71.24 C ATOM 3001 C ALA C 569 63.962 73.499 -43.027 1.00 69.40 C ATOM 3002 O ALA C 569 62.854 74.002 -42.880 1.00 66.08 O ATOM 3003 CB ALA C 569 65.623 73.482 -41.142 1.00 70.92 C ATOM 3004 N LEU C 570 64.663 73.661 -44.139 1.00 71.55 N ATOM 3005 CA LEU C 570 64.129 74.440 -45.248 1.00 75.93 C ATOM 3006 C LEU C 570 62.904 73.717 -45.805 1.00 77.23 C ATOM 3007 O LEU C 570 62.408 74.038 -46.885 1.00 75.35 O ATOM 3008 CB LEU C 570 65.193 74.593 -46.336 1.00 80.13 C ATOM 3009 CG LEU C 570 64.955 75.511 -47.540 1.00 81.78 C ATOM 3010 CD1 LEU C 570 64.788 76.963 -47.099 1.00 81.55 C ATOM 3011 CD2 LEU C 570 66.150 75.386 -48.471 1.00 82.31 C ATOM 3012 N GLU C 571 62.436 72.725 -45.056 1.00 79.73 N ATOM 3013 CA GLU C 571 61.269 71.940 -45.430 1.00 83.51 C ATOM 3014 C GLU C 571 60.230 72.101 -44.329 1.00 82.73 C ATOM 3015 O GLU C 571 59.034 71.983 -44.570 1.00 82.54 O ATOM 3016 CB GLU C 571 61.644 70.460 -45.581 1.00 90.24 C ATOM 3017 CG GLU C 571 62.534 70.140 -46.791 1.00 98.31 C ATOM 3018 CD GLU C 571 63.050 68.695 -46.810 1.00101.31 C ATOM 3019 OE1 GLU C 571 62.236 67.748 -46.709 1.00101.97 O ATOM 3020 OE2 GLU C 571 64.279 68.508 -46.937 1.00103.43 O ATOM 3021 N SER C 572 60.700 72.384 -43.120 1.00 83.29 N ATOM 3022 CA SER C 572 59.820 72.567 -41.971 1.00 83.03 C ATOM 3023 C SER C 572 59.092 73.895 -42.070 1.00 82.06 C ATOM 3024 O SER C 572 58.572 74.391 -41.074 1.00 81.28 O ATOM 3025 CB SER C 572 60.622 72.549 -40.665 1.00 86.15 C ATOM 3026 OG SER C 572 61.492 71.431 -40.596 1.00 90.02 O ATOM 3027 N CYS C 573 59.075 74.477 -43.265 1.00 83.74 N ATOM 3028 CA CYS C 573 58.404 75.754 -43.498 1.00 87.34 C ATOM 3029 C CYS C 573 57.956 75.880 -44.942 1.00 87.25 C ATOM 3030 O CYS C 573 58.166 76.910 -45.581 1.00 86.77 O ATOM 3031 CB CYS C 573 59.327 76.918 -43.147 1.00 89.19 C ATOM 3032 SG CYS C 573 59.583 77.131 -41.376 1.00 98.82 S ATOM 3033 N SER C 574 57.332 74.819 -45.437 1.00 88.10 N ATOM 3034 CA SER C 574 56.842 74.750 -46.806 1.00 91.72 C ATOM 3035 C SER C 574 56.410 76.099 -47.364 1.00 93.82 C ATOM 3036 O SER C 574 56.785 76.476 -48.480 1.00 92.69 O ATOM 3037 CB SER C 574 55.663 73.778 -46.878 1.00 94.25 C ATOM 3038 OG SER C 574 56.004 72.512 -46.342 1.00 96.25 O ATOM 3039 N PHE C 575 55.614 76.814 -46.574 1.00 96.56 N ATOM 3040 CA PHE C 575 55.090 78.116 -46.962 1.00 99.23 C ATOM 3041 C PHE C 575 56.206 79.103 -47.283 1.00 97.30 C ATOM 3042 O PHE C 575 56.443 79.430 -48.450 1.00 95.23 O ATOM 3043 CB PHE C 575 54.197 78.657 -45.838 1.00105.83 C ATOM 3044 CG PHE C 575 53.437 79.905 -46.202 1.00113.68 C ATOM 3045 CD1 PHE C 575 52.717 79.979 -47.397 1.00115.00 C ATOM 3046 CD2 PHE C 575 53.421 81.003 -45.337 1.00116.40 C ATOM 3047 CE1 PHE C 575 51.993 81.127 -47.725 1.00116.71 C ATOM 3048 CE2 PHE C 575 52.700 82.156 -45.655 1.00117.37 C ATOM 3049 CZ PHE C 575 51.984 82.219 -46.851 1.00117.76 C ATOM 3050 N ALA C 576 56.890 79.564 -46.239 1.00 96.11 N ATOM 3051 CA ALA C 576 57.985 80.519 -46.378 1.00 96.10 C ATOM 3052 C ALA C 576 58.859 80.236 -47.600 1.00 95.47 C ATOM 3053 O ALA C 576 59.229 81.148 -48.347 1.00 94.51 O ATOM 3054 CB ALA C 576 58.836 80.506 -45.113 1.00 95.80 C ATOM 3055 N ARG C 577 59.180 78.963 -47.798 1.00 93.61 N ATOM 3056 CA ARG C 577 60.013 78.547 -48.910 1.00 92.24 C ATOM 3057 C ARG C 577 59.323 78.708 -50.262 1.00 92.48 C ATOM 3058 O ARG C 577 59.797 79.468 -51.103 1.00 91.63 O ATOM 3059 CB ARG C 577 60.444 77.098 -48.710 1.00 92.34 C ATOM 3060 CG ARG C 577 61.338 76.551 -49.805 1.00 93.88 C ATOM 3061 CD ARG C 577 61.683 75.104 -49.523 1.00 93.23 C ATOM 3062 NE ARG C 577 62.470 74.503 -50.589 1.00 93.01 N ATOM 3063 CZ ARG C 577 62.935 73.263 -50.548 1.00 95.89 C ATOM 3064 NH1 ARG C 577 62.686 72.498 -49.495 1.00 96.45 N ATOM 3065 NH2 ARG C 577 63.656 72.790 -51.552 1.00 99.06 N ATOM 3066 N HIS C 578 58.216 77.999 -50.477 1.00 93.76 N ATOM 3067 CA HIS C 578 57.500 78.100 -51.751 1.00 97.11 C ATOM 3068 C HIS C 578 57.389 79.574 -52.133 1.00 96.29 C ATOM 3069 O HIS C 578 57.521 79.941 -53.304 1.00 95.85 O ATOM 3070 CB HIS C 578 56.095 77.480 -51.640 1.00102.86 C ATOM 3071 CG HIS C 578 55.289 77.551 -52.908 1.00108.46 C ATOM 3072 ND1 HIS C 578 53.944 77.239 -52.954 1.00109.64 N ATOM 3073 CD2 HIS C 578 55.634 77.896 -54.173 1.00109.04 C ATOM 3074 CE1 HIS C 578 53.498 77.391 -54.189 1.00108.04 C ATOM 3075 NE2 HIS C 578 54.503 77.789 -54.948 1.00107.98 N ATOM 3076 N SER C 579 57.157 80.416 -51.131 1.00 94.79 N ATOM 3077 CA SER C 579 57.036 81.853 -51.348 1.00 92.14 C ATOM 3078 C SER C 579 58.316 82.361 -51.993 1.00 89.00 C ATOM 3079 O SER C 579 58.308 82.831 -53.132 1.00 86.52 O ATOM 3080 CB SER C 579 56.822 82.567 -50.013 1.00 92.04 C ATOM 3081 OG SER C 579 55.774 81.961 -49.281 1.00 91.07 O ATOM 3082 N LEU C 580 59.413 82.250 -51.245 1.00 85.71 N ATOM 3083 CA LEU C 580 60.724 82.686 -51.702 1.00 81.80 C ATOM 3084 C LEU C 580 61.020 82.078 -53.063 1.00 80.30 C ATOM 3085 O LEU C 580 61.476 82.771 -53.972 1.00 80.30 O ATOM 3086 CB LEU C 580 61.800 82.251 -50.708 1.00 81.27 C ATOM 3087 CG LEU C 580 63.019 83.164 -50.525 1.00 81.05 C ATOM 3088 CD1 LEU C 580 64.121 82.390 -49.802 1.00 79.42 C ATOM 3089 CD2 LEU C 580 63.515 83.669 -51.866 1.00 77.33 C ATOM 3090 N LEU C 581 60.771 80.778 -53.201 1.00 79.15 N ATOM 3091 CA LEU C 581 61.012 80.109 -54.474 1.00 78.02 C ATOM 3092 C LEU C 581 60.229 80.840 -55.542 1.00 76.21 C ATOM 3093 O LEU C 581 60.749 81.134 -56.613 1.00 73.10 O ATOM 3094 CB LEU C 581 60.588 78.636 -54.416 1.00 76.68 C ATOM 3095 CG LEU C 581 61.597 77.727 -53.706 1.00 75.88 C ATOM 3096 CD1 LEU C 581 61.100 76.295 -53.673 1.00 75.63 C ATOM 3097 CD2 LEU C 581 62.929 77.804 -54.436 1.00 76.69 C ATOM 3098 N GLN C 582 58.977 81.150 -55.240 1.00 77.88 N ATOM 3099 CA GLN C 582 58.158 81.870 -56.193 1.00 81.01 C ATOM 3100 C GLN C 582 58.765 83.240 -56.455 1.00 82.80 C ATOM 3101 O GLN C 582 59.025 83.604 -57.605 1.00 85.29 O ATOM 3102 CB GLN C 582 56.725 81.999 -55.675 1.00 80.84 C ATOM 3103 CG GLN C 582 55.876 80.797 -56.030 1.00 81.47 C ATOM 3104 CD GLN C 582 55.863 80.533 -57.530 1.00 82.48 C ATOM 3105 OE1 GLN C 582 55.561 79.425 -57.976 1.00 84.33 O ATOM 3106 NE2 GLN C 582 56.186 81.557 -58.317 1.00 80.22 N ATOM 3107 N THR C 583 59.001 83.991 -55.383 1.00 81.82 N ATOM 3108 CA THR C 583 59.594 85.320 -55.489 1.00 79.66 C ATOM 3109 C THR C 583 60.811 85.260 -56.417 1.00 77.14 C ATOM 3110 O THR C 583 60.934 86.052 -57.354 1.00 74.70 O ATOM 3111 CB THR C 583 60.040 85.835 -54.090 1.00 81.92 C ATOM 3112 OG1 THR C 583 58.894 86.003 -53.245 1.00 81.57 O ATOM 3113 CG2 THR C 583 60.771 87.157 -54.211 1.00 83.82 C ATOM 3114 N LEU C 584 61.689 84.293 -56.153 1.00 74.83 N ATOM 3115 CA LEU C 584 62.914 84.095 -56.921 1.00 72.17 C ATOM 3116 C LEU C 584 62.705 83.642 -58.356 1.00 73.15 C ATOM 3117 O LEU C 584 63.430 84.067 -59.251 1.00 70.80 O ATOM 3118 CB LEU C 584 63.812 83.088 -56.209 1.00 70.45 C ATOM 3119 CG LEU C 584 64.438 83.569 -54.902 1.00 72.08 C ATOM 3120 CD1 LEU C 584 65.178 82.430 -54.226 1.00 74.11 C ATOM 3121 CD2 LEU C 584 65.388 84.711 -55.194 1.00 72.41 C ATOM 3122 N TYR C 585 61.728 82.770 -58.581 1.00 77.40 N ATOM 3123 CA TYR C 585 61.472 82.285 -59.934 1.00 81.50 C ATOM 3124 C TYR C 585 61.209 83.474 -60.850 1.00 83.04 C ATOM 3125 O TYR C 585 61.442 83.403 -62.058 1.00 81.40 O ATOM 3126 CB TYR C 585 60.264 81.328 -59.965 1.00 82.42 C ATOM 3127 CG TYR C 585 60.472 79.964 -59.315 1.00 82.30 C ATOM 3128 CD1 TYR C 585 59.399 79.100 -59.117 1.00 82.58 C ATOM 3129 CD2 TYR C 585 61.727 79.554 -58.867 1.00 84.11 C ATOM 3130 CE1 TYR C 585 59.566 77.870 -58.482 1.00 83.34 C ATOM 3131 CE2 TYR C 585 61.903 78.324 -58.229 1.00 83.40 C ATOM 3132 CZ TYR C 585 60.817 77.491 -58.039 1.00 82.78 C ATOM 3133 OH TYR C 585 60.977 76.293 -57.386 1.00 80.35 O ATOM 3134 N LYS C 586 60.742 84.572 -60.260 1.00 86.59 N ATOM 3135 CA LYS C 586 60.426 85.780 -61.013 1.00 91.90 C ATOM 3136 C LYS C 586 61.603 86.745 -61.180 1.00 97.69 C ATOM 3137 O LYS C 586 61.781 87.328 -62.254 1.00 98.22 O ATOM 3138 CB LYS C 586 59.254 86.512 -60.352 1.00 87.35 C ATOM 3139 N VAL C 587 62.405 86.909 -60.126 1.00103.24 N ATOM 3140 CA VAL C 587 63.555 87.821 -60.161 1.00106.78 C ATOM 3141 C VAL C 587 64.588 87.486 -61.233 1.00109.51 C ATOM 3142 O VAL C 587 64.882 88.381 -62.058 1.00110.36 O ATOM 3143 CB VAL C 587 64.284 87.887 -58.787 1.00106.16 C ATOM 3144 CG1 VAL C 587 63.327 88.385 -57.715 1.00106.64 C ATOM 3145 CG2 VAL C 587 64.849 86.524 -58.416 1.00105.76 C ATOM 3146 OXT VAL C 587 65.097 86.343 -61.235 1.00113.47 O TER 3731 HOH B 101 HETATM 3732 O HOH C 3 61.679 73.018 -54.080 1.00 42.74 O HETATM 3733 O HOH C 5 56.061 78.304 -43.537 1.00 41.71 O HETATM 3734 O HOH C 9 80.481 76.748 -46.775 1.00 48.13 O HETATM 3735 O HOH C 17 57.615 93.409 -50.290 1.00 45.78 O HETATM 3736 O HOH C 18 71.450 68.800 -45.566 1.00 43.84 O HETATM 3737 O HOH C 23 79.796 98.022 -45.898 1.00 51.33 O HETATM 3738 O HOH C 27 83.052 84.716 -52.701 1.00 66.96 O HETATM 3739 O HOH C 28 74.610 70.666 -44.559 1.00 45.26 O CONECT 1952 1951 1953 2661 CONECT 2661 1952 2660 END