USER MOD reduce.3.24.130724 H: found=0, std=0, add=2445, rem=0, adj=98 USER MOD reduce.3.24.130724 removed 0 hydrogens (0 hets) HEADER CONTRACTILE PROTEIN 11-JUL-00 1F9U TITLE CRYSTAL STRUCTURES OF MUTANTS REVEAL A SIGNALLING PATHWAY TITLE 2 FOR ACTIVATION OF THE KINESIN MOTOR ATPASE COMPND MOL_ID: 1; COMPND 2 MOLECULE: KINESIN-LIKE PROTEIN KAR3; COMPND 3 CHAIN: A; COMPND 4 FRAGMENT: N650K MUTANT MOTOR DOMAIN; COMPND 5 ENGINEERED: YES; COMPND 6 MUTATION: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; SOURCE 3 ORGANISM_COMMON: BAKER'S YEAST; SOURCE 4 ORGANISM_TAXID: 4932; SOURCE 5 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 6 EXPRESSION_SYSTEM_TAXID: 562; SOURCE 7 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 8 EXPRESSION_SYSTEM_PLASMID: PMW174; SOURCE 9 OTHER_DETAILS: SACCHAROMYCES CEREVISIAE KEYWDS KAR3, KINESIN-RELATED PROTEIN, MOTOR PROTEIN, MICROTUBULE KEYWDS 2 BINDING PROTEIN, CONTRACTILE PROTEIN EXPDTA X-RAY DIFFRACTION AUTHOR M.YUN,X.ZHANG,C.G.PARK,H.W.PARK,S.A ENDOW REVDAT 4 24-FEB-09 1F9U 1 VERSN REVDAT 3 09-MAY-06 1F9U 1 REMARK REVDAT 2 01-APR-03 1F9U 1 JRNL REVDAT 1 13-JUN-01 1F9U 0 JRNL AUTH M.YUN,X.ZHANG,C.G.PARK,H.W.PARK,S.A.ENDOW JRNL TITL A STRUCTURAL PATHWAY FOR ACTIVATION OF THE KINESIN JRNL TITL 2 MOTOR ATPASE. JRNL REF EMBO J. V. 20 2611 2001 JRNL REFN ISSN 0261-4189 JRNL PMID 11387196 JRNL DOI 10.1093/EMBOJ/20.11.2611 REMARK 1 REMARK 2 REMARK 2 RESOLUTION. 1.70 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : X-PLOR REMARK 3 AUTHORS : BRUNGER REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 1.70 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 20.00 REMARK 3 DATA CUTOFF (SIGMA(F)) : 2.000 REMARK 3 DATA CUTOFF HIGH (ABS(F)) : NULL REMARK 3 DATA CUTOFF LOW (ABS(F)) : NULL REMARK 3 COMPLETENESS (WORKING+TEST) (%) : 86.2 REMARK 3 NUMBER OF REFLECTIONS : 27632 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT. REMARK 3 CROSS-VALIDATION METHOD : NULL REMARK 3 FREE R VALUE TEST SET SELECTION : RANDOM REMARK 3 R VALUE (WORKING SET) : 0.217 REMARK 3 FREE R VALUE : 0.266 REMARK 3 FREE R VALUE TEST SET SIZE (%) : NULL REMARK 3 FREE R VALUE TEST SET COUNT : 2817 REMARK 3 ESTIMATED ERROR OF FREE R VALUE : NULL REMARK 3 REMARK 3 FIT IN THE HIGHEST RESOLUTION BIN. REMARK 3 TOTAL NUMBER OF BINS USED : NULL REMARK 3 BIN RESOLUTION RANGE HIGH (A) : NULL REMARK 3 BIN RESOLUTION RANGE LOW (A) : NULL REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : NULL REMARK 3 REFLECTIONS IN BIN (WORKING SET) : NULL REMARK 3 BIN R VALUE (WORKING SET) : NULL REMARK 3 BIN FREE R VALUE : NULL REMARK 3 BIN FREE R VALUE TEST SET SIZE (%) : NULL REMARK 3 BIN FREE R VALUE TEST SET COUNT : NULL REMARK 3 ESTIMATED ERROR OF BIN FREE R VALUE : NULL REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 2444 REMARK 3 NUCLEIC ACID ATOMS : 0 REMARK 3 HETEROGEN ATOMS : 28 REMARK 3 SOLVENT ATOMS : 209 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : NULL REMARK 3 MEAN B VALUE (OVERALL, A**2) : NULL REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : NULL REMARK 3 B22 (A**2) : NULL REMARK 3 B33 (A**2) : NULL REMARK 3 B12 (A**2) : NULL REMARK 3 B13 (A**2) : NULL REMARK 3 B23 (A**2) : NULL REMARK 3 REMARK 3 ESTIMATED COORDINATE ERROR. REMARK 3 ESD FROM LUZZATI PLOT (A) : NULL REMARK 3 ESD FROM SIGMAA (A) : NULL REMARK 3 LOW RESOLUTION CUTOFF (A) : NULL REMARK 3 REMARK 3 CROSS-VALIDATED ESTIMATED COORDINATE ERROR. REMARK 3 ESD FROM C-V LUZZATI PLOT (A) : NULL REMARK 3 ESD FROM C-V SIGMAA (A) : NULL REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES. REMARK 3 BOND LENGTHS (A) : 0.006 REMARK 3 BOND ANGLES (DEGREES) : 1.19 REMARK 3 DIHEDRAL ANGLES (DEGREES) : NULL REMARK 3 IMPROPER ANGLES (DEGREES) : NULL REMARK 3 REMARK 3 ISOTROPIC THERMAL MODEL : NULL REMARK 3 REMARK 3 ISOTROPIC THERMAL FACTOR RESTRAINTS. RMS SIGMA REMARK 3 MAIN-CHAIN BOND (A**2) : NULL ; NULL REMARK 3 MAIN-CHAIN ANGLE (A**2) : NULL ; NULL REMARK 3 SIDE-CHAIN BOND (A**2) : NULL ; NULL REMARK 3 SIDE-CHAIN ANGLE (A**2) : NULL ; NULL REMARK 3 REMARK 3 NCS MODEL : NULL REMARK 3 REMARK 3 NCS RESTRAINTS. RMS SIGMA/WEIGHT REMARK 3 GROUP 1 POSITIONAL (A) : NULL ; NULL REMARK 3 GROUP 1 B-FACTOR (A**2) : NULL ; NULL REMARK 3 REMARK 3 PARAMETER FILE 1 : NULL REMARK 3 TOPOLOGY FILE 1 : NULL REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 1F9U COMPLIES WITH FORMAT V. 3.15, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 18-JUL-00. REMARK 100 THE RCSB ID CODE IS RCSB011421. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 21-APR-00 REMARK 200 TEMPERATURE (KELVIN) : 100 REMARK 200 PH : 7.0 REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : Y REMARK 200 RADIATION SOURCE : NSLS REMARK 200 BEAMLINE : X4A REMARK 200 X-RAY GENERATOR MODEL : NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 0.97950 REMARK 200 MONOCHROMATOR : NULL REMARK 200 OPTICS : NULL REMARK 200 REMARK 200 DETECTOR TYPE : CCD REMARK 200 DETECTOR MANUFACTURER : NULL REMARK 200 INTENSITY-INTEGRATION SOFTWARE : DENZO REMARK 200 DATA SCALING SOFTWARE : SCALEPACK REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 31822 REMARK 200 RESOLUTION RANGE HIGH (A) : 1.700 REMARK 200 RESOLUTION RANGE LOW (A) : 20.000 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : -3.000 REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 93.5 REMARK 200 DATA REDUNDANCY : 9.720 REMARK 200 R MERGE (I) : 0.06900 REMARK 200 R SYM (I) : NULL REMARK 200 FOR THE DATA SET : 17.5000 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 1.70 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 1.73 REMARK 200 COMPLETENESS FOR SHELL (%) : 89.5 REMARK 200 DATA REDUNDANCY IN SHELL : 2.95 REMARK 200 R MERGE FOR SHELL (I) : NULL REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200 FOR SHELL : NULL REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: NULL REMARK 200 SOFTWARE USED: X-PLOR REMARK 200 STARTING MODEL: NULL REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 38.21 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 1.99 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: HEPES, PEG 2000 ME, ETHYLEN GLYCOL, REMARK 280 MAGNESIUM CHLORIDE, SODIUM CHLORIDE, PH 7.0, VAPOR DIFFUSION, REMARK 280 HANGING DROP, TEMPERATURE 291K 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 39.02000 REMARK 290 SMTRY3 2 0.000000 0.000000 -1.000000 0.00000 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: 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 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 383 REMARK 465 ARG A 384 REMARK 465 ARG A 532 REMARK 465 SER A 533 REMARK 465 ASP A 534 REMARK 465 ASN A 535 REMARK 465 ASN A 536 REMARK 465 ASN A 537 REMARK 465 LYS A 538 REMARK 465 GLU A 539 REMARK 465 ASP A 540 REMARK 465 THR A 541 REMARK 465 SER A 542 REMARK 465 ILE A 543 REMARK 465 GLY A 544 REMARK 465 LEU A 545 REMARK 465 ILE A 633 REMARK 465 ASN A 634 REMARK 465 VAL A 635 REMARK 465 SER A 636 REMARK 465 GLN A 637 REMARK 465 VAL A 638 REMARK 465 VAL A 639 REMARK 465 GLY A 640 REMARK 465 ASP A 641 REMARK 465 ASP A 667 REMARK 465 SER A 668 REMARK 465 THR A 669 REMARK 465 LYS A 670 REMARK 465 ARG A 671 REMARK 465 THR A 723 REMARK 465 ARG A 724 REMARK 465 LEU A 725 REMARK 465 VAL A 726 REMARK 465 SER A 727 REMARK 465 ARG A 728 REMARK 465 LYS A 729 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 O HOH A 38 O HOH A 72 2.01 REMARK 500 O HOH A 267 O HOH A 268 2.02 REMARK 500 O HOH A 171 O HOH A 267 2.05 REMARK 500 O HOH A 72 O HOH A 244 2.13 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 429 62.64 -178.76 REMARK 500 THR A 430 -5.35 -59.07 REMARK 500 PRO A 487 126.15 -39.92 REMARK 500 THR A 590 30.40 -82.07 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 17 DISTANCE = 5.33 ANGSTROMS REMARK 525 HOH A 69 DISTANCE = 5.32 ANGSTROMS REMARK 525 HOH A 109 DISTANCE = 5.55 ANGSTROMS REMARK 525 HOH A 129 DISTANCE = 7.66 ANGSTROMS REMARK 525 HOH A 180 DISTANCE = 7.12 ANGSTROMS REMARK 525 HOH A 184 DISTANCE = 5.05 ANGSTROMS REMARK 525 HOH A 186 DISTANCE = 7.85 ANGSTROMS REMARK 525 HOH A 202 DISTANCE = 5.62 ANGSTROMS REMARK 525 HOH A 203 DISTANCE = 5.08 ANGSTROMS REMARK 525 HOH A 210 DISTANCE = 6.70 ANGSTROMS 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 MG A 997 MG REMARK 620 N RES CSSEQI ATOM REMARK 620 1 THR A 481 OG1 REMARK 620 2 ADP A 999 O2B 83.0 REMARK 620 3 HOH A 4 O 82.8 89.4 REMARK 620 4 HOH A 9 O 85.4 168.3 87.0 REMARK 620 5 HOH A 89 O 161.0 96.2 78.1 94.0 REMARK 620 6 HOH A 138 O 97.2 97.8 172.8 85.8 101.7 REMARK 620 N 1 2 3 4 5 REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE MG A 997 REMARK 800 SITE_IDENTIFIER: AC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE ADP A 999 DBREF 1F9U A 383 729 UNP P17119 KAR3_YEAST 383 729 SEQADV 1F9U MET A 383 UNP P17119 LYS 383 ENGINEERED SEQADV 1F9U LYS A 650 UNP P17119 ASN 650 ENGINEERED SEQRES 1 A 347 MET ARG GLY ASN ILE ARG VAL TYR CYS ARG ILE ARG PRO SEQRES 2 A 347 ALA LEU LYS ASN LEU GLU ASN SER ASP THR SER LEU ILE SEQRES 3 A 347 ASN VAL ASN GLU PHE ASP ASP ASN SER GLY VAL GLN SER SEQRES 4 A 347 MET GLU VAL THR LYS ILE GLN ASN THR ALA GLN VAL HIS SEQRES 5 A 347 GLU PHE LYS PHE ASP LYS ILE PHE ASP GLN GLN ASP THR SEQRES 6 A 347 ASN VAL ASP VAL PHE LYS GLU VAL GLY GLN LEU VAL GLN SEQRES 7 A 347 SER SER LEU ASP GLY TYR ASN VAL CYS ILE PHE ALA TYR SEQRES 8 A 347 GLY GLN THR GLY SER GLY LYS THR PHE THR MET LEU ASN SEQRES 9 A 347 PRO GLY ASP GLY ILE ILE PRO SER THR ILE SER HIS ILE SEQRES 10 A 347 PHE ASN TRP ILE ASN LYS LEU LYS THR LYS GLY TRP ASP SEQRES 11 A 347 TYR LYS VAL ASN CYS GLU PHE ILE GLU ILE TYR ASN GLU SEQRES 12 A 347 ASN ILE VAL ASP LEU LEU ARG SER ASP ASN ASN ASN LYS SEQRES 13 A 347 GLU ASP THR SER ILE GLY LEU LYS HIS GLU ILE ARG HIS SEQRES 14 A 347 ASP GLN GLU THR LYS THR THR THR ILE THR ASN VAL THR SEQRES 15 A 347 SER CYS LYS LEU GLU SER GLU GLU MET VAL GLU ILE ILE SEQRES 16 A 347 LEU LYS LYS ALA ASN LYS LEU ARG SER THR ALA SER THR SEQRES 17 A 347 ALA SER ASN GLU HIS SER SER ARG SER HIS SER ILE PHE SEQRES 18 A 347 ILE ILE HIS LEU SER GLY SER ASN ALA LYS THR GLY ALA SEQRES 19 A 347 HIS SER TYR GLY THR LEU ASN LEU VAL ASP LEU ALA GLY SEQRES 20 A 347 SER GLU ARG ILE ASN VAL SER GLN VAL VAL GLY ASP ARG SEQRES 21 A 347 LEU ARG GLU THR GLN ASN ILE LYS LYS SER LEU SER CYS SEQRES 22 A 347 LEU GLY ASP VAL ILE HIS ALA LEU GLY GLN PRO ASP SER SEQRES 23 A 347 THR LYS ARG HIS ILE PRO PHE ARG ASN SER LYS LEU THR SEQRES 24 A 347 TYR LEU LEU GLN TYR SER LEU THR GLY ASP SER LYS THR SEQRES 25 A 347 LEU MET PHE VAL ASN ILE SER PRO SER SER SER HIS ILE SEQRES 26 A 347 ASN GLU THR LEU ASN SER LEU ARG PHE ALA SER LYS VAL SEQRES 27 A 347 ASN SER THR ARG LEU VAL SER ARG LYS HET MG A 997 1 HET ADP A 999 27 HETNAM MG MAGNESIUM ION HETNAM ADP ADENOSINE-5'-DIPHOSPHATE FORMUL 2 MG MG 2+ FORMUL 3 ADP C10 H15 N5 O10 P2 FORMUL 4 HOH *209(H2 O) HELIX 1 1 GLN A 428 THR A 430 5 3 HELIX 2 2 THR A 447 LYS A 453 1 7 HELIX 3 3 VAL A 455 GLN A 460 1 6 HELIX 4 4 SER A 461 GLY A 465 5 5 HELIX 5 5 GLY A 479 ASN A 486 1 8 HELIX 6 6 GLY A 490 THR A 508 1 19 HELIX 7 7 SER A 570 SER A 586 1 17 HELIX 8 8 SER A 592 ARG A 598 1 7 HELIX 9 9 ARG A 642 GLN A 665 1 24 HELIX 10 10 PRO A 674 ASN A 677 5 4 HELIX 11 11 SER A 678 GLN A 685 1 8 HELIX 12 12 LEU A 684 THR A 689 1 6 HELIX 13 13 SER A 703 SER A 705 5 3 HELIX 14 14 HIS A 706 VAL A 720 1 15 SHEET 1 A 8 LYS A 440 PHE A 442 0 SHEET 2 A 8 ILE A 387 ILE A 393 1 O VAL A 389 N LYS A 440 SHEET 3 A 8 LYS A 693 ILE A 700 1 O THR A 694 N ARG A 388 SHEET 4 A 8 VAL A 468 TYR A 473 1 O CYS A 469 N LEU A 695 SHEET 5 A 8 HIS A 617 ASP A 626 1 O THR A 621 N VAL A 468 SHEET 6 A 8 HIS A 600 ASN A 611 -1 O SER A 601 N ASP A 626 SHEET 7 A 8 TRP A 511 TYR A 523 -1 N ASP A 512 O SER A 610 SHEET 8 A 8 ASN A 526 ASP A 529 -1 O ASN A 526 N TYR A 523 SHEET 1 B 8 LYS A 440 PHE A 442 0 SHEET 2 B 8 ILE A 387 ILE A 393 1 O VAL A 389 N LYS A 440 SHEET 3 B 8 LYS A 693 ILE A 700 1 O THR A 694 N ARG A 388 SHEET 4 B 8 VAL A 468 TYR A 473 1 O CYS A 469 N LEU A 695 SHEET 5 B 8 HIS A 617 ASP A 626 1 O THR A 621 N VAL A 468 SHEET 6 B 8 HIS A 600 ASN A 611 -1 O SER A 601 N ASP A 626 SHEET 7 B 8 TRP A 511 TYR A 523 -1 N ASP A 512 O SER A 610 SHEET 8 B 8 CYS A 566 LYS A 567 -1 N CYS A 566 O CYS A 517 SHEET 1 C 3 SER A 406 VAL A 410 0 SHEET 2 C 3 GLN A 420 LYS A 426 -1 O GLU A 423 N ASN A 409 SHEET 3 C 3 VAL A 433 PHE A 438 -1 N HIS A 434 O VAL A 424 SHEET 1 D 2 ILE A 549 ASP A 552 0 SHEET 2 D 2 THR A 557 ILE A 560 -1 O THR A 557 N ASP A 552 LINK MG MG A 997 OG1 THR A 481 1555 1555 2.27 LINK MG MG A 997 O2B ADP A 999 1555 1555 2.27 LINK MG MG A 997 O HOH A 4 1555 1555 2.45 LINK MG MG A 997 O HOH A 9 1555 1555 2.31 LINK MG MG A 997 O HOH A 89 1555 1555 2.22 LINK MG MG A 997 O HOH A 138 1555 1555 2.31 SITE *** AC1 6 HOH A 4 HOH A 9 HOH A 89 HOH A 138 SITE *** AC1 6 THR A 481 ADP A 999 SITE *** AC2 21 HOH A 69 HOH A 79 HOH A 88 HOH A 89 SITE *** AC2 21 HOH A 124 HOH A 129 HOH A 138 HOH A 145 SITE *** AC2 21 ARG A 392 ARG A 394 PRO A 395 GLN A 475 SITE *** AC2 21 THR A 476 GLY A 477 SER A 478 GLY A 479 SITE *** AC2 21 LYS A 480 THR A 481 PHE A 482 THR A 587 SITE *** AC2 21 MG A 997 CRYST1 43.570 78.040 47.270 90.00 105.07 90.00 P 1 21 1 2 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 0.022952 0.000000 0.006180 0.00000 SCALE2 0.000000 0.012814 0.000000 0.00000 SCALE3 0.000000 0.000000 0.021909 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 Set 1.1: A 406 SER OG : rot 113:sc= 2.41 USER MOD Set 1.2: A 704 SER OG : rot -25:sc= 0.782 USER MOD Set 2.1: A 703 SER OG : rot -116:sc= -1.66! USER MOD Set 2.2: A 705 SER OG : rot 80:sc= 1.14 USER MOD Set 3.1: A 701 SER OG : rot 179:sc= 1.38 USER MOD Set 3.2: A 706 HIS : no HD1:sc= 0.547 K(o=1.9,f=-7.7!) USER MOD Set 4.1: A 483 THR OG1 : rot 88:sc= 0.732 USER MOD Set 4.2: A 699 ASN : amide:sc= 0.559 X(o=1.3,f=1.4) USER MOD Set 5.1: A 661 HIS : +bothHN:sc= -1.9! C(o=-3.2!,f=-11!) USER MOD Set 5.2: A 665 GLN : amide:sc= -1.31! C(o=-3.2!,f=-3.2!) USER MOD Set 6.1: A 655 CYS SG : rot -137:sc= 0.0802 USER MOD Set 6.2: A 678 SER OG : rot -35:sc= 2.17 USER MOD Set 6.3: A 681 THR OG1 : rot 75:sc= 2.25 USER MOD Set 7.1: A 600 HIS : no HD1:sc= 0.96 K(o=3.8,f=-4.9!) USER MOD Set 7.2: A 652 SER OG : rot 37:sc= 2.85 USER MOD Set 8.1: A 524 ASN : amide:sc= 0.356 K(o=0.7,f=-1.6) USER MOD Set 8.2: A 648 ASN : amide:sc= 0.344 K(o=0.7,f=-1.6!) USER MOD Set 9.1: A 606 HIS : no HD1:sc= 0.939 K(o=2.5,f=-4.7!) USER MOD Set 9.2: A 619 TYR OH : rot 180:sc= -0.161 USER MOD Set 9.3: A 621 THR OG1 : rot -98:sc= 1.73 USER MOD Set10.1: A 582 ASN : amide:sc= 0.356 K(o=2,f=-3.1) USER MOD Set10.2: A 586 SER OG : rot 105:sc= 1.69 USER MOD Set11.1: A 551 HIS : no HD1:sc= 0.579 K(o=2.4,f=-5.9!) USER MOD Set11.2: A 558 THR OG1 : rot -88:sc= 1.8 USER MOD Set11.3: A 682 TYR OH : rot 180:sc= 0.00588 USER MOD Set12.1: A 555 THR OG1 : rot 119:sc= 1.24 USER MOD Set12.2: A 557 THR OG1 : rot 180:sc= 1.13 USER MOD Set13.1: A 553 GLN : amide:sc= 0.107 X(o=0.21,f=0) USER MOD Set13.2: A 686 TYR OH : rot 90:sc= 0.101 USER MOD Set14.1: A 516 ASN :FLIP amide:sc= 0.112 F(o=-0.88!,f=1.3) USER MOD Set14.2: A 565 SER OG : rot 87:sc= 1.21 USER MOD Set15.1: A 504 ASN : amide:sc= 1.11 K(o=2.4,f=-8.2!) USER MOD Set15.2: A 507 LYS NZ :NH3+ -143:sc= 1.29 (180deg=0) USER MOD Set16.1: A 469 CYS SG : rot 106:sc= -0.283 USER MOD Set16.2: A 623 ASN : amide:sc= 0.0328 X(o=0.99,f=0.78) USER MOD Set16.3: A 687 SER OG : rot -166:sc= 1.24 USER MOD Set17.1: A 460 GLN : amide:sc= 0.172 K(o=1.7,f=0.79) USER MOD Set17.2: A 498 HIS : no HD1:sc= 1.53 K(o=1.7,f=-5.1!) USER MOD Set18.1: A 426 LYS NZ :NH3+ 164:sc= 0.775 (180deg=0) USER MOD Set18.2: A 708 ASN :FLIP amide:sc= 0.584 F(o=-7.4!,f=1.4) USER MOD Single : A 386 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 390 TYR OH : rot 180:sc= 0 USER MOD Single : A 391 CYS SG : rot -171:sc= 0.0213 USER MOD Single : A 398 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 399 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 402 ASN :FLIP amide:sc= -0.669 F(o=-9.6!,f=-0.67) USER MOD Single : A 403 SER OG : rot -43:sc= 2.63 USER MOD Single : A 405 THR OG1 : rot 180:sc= -0.113 USER MOD Single : A 409 ASN : amide:sc= -0.245 X(o=-0.24,f=0.0084) USER MOD Single : A 411 ASN : amide:sc= -0.0117 K(o=-0.012,f=-1.2) USER MOD Single : A 416 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 417 SER OG : rot 180:sc= 0 USER MOD Single : A 420 GLN : amide:sc= 0.334 K(o=0.33,f=-2.1) USER MOD Single : A 421 SER OG : rot 180:sc= 0 USER MOD Single : A 422 MET CE :methyl -136:sc= 0 (180deg=-0.0496) USER MOD Single : A 425 THR OG1 : rot 82:sc= 1.28 USER MOD Single : A 428 GLN :FLIP amide:sc= -7.09! C(o=-12!,f=-7.1!) USER MOD Single : A 429 ASN : amide:sc= -1.58 X(o=-1.6,f=-1.1) USER MOD Single : A 430 THR OG1 : rot 180:sc= 0.00767 USER MOD Single : A 432 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 434 HIS : no HD1:sc= 0 X(o=0,f=-0.2) USER MOD Single : A 437 LYS NZ :NH3+ 165:sc= -0.0695 (180deg=-0.274) USER MOD Single : A 440 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 444 GLN : amide:sc= 0.402 K(o=0.4,f=-2.6!) USER MOD Single : A 445 GLN : amide:sc= 0 K(o=0,f=-0.77) USER MOD Single : A 447 THR OG1 : rot 180:sc= 0.113 USER MOD Single : A 448 ASN : amide:sc= -1.26! C(o=-1.3!,f=-7.3!) USER MOD Single : A 453 LYS NZ :NH3+ -125:sc= 0.0541 (180deg=0) USER MOD Single : A 457 GLN : amide:sc= 0 X(o=0,f=-0.024) USER MOD Single : A 461 SER OG : rot -81:sc= 1.17 USER MOD Single : A 462 SER OG : rot -41:sc= -1.98! USER MOD Single : A 466 TYR OH : rot 180:sc= 0 USER MOD Single : A 467 ASN : amide:sc= 2.4 K(o=2.4,f=-2.9!) USER MOD Single : A 473 TYR OH : rot 168:sc= 2.49 USER MOD Single : A 475 GLN :FLIP amide:sc= 0.346 F(o=-1.4!,f=0.35) USER MOD Single : A 476 THR OG1 : rot 130:sc= 1.95 USER MOD Single : A 478 SER OG : rot -81:sc= 1.18 USER MOD Single : A 480 LYS NZ :NH3+ -158:sc= 2.26 (180deg=1.51) USER MOD Single : A 484 MET CE :methyl -168:sc= -1.84 (180deg=-2.56) USER MOD Single : A 486 ASN : amide:sc= 0.201 X(o=0.2,f=0.54) USER MOD Single : A 494 SER OG : rot 96:sc= 0.897 USER MOD Single : A 495 THR OG1 : rot 97:sc= 1.31 USER MOD Single : A 497 SER OG : rot 77:sc= 0.0109 USER MOD Single : A 501 ASN : amide:sc= 0.826 K(o=0.83,f=-0.16) USER MOD Single : A 505 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 508 THR OG1 : rot 180:sc= 0 USER MOD Single : A 509 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 513 TYR OH : rot -31:sc= 0.961 USER MOD Single : A 514 LYS NZ :NH3+ -169:sc= -1.28! (180deg=-1.3!) USER MOD Single : A 517 CYS SG : rot 180:sc= 0 USER MOD Single : A 523 TYR OH : rot -55:sc= 0.878 USER MOD Single : A 526 ASN :FLIP amide:sc= 0.608 F(o=-1.2!,f=0.61) USER MOD Single : A 546 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 547 HIS : no HE2:sc= 1.1 K(o=1.1,f=-3.6!) USER MOD Single : A 556 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 559 THR OG1 : rot 140:sc= 0.00235 USER MOD Single : A 561 THR OG1 : rot 180:sc= 0.415 USER MOD Single : A 562 ASN : amide:sc= 0.745 K(o=0.75,f=-0.52) USER MOD Single : A 564 THR OG1 : rot 73:sc= 1.28 USER MOD Single : A 566 CYS SG : rot 180:sc= 0 USER MOD Single : A 567 LYS NZ :NH3+ -161:sc= 0.151 (180deg=0.0609) USER MOD Single : A 570 SER OG : rot 180:sc= 0.579 USER MOD Single : A 573 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 579 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 580 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 583 LYS NZ :NH3+ 166:sc= -0.0171 (180deg=-0.114) USER MOD Single : A 587 THR OG1 : rot -133:sc= 0.028 USER MOD Single : A 589 SER OG : rot 180:sc= 0 USER MOD Single : A 590 THR OG1 : rot 180:sc= 0 USER MOD Single : A 592 SER OG : rot 180:sc= 0 USER MOD Single : A 593 ASN : amide:sc= 0.796 X(o=0.8,f=0.73) USER MOD Single : A 595 HIS : no HD1:sc= -0.654! C(o=-0.65!,f=-5.5!) USER MOD Single : A 596 SER OG : rot 72:sc= 1.72 USER MOD Single : A 597 SER OG : rot -58:sc= 1.38 USER MOD Single : A 599 SER OG : rot 162:sc= 1.02 USER MOD Single : A 601 SER OG : rot 91:sc= 0.0611 USER MOD Single : A 608 SER OG : rot -94:sc= 1.05 USER MOD Single : A 610 SER OG : rot 180:sc= 0 USER MOD Single : A 611 ASN : amide:sc= -2.74! C(o=-2.7!,f=-6!) USER MOD Single : A 613 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 614 THR OG1 : rot 180:sc= 0 USER MOD Single : A 617 HIS : no HD1:sc= -0.158 X(o=-0.16,f=0.07) USER MOD Single : A 618 SER OG : rot -100:sc= 1.31 USER MOD Single : A 630 SER OG : rot -172:sc= 1.04 USER MOD Single : A 646 THR OG1 : rot 78:sc= 0.385 USER MOD Single : A 647 GLN : amide:sc= -0.975 X(o=-0.97,f=-0.79) USER MOD Single : A 650 LYS NZ :NH3+ -172:sc= 0.112 (180deg=0.0532) USER MOD Single : A 651 LYS NZ :NH3+ -160:sc= 0.112 (180deg=0.0287) USER MOD Single : A 654 SER OG : rot 180:sc= 0 USER MOD Single : A 672 HIS :FLIP no HE2:sc= -0.125 F(o=-0.76,f=-0.12) USER MOD Single : A 677 ASN : amide:sc= -0.0759 K(o=-0.076,f=-1.3!) USER MOD Single : A 679 LYS NZ :NH3+ -115:sc= 1.07 (180deg=-1.22!) USER MOD Single : A 685 GLN :FLIP amide:sc= 0.625 F(o=-0.47,f=0.62) USER MOD Single : A 689 THR OG1 : rot -76:sc= 1.26 USER MOD Single : A 692 SER OG : rot 79:sc= 1.73 USER MOD Single : A 693 LYS NZ :NH3+ -165:sc= -0.241 (180deg=-0.781) USER MOD Single : A 694 THR OG1 : rot 87:sc= 1.17 USER MOD Single : A 696 MET CE :methyl -123:sc= -6.01! (180deg=-14.1!) USER MOD Single : A 710 THR OG1 : rot 156:sc= 2.3 USER MOD Single : A 712 ASN : amide:sc= 0.697 K(o=0.7,f=-0.84) USER MOD Single : A 713 SER OG : rot 159:sc= 2.42 USER MOD Single : A 718 SER OG : rot 70:sc= 0.146 USER MOD Single : A 719 LYS NZ :NH3+ 151:sc= 0.129 (180deg=-0.186) USER MOD Single : A 721 ASN : amide:sc= -1.34 K(o=-1.3,f=-4!) USER MOD Single : A 722 SER OG : rot 180:sc= 0 USER MOD Single : A 999 ADP O2' : rot -164:sc= 0.0177 USER MOD Single : A 999 ADP O3' : rot 132:sc= 0.0853 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 385 2.483 -15.604 14.831 1.00 45.28 N ATOM 2 CA GLY A 385 1.174 -16.262 15.117 1.00 44.63 C ATOM 3 C GLY A 385 0.116 -15.956 14.069 1.00 44.26 C ATOM 4 O GLY A 385 0.382 -16.009 12.868 1.00 46.50 O ATOM 0 HA2 GLY A 385 1.304 -17.222 15.168 1.00 44.63 H new ATOM 0 HA3 GLY A 385 0.855 -15.973 15.986 1.00 44.63 H new ATOM 5 N ASN A 386 -1.080 -15.607 14.526 1.00 41.62 N ATOM 6 CA ASN A 386 -2.189 -15.316 13.631 1.00 37.86 C ATOM 7 C ASN A 386 -2.167 -13.938 12.981 1.00 32.60 C ATOM 8 O ASN A 386 -1.843 -12.938 13.616 1.00 30.58 O ATOM 9 CB ASN A 386 -3.504 -15.486 14.393 1.00 41.86 C ATOM 10 CG ASN A 386 -4.410 -16.519 13.763 1.00 44.89 C ATOM 11 OD1 ASN A 386 -5.217 -16.197 12.891 1.00 48.42 O ATOM 12 ND2 ASN A 386 -4.281 -17.774 14.199 1.00 44.90 N ATOM 0 H ASN A 386 -1.270 -15.533 15.361 1.00 41.62 H new ATOM 0 HA ASN A 386 -2.101 -15.947 12.900 1.00 37.86 H new ATOM 0 HB2 ASN A 386 -3.313 -15.743 15.308 1.00 41.86 H new ATOM 0 HB3 ASN A 386 -3.966 -14.634 14.429 1.00 41.86 H new ATOM 0 HD21 ASN A 386 -4.774 -18.397 13.869 1.00 44.90 H new ATOM 0 HD22 ASN A 386 -3.705 -17.960 14.810 1.00 44.90 H new ATOM 13 N ILE A 387 -2.517 -13.907 11.700 1.00 27.79 N ATOM 14 CA ILE A 387 -2.602 -12.667 10.936 1.00 23.31 C ATOM 15 C ILE A 387 -4.043 -12.563 10.451 1.00 22.36 C ATOM 16 O ILE A 387 -4.542 -13.458 9.771 1.00 21.11 O ATOM 17 CB ILE A 387 -1.674 -12.673 9.704 1.00 23.52 C ATOM 18 CG1 ILE A 387 -0.208 -12.752 10.157 1.00 24.11 C ATOM 19 CG2 ILE A 387 -1.962 -11.443 8.848 1.00 21.10 C ATOM 20 CD1 ILE A 387 0.690 -11.667 9.611 1.00 28.78 C ATOM 0 H ILE A 387 -2.713 -14.610 11.246 1.00 27.79 H new ATOM 0 HA ILE A 387 -2.332 -11.924 11.497 1.00 23.31 H new ATOM 0 HB ILE A 387 -1.843 -13.455 9.155 1.00 23.52 H new ATOM 0 HG12 ILE A 387 -0.181 -12.718 11.126 1.00 24.11 H new ATOM 0 HG13 ILE A 387 0.152 -13.613 9.893 1.00 24.11 H new ATOM 0 HG21 ILE A 387 -1.379 -11.445 8.072 1.00 21.10 H new ATOM 0 HG22 ILE A 387 -2.887 -11.460 8.557 1.00 21.10 H new ATOM 0 HG23 ILE A 387 -1.803 -10.641 9.370 1.00 21.10 H new ATOM 0 HD11 ILE A 387 1.591 -11.794 9.946 1.00 28.78 H new ATOM 0 HD12 ILE A 387 0.697 -11.710 8.642 1.00 28.78 H new ATOM 0 HD13 ILE A 387 0.359 -10.800 9.894 1.00 28.78 H new ATOM 21 N ARG A 388 -4.713 -11.480 10.818 1.00 20.99 N ATOM 22 CA ARG A 388 -6.098 -11.275 10.417 1.00 20.49 C ATOM 23 C ARG A 388 -6.254 -9.945 9.703 1.00 16.51 C ATOM 24 O ARG A 388 -5.525 -8.992 9.967 1.00 14.46 O ATOM 25 CB ARG A 388 -7.016 -11.291 11.645 1.00 23.53 C ATOM 26 CG ARG A 388 -7.051 -12.611 12.380 1.00 30.16 C ATOM 27 CD ARG A 388 -7.927 -13.605 11.651 1.00 36.48 C ATOM 28 NE ARG A 388 -8.517 -14.592 12.551 1.00 43.97 N ATOM 29 CZ ARG A 388 -9.631 -14.400 13.255 1.00 48.19 C ATOM 30 NH1 ARG A 388 -10.086 -15.364 14.047 1.00 49.45 N ATOM 31 NH2 ARG A 388 -10.291 -13.248 13.174 1.00 45.73 N ATOM 0 H ARG A 388 -4.383 -10.849 11.301 1.00 20.99 H new ATOM 0 HA ARG A 388 -6.346 -11.995 9.816 1.00 20.49 H new ATOM 0 HB2 ARG A 388 -6.728 -10.598 12.260 1.00 23.53 H new ATOM 0 HB3 ARG A 388 -7.917 -11.065 11.365 1.00 23.53 H new ATOM 0 HG2 ARG A 388 -6.152 -12.965 12.462 1.00 30.16 H new ATOM 0 HG3 ARG A 388 -7.386 -12.477 13.280 1.00 30.16 H new ATOM 0 HD2 ARG A 388 -8.634 -13.130 11.188 1.00 36.48 H new ATOM 0 HD3 ARG A 388 -7.401 -14.061 10.975 1.00 36.48 H new ATOM 0 HE ARG A 388 -8.118 -15.349 12.632 1.00 43.97 H new ATOM 0 HH11 ARG A 388 -9.661 -16.110 14.104 1.00 49.45 H new ATOM 0 HH12 ARG A 388 -10.805 -15.243 14.503 1.00 49.45 H new ATOM 0 HH21 ARG A 388 -9.999 -12.620 12.664 1.00 45.73 H new ATOM 0 HH22 ARG A 388 -11.010 -13.131 13.632 1.00 45.73 H new ATOM 32 N VAL A 389 -7.223 -9.880 8.801 1.00 16.28 N ATOM 33 CA VAL A 389 -7.495 -8.652 8.067 1.00 13.94 C ATOM 34 C VAL A 389 -8.996 -8.353 8.148 1.00 11.62 C ATOM 35 O VAL A 389 -9.821 -9.221 7.883 1.00 11.29 O ATOM 36 CB VAL A 389 -7.079 -8.790 6.586 1.00 16.86 C ATOM 37 CG1 VAL A 389 -7.152 -7.429 5.888 1.00 17.60 C ATOM 38 CG2 VAL A 389 -5.667 -9.359 6.502 1.00 16.28 C ATOM 0 H VAL A 389 -7.737 -10.539 8.598 1.00 16.28 H new ATOM 0 HA VAL A 389 -6.982 -7.929 8.461 1.00 13.94 H new ATOM 0 HB VAL A 389 -7.689 -9.396 6.137 1.00 16.86 H new ATOM 0 HG11 VAL A 389 -6.889 -7.527 4.959 1.00 17.60 H new ATOM 0 HG12 VAL A 389 -8.060 -7.091 5.933 1.00 17.60 H new ATOM 0 HG13 VAL A 389 -6.553 -6.806 6.329 1.00 17.60 H new ATOM 0 HG21 VAL A 389 -5.407 -9.445 5.571 1.00 16.28 H new ATOM 0 HG22 VAL A 389 -5.050 -8.763 6.956 1.00 16.28 H new ATOM 0 HG23 VAL A 389 -5.644 -10.231 6.926 1.00 16.28 H new ATOM 39 N TYR A 390 -9.319 -7.125 8.537 1.00 12.73 N ATOM 40 CA TYR A 390 -10.694 -6.647 8.661 1.00 12.17 C ATOM 41 C TYR A 390 -10.859 -5.455 7.742 1.00 13.14 C ATOM 42 O TYR A 390 -9.938 -4.674 7.566 1.00 13.08 O ATOM 43 CB TYR A 390 -10.984 -6.135 10.072 1.00 9.78 C ATOM 44 CG TYR A 390 -11.039 -7.159 11.176 1.00 9.09 C ATOM 45 CD1 TYR A 390 -10.976 -8.520 10.912 1.00 5.38 C ATOM 46 CD2 TYR A 390 -11.165 -6.750 12.503 1.00 12.84 C ATOM 47 CE1 TYR A 390 -11.037 -9.452 11.933 1.00 9.35 C ATOM 48 CE2 TYR A 390 -11.227 -7.679 13.542 1.00 11.56 C ATOM 49 CZ TYR A 390 -11.161 -9.025 13.248 1.00 10.74 C ATOM 50 OH TYR A 390 -11.206 -9.946 14.271 1.00 15.93 O ATOM 0 H TYR A 390 -8.732 -6.531 8.741 1.00 12.73 H new ATOM 0 HA TYR A 390 -11.289 -7.383 8.447 1.00 12.17 H new ATOM 0 HB2 TYR A 390 -10.304 -5.482 10.301 1.00 9.78 H new ATOM 0 HB3 TYR A 390 -11.833 -5.666 10.054 1.00 9.78 H new ATOM 0 HD1 TYR A 390 -10.891 -8.811 10.033 1.00 5.38 H new ATOM 0 HD2 TYR A 390 -11.208 -5.842 12.699 1.00 12.84 H new ATOM 0 HE1 TYR A 390 -10.995 -10.361 11.739 1.00 9.35 H new ATOM 0 HE2 TYR A 390 -11.312 -7.394 14.423 1.00 11.56 H new ATOM 0 HH TYR A 390 -11.281 -9.546 15.006 1.00 15.93 H new ATOM 51 N CYS A 391 -12.039 -5.298 7.161 1.00 13.51 N ATOM 52 CA CYS A 391 -12.283 -4.139 6.320 1.00 12.59 C ATOM 53 C CYS A 391 -13.324 -3.325 7.068 1.00 10.80 C ATOM 54 O CYS A 391 -14.206 -3.897 7.704 1.00 12.10 O ATOM 55 CB CYS A 391 -12.830 -4.554 4.956 1.00 13.17 C ATOM 56 SG CYS A 391 -13.414 -3.144 4.005 1.00 15.33 S ATOM 0 H CYS A 391 -12.701 -5.841 7.239 1.00 13.51 H new ATOM 0 HA CYS A 391 -11.467 -3.642 6.154 1.00 12.59 H new ATOM 0 HB2 CYS A 391 -12.137 -5.014 4.457 1.00 13.17 H new ATOM 0 HB3 CYS A 391 -13.557 -5.184 5.078 1.00 13.17 H new ATOM 0 HG CYS A 391 -13.993 -3.532 3.028 1.00 15.33 H new ATOM 57 N ARG A 392 -13.204 -2.005 7.037 1.00 10.58 N ATOM 58 CA ARG A 392 -14.180 -1.172 7.713 1.00 12.16 C ATOM 59 C ARG A 392 -14.674 -0.048 6.830 1.00 13.71 C ATOM 60 O ARG A 392 -13.911 0.840 6.442 1.00 9.75 O ATOM 61 CB ARG A 392 -13.627 -0.565 9.004 1.00 13.69 C ATOM 62 CG ARG A 392 -14.734 -0.198 9.981 1.00 14.38 C ATOM 63 CD ARG A 392 -14.438 1.046 10.795 1.00 15.62 C ATOM 64 NE ARG A 392 -15.584 1.422 11.625 1.00 13.84 N ATOM 65 CZ ARG A 392 -15.499 1.947 12.845 1.00 19.09 C ATOM 66 NH1 ARG A 392 -14.313 2.171 13.407 1.00 14.88 N ATOM 67 NH2 ARG A 392 -16.607 2.264 13.503 1.00 14.32 N ATOM 0 H ARG A 392 -12.574 -1.579 6.636 1.00 10.58 H new ATOM 0 HA ARG A 392 -14.919 -1.762 7.928 1.00 12.16 H new ATOM 0 HB2 ARG A 392 -13.022 -1.196 9.424 1.00 13.69 H new ATOM 0 HB3 ARG A 392 -13.108 0.227 8.792 1.00 13.69 H new ATOM 0 HG2 ARG A 392 -15.559 -0.064 9.488 1.00 14.38 H new ATOM 0 HG3 ARG A 392 -14.882 -0.943 10.585 1.00 14.38 H new ATOM 0 HD2 ARG A 392 -13.665 0.890 11.359 1.00 15.62 H new ATOM 0 HD3 ARG A 392 -14.212 1.778 10.200 1.00 15.62 H new ATOM 0 HE ARG A 392 -16.370 1.294 11.300 1.00 13.84 H new ATOM 0 HH11 ARG A 392 -13.592 1.976 12.981 1.00 14.88 H new ATOM 0 HH12 ARG A 392 -14.268 2.511 14.196 1.00 14.88 H new ATOM 0 HH21 ARG A 392 -17.375 2.130 13.141 1.00 14.32 H new ATOM 0 HH22 ARG A 392 -16.557 2.603 14.292 1.00 14.32 H new ATOM 68 N ILE A 393 -15.966 -0.093 6.513 1.00 13.24 N ATOM 69 CA ILE A 393 -16.584 0.945 5.704 1.00 13.38 C ATOM 70 C ILE A 393 -17.213 1.952 6.651 1.00 12.48 C ATOM 71 O ILE A 393 -18.146 1.617 7.386 1.00 15.16 O ATOM 72 CB ILE A 393 -17.686 0.375 4.801 1.00 14.97 C ATOM 73 CG1 ILE A 393 -17.150 -0.836 4.030 1.00 15.20 C ATOM 74 CG2 ILE A 393 -18.201 1.476 3.881 1.00 15.12 C ATOM 75 CD1 ILE A 393 -18.232 -1.728 3.456 1.00 16.02 C ATOM 0 H ILE A 393 -16.501 -0.720 6.759 1.00 13.24 H new ATOM 0 HA ILE A 393 -15.908 1.349 5.138 1.00 13.38 H new ATOM 0 HB ILE A 393 -18.435 0.064 5.333 1.00 14.97 H new ATOM 0 HG12 ILE A 393 -16.584 -0.523 3.307 1.00 15.20 H new ATOM 0 HG13 ILE A 393 -16.590 -1.362 4.621 1.00 15.20 H new ATOM 0 HG21 ILE A 393 -18.898 1.120 3.308 1.00 15.12 H new ATOM 0 HG22 ILE A 393 -18.561 2.202 4.415 1.00 15.12 H new ATOM 0 HG23 ILE A 393 -17.472 1.808 3.334 1.00 15.12 H new ATOM 0 HD11 ILE A 393 -17.823 -2.470 2.984 1.00 16.02 H new ATOM 0 HD12 ILE A 393 -18.786 -2.069 4.176 1.00 16.02 H new ATOM 0 HD13 ILE A 393 -18.781 -1.217 2.841 1.00 16.02 H new ATOM 76 N ARG A 394 -16.706 3.178 6.638 1.00 12.95 N ATOM 77 CA ARG A 394 -17.217 4.217 7.513 1.00 15.12 C ATOM 78 C ARG A 394 -18.508 4.814 6.971 1.00 18.25 C ATOM 79 O ARG A 394 -18.773 4.745 5.766 1.00 16.32 O ATOM 80 CB ARG A 394 -16.179 5.330 7.675 1.00 16.23 C ATOM 81 CG ARG A 394 -15.910 6.155 6.421 1.00 12.40 C ATOM 82 CD ARG A 394 -15.403 7.545 6.795 1.00 15.37 C ATOM 83 NE ARG A 394 -14.877 8.290 5.652 1.00 13.51 N ATOM 84 CZ ARG A 394 -15.629 8.925 4.753 1.00 18.96 C ATOM 85 NH1 ARG A 394 -16.956 8.912 4.855 1.00 14.06 N ATOM 86 NH2 ARG A 394 -15.054 9.573 3.749 1.00 12.78 N ATOM 0 H ARG A 394 -16.062 3.428 6.126 1.00 12.95 H new ATOM 0 HA ARG A 394 -17.401 3.810 8.374 1.00 15.12 H new ATOM 0 HB2 ARG A 394 -16.474 5.927 8.380 1.00 16.23 H new ATOM 0 HB3 ARG A 394 -15.344 4.934 7.969 1.00 16.23 H new ATOM 0 HG2 ARG A 394 -15.255 5.705 5.865 1.00 12.40 H new ATOM 0 HG3 ARG A 394 -16.723 6.231 5.897 1.00 12.40 H new ATOM 0 HD2 ARG A 394 -16.127 8.050 7.198 1.00 15.37 H new ATOM 0 HD3 ARG A 394 -14.708 7.460 7.466 1.00 15.37 H new ATOM 0 HE ARG A 394 -14.023 8.321 5.553 1.00 13.51 H new ATOM 0 HH11 ARG A 394 -17.333 8.492 5.504 1.00 14.06 H new ATOM 0 HH12 ARG A 394 -17.436 9.323 4.272 1.00 14.06 H new ATOM 0 HH21 ARG A 394 -14.197 9.583 3.678 1.00 12.78 H new ATOM 0 HH22 ARG A 394 -15.538 9.983 3.168 1.00 12.78 H new ATOM 87 N PRO A 395 -19.339 5.386 7.857 1.00 18.79 N ATOM 88 CA PRO A 395 -20.597 5.997 7.428 1.00 19.66 C ATOM 89 C PRO A 395 -20.283 7.139 6.461 1.00 20.78 C ATOM 90 O PRO A 395 -19.311 7.878 6.654 1.00 20.50 O ATOM 91 CB PRO A 395 -21.218 6.513 8.725 1.00 18.47 C ATOM 92 CG PRO A 395 -20.531 5.764 9.809 1.00 17.55 C ATOM 93 CD PRO A 395 -19.159 5.481 9.319 1.00 17.22 C ATOM 0 HA PRO A 395 -21.196 5.391 6.965 1.00 19.66 H new ATOM 0 HB2 PRO A 395 -21.086 7.469 8.821 1.00 18.47 H new ATOM 0 HB3 PRO A 395 -22.175 6.356 8.742 1.00 18.47 H new ATOM 0 HG2 PRO A 395 -20.505 6.285 10.627 1.00 17.55 H new ATOM 0 HG3 PRO A 395 -21.002 4.941 10.012 1.00 17.55 H new ATOM 0 HD2 PRO A 395 -18.539 6.188 9.559 1.00 17.22 H new ATOM 0 HD3 PRO A 395 -18.808 4.657 9.692 1.00 17.22 H new ATOM 94 N ALA A 396 -21.088 7.272 5.415 1.00 21.79 N ATOM 95 CA ALA A 396 -20.878 8.332 4.439 1.00 21.67 C ATOM 96 C ALA A 396 -21.069 9.698 5.083 1.00 23.06 C ATOM 97 O ALA A 396 -21.946 9.883 5.926 1.00 21.51 O ATOM 98 CB ALA A 396 -21.847 8.169 3.273 1.00 21.22 C ATOM 0 H ALA A 396 -21.760 6.761 5.252 1.00 21.79 H new ATOM 0 HA ALA A 396 -19.968 8.269 4.109 1.00 21.67 H new ATOM 0 HB1 ALA A 396 -21.700 8.879 2.628 1.00 21.22 H new ATOM 0 HB2 ALA A 396 -21.699 7.310 2.847 1.00 21.22 H new ATOM 0 HB3 ALA A 396 -22.759 8.214 3.601 1.00 21.22 H new ATOM 99 N LEU A 397 -20.225 10.650 4.707 1.00 25.97 N ATOM 100 CA LEU A 397 -20.354 11.996 5.231 1.00 29.38 C ATOM 101 C LEU A 397 -21.355 12.639 4.281 1.00 34.51 C ATOM 102 O LEU A 397 -20.983 13.196 3.247 1.00 34.19 O ATOM 103 CB LEU A 397 -19.006 12.728 5.194 1.00 28.24 C ATOM 104 CG LEU A 397 -17.848 12.056 5.950 1.00 26.40 C ATOM 105 CD1 LEU A 397 -16.535 12.694 5.537 1.00 27.13 C ATOM 106 CD2 LEU A 397 -18.036 12.189 7.447 1.00 26.59 C ATOM 0 H LEU A 397 -19.576 10.536 4.154 1.00 25.97 H new ATOM 0 HA LEU A 397 -20.639 12.022 6.158 1.00 29.38 H new ATOM 0 HB2 LEU A 397 -18.743 12.836 4.267 1.00 28.24 H new ATOM 0 HB3 LEU A 397 -19.132 13.618 5.558 1.00 28.24 H new ATOM 0 HG LEU A 397 -17.836 11.112 5.726 1.00 26.40 H new ATOM 0 HD11 LEU A 397 -15.805 12.270 6.014 1.00 27.13 H new ATOM 0 HD12 LEU A 397 -16.406 12.581 4.582 1.00 27.13 H new ATOM 0 HD13 LEU A 397 -16.554 13.640 5.750 1.00 27.13 H new ATOM 0 HD21 LEU A 397 -17.297 11.760 7.906 1.00 26.59 H new ATOM 0 HD22 LEU A 397 -18.064 13.128 7.688 1.00 26.59 H new ATOM 0 HD23 LEU A 397 -18.868 11.764 7.708 1.00 26.59 H new ATOM 107 N LYS A 398 -22.634 12.524 4.621 1.00 38.95 N ATOM 108 CA LYS A 398 -23.695 13.071 3.786 1.00 44.83 C ATOM 109 C LYS A 398 -23.514 14.564 3.529 1.00 46.61 C ATOM 110 O LYS A 398 -22.909 15.271 4.335 1.00 47.92 O ATOM 111 CB LYS A 398 -25.064 12.802 4.428 1.00 47.73 C ATOM 112 CG LYS A 398 -25.762 11.534 3.909 1.00 50.22 C ATOM 113 CD LYS A 398 -27.290 11.653 3.985 1.00 53.49 C ATOM 114 CE LYS A 398 -27.987 10.894 2.852 1.00 53.97 C ATOM 115 NZ LYS A 398 -29.394 11.348 2.638 1.00 51.22 N ATOM 0 H LYS A 398 -22.909 12.131 5.335 1.00 38.95 H new ATOM 0 HA LYS A 398 -23.649 12.624 2.926 1.00 44.83 H new ATOM 0 HB2 LYS A 398 -24.951 12.727 5.388 1.00 47.73 H new ATOM 0 HB3 LYS A 398 -25.641 13.565 4.269 1.00 47.73 H new ATOM 0 HG2 LYS A 398 -25.496 11.371 2.991 1.00 50.22 H new ATOM 0 HG3 LYS A 398 -25.471 10.769 4.429 1.00 50.22 H new ATOM 0 HD2 LYS A 398 -27.597 11.310 4.839 1.00 53.49 H new ATOM 0 HD3 LYS A 398 -27.542 12.589 3.948 1.00 53.49 H new ATOM 0 HE2 LYS A 398 -27.484 11.012 2.031 1.00 53.97 H new ATOM 0 HE3 LYS A 398 -27.984 9.945 3.053 1.00 53.97 H new ATOM 0 HZ1 LYS A 398 -29.759 10.882 1.973 1.00 51.22 H new ATOM 0 HZ2 LYS A 398 -29.864 11.220 3.383 1.00 51.22 H new ATOM 0 HZ3 LYS A 398 -29.399 12.213 2.430 1.00 51.22 H new ATOM 116 N ASN A 399 -24.043 15.027 2.398 1.00 48.50 N ATOM 117 CA ASN A 399 -23.957 16.426 1.992 1.00 50.14 C ATOM 118 C ASN A 399 -22.581 16.711 1.412 1.00 48.76 C ATOM 119 O ASN A 399 -22.267 17.841 1.037 1.00 51.18 O ATOM 120 CB ASN A 399 -24.221 17.356 3.181 1.00 54.69 C ATOM 121 CG ASN A 399 -25.576 18.041 3.099 1.00 58.39 C ATOM 122 OD1 ASN A 399 -26.583 17.507 3.567 1.00 60.42 O ATOM 123 ND2 ASN A 399 -25.605 19.232 2.501 1.00 59.07 N ATOM 0 H ASN A 399 -24.467 14.530 1.839 1.00 48.50 H new ATOM 0 HA ASN A 399 -24.634 16.591 1.317 1.00 50.14 H new ATOM 0 HB2 ASN A 399 -24.170 16.845 4.004 1.00 54.69 H new ATOM 0 HB3 ASN A 399 -23.524 18.029 3.221 1.00 54.69 H new ATOM 0 HD21 ASN A 399 -26.348 19.659 2.430 1.00 59.07 H new ATOM 0 HD22 ASN A 399 -24.881 19.573 2.186 1.00 59.07 H new ATOM 124 N LEU A 400 -21.760 15.676 1.339 1.00 45.18 N ATOM 125 CA LEU A 400 -20.418 15.818 0.807 1.00 42.59 C ATOM 126 C LEU A 400 -20.139 14.660 -0.129 1.00 39.44 C ATOM 127 O LEU A 400 -19.380 14.786 -1.092 1.00 39.95 O ATOM 128 CB LEU A 400 -19.390 15.805 1.946 1.00 44.57 C ATOM 129 CG LEU A 400 -18.592 17.077 2.249 1.00 46.46 C ATOM 130 CD1 LEU A 400 -17.292 16.692 2.946 1.00 45.31 C ATOM 131 CD2 LEU A 400 -18.307 17.847 0.964 1.00 46.84 C ATOM 0 H LEU A 400 -21.962 14.880 1.594 1.00 45.18 H new ATOM 0 HA LEU A 400 -20.349 16.661 0.332 1.00 42.59 H new ATOM 0 HB2 LEU A 400 -19.857 15.554 2.758 1.00 44.57 H new ATOM 0 HB3 LEU A 400 -18.753 15.099 1.756 1.00 44.57 H new ATOM 0 HG LEU A 400 -19.110 17.654 2.832 1.00 46.46 H new ATOM 0 HD11 LEU A 400 -16.780 17.492 3.142 1.00 45.31 H new ATOM 0 HD12 LEU A 400 -17.493 16.227 3.773 1.00 45.31 H new ATOM 0 HD13 LEU A 400 -16.774 16.111 2.367 1.00 45.31 H new ATOM 0 HD21 LEU A 400 -17.802 18.649 1.172 1.00 46.84 H new ATOM 0 HD22 LEU A 400 -17.793 17.289 0.360 1.00 46.84 H new ATOM 0 HD23 LEU A 400 -19.145 18.094 0.542 1.00 46.84 H new ATOM 132 N GLU A 401 -20.771 13.528 0.160 1.00 34.74 N ATOM 133 CA GLU A 401 -20.565 12.326 -0.628 1.00 30.30 C ATOM 134 C GLU A 401 -21.842 11.540 -0.871 1.00 28.28 C ATOM 135 O GLU A 401 -22.856 11.746 -0.212 1.00 29.23 O ATOM 136 CB GLU A 401 -19.559 11.411 0.082 1.00 28.97 C ATOM 137 CG GLU A 401 -18.620 12.122 1.042 1.00 26.53 C ATOM 138 CD GLU A 401 -17.823 11.169 1.905 1.00 24.45 C ATOM 139 OE1 GLU A 401 -18.390 10.176 2.413 1.00 18.55 O ATOM 140 OE2 GLU A 401 -16.617 11.422 2.078 1.00 26.71 O ATOM 0 H GLU A 401 -21.325 13.438 0.812 1.00 34.74 H new ATOM 0 HA GLU A 401 -20.232 12.618 -1.491 1.00 30.30 H new ATOM 0 HB2 GLU A 401 -20.048 10.731 0.572 1.00 28.97 H new ATOM 0 HB3 GLU A 401 -19.029 10.952 -0.588 1.00 28.97 H new ATOM 0 HG2 GLU A 401 -18.009 12.679 0.535 1.00 26.53 H new ATOM 0 HG3 GLU A 401 -19.136 12.713 1.613 1.00 26.53 H new ATOM 141 N ASN A 402 -21.776 10.625 -1.825 1.00 24.04 N ATOM 142 CA ASN A 402 -22.902 9.766 -2.135 1.00 22.60 C ATOM 143 C ASN A 402 -22.356 8.565 -2.875 1.00 21.16 C ATOM 144 O ASN A 402 -21.170 8.512 -3.187 1.00 21.87 O ATOM 145 CB ASN A 402 -23.927 10.501 -3.000 1.00 21.81 C ATOM 146 CG ASN A 402 -23.362 10.926 -4.333 1.00 19.45 C ATOM 147 OD1 ASN A 402 -22.898 9.962 -5.116 1.00 23.07 O flip ATOM 148 ND2 ASN A 402 -23.341 12.110 -4.655 1.00 16.72 N flip ATOM 0 H ASN A 402 -21.079 10.486 -2.309 1.00 24.04 H new ATOM 0 HA ASN A 402 -23.355 9.496 -1.321 1.00 22.60 H new ATOM 0 HB2 ASN A 402 -24.694 9.926 -3.146 1.00 21.81 H new ATOM 0 HB3 ASN A 402 -24.246 11.283 -2.523 1.00 21.81 H new ATOM 0 HD21 ASN A 402 -23.652 12.707 -4.119 1.00 16.72 H new ATOM 0 HD22 ASN A 402 -23.016 12.343 -5.416 1.00 16.72 H new ATOM 149 N SER A 403 -23.222 7.604 -3.162 1.00 19.46 N ATOM 150 CA SER A 403 -22.813 6.404 -3.873 1.00 18.81 C ATOM 151 C SER A 403 -23.535 6.305 -5.228 1.00 17.69 C ATOM 152 O SER A 403 -23.832 5.210 -5.706 1.00 15.79 O ATOM 153 CB SER A 403 -23.122 5.184 -3.009 1.00 18.47 C ATOM 154 OG SER A 403 -22.792 3.984 -3.674 1.00 27.28 O ATOM 0 H SER A 403 -24.056 7.628 -2.952 1.00 19.46 H new ATOM 0 HA SER A 403 -21.860 6.442 -4.047 1.00 18.81 H new ATOM 0 HB2 SER A 403 -22.627 5.241 -2.177 1.00 18.47 H new ATOM 0 HB3 SER A 403 -24.064 5.179 -2.778 1.00 18.47 H new ATOM 0 HG SER A 403 -23.049 4.026 -4.473 1.00 27.28 H new ATOM 155 N ASP A 404 -23.777 7.463 -5.843 1.00 19.16 N ATOM 156 CA ASP A 404 -24.482 7.571 -7.127 1.00 19.43 C ATOM 157 C ASP A 404 -23.823 6.872 -8.315 1.00 20.33 C ATOM 158 O ASP A 404 -24.509 6.465 -9.251 1.00 20.72 O ATOM 159 CB ASP A 404 -24.683 9.043 -7.510 1.00 19.17 C ATOM 160 CG ASP A 404 -25.556 9.814 -6.517 1.00 22.21 C ATOM 161 OD1 ASP A 404 -26.242 9.188 -5.676 1.00 22.90 O ATOM 162 OD2 ASP A 404 -25.549 11.064 -6.589 1.00 21.45 O ATOM 0 H ASP A 404 -23.533 8.222 -5.522 1.00 19.16 H new ATOM 0 HA ASP A 404 -25.320 7.111 -6.963 1.00 19.43 H new ATOM 0 HB2 ASP A 404 -23.817 9.475 -7.573 1.00 19.17 H new ATOM 0 HB3 ASP A 404 -25.088 9.089 -8.390 1.00 19.17 H new ATOM 163 N THR A 405 -22.503 6.727 -8.297 1.00 18.60 N ATOM 164 CA THR A 405 -21.835 6.095 -9.429 1.00 16.87 C ATOM 165 C THR A 405 -20.992 4.873 -9.102 1.00 18.18 C ATOM 166 O THR A 405 -20.103 4.505 -9.865 1.00 17.09 O ATOM 167 CB THR A 405 -20.956 7.110 -10.179 1.00 18.21 C ATOM 168 OG1 THR A 405 -20.089 7.771 -9.249 1.00 17.60 O ATOM 169 CG2 THR A 405 -21.827 8.154 -10.878 1.00 12.41 C ATOM 0 H THR A 405 -21.987 6.980 -7.657 1.00 18.60 H new ATOM 0 HA THR A 405 -22.567 5.778 -9.981 1.00 16.87 H new ATOM 0 HB THR A 405 -20.432 6.636 -10.843 1.00 18.21 H new ATOM 0 HG1 THR A 405 -19.608 8.324 -9.659 1.00 17.60 H new ATOM 0 HG21 THR A 405 -21.261 8.787 -11.346 1.00 12.41 H new ATOM 0 HG22 THR A 405 -22.413 7.714 -11.513 1.00 12.41 H new ATOM 0 HG23 THR A 405 -22.360 8.625 -10.219 1.00 12.41 H new ATOM 170 N SER A 406 -21.268 4.237 -7.970 1.00 16.51 N ATOM 171 CA SER A 406 -20.528 3.042 -7.592 1.00 16.62 C ATOM 172 C SER A 406 -21.383 2.208 -6.660 1.00 17.26 C ATOM 173 O SER A 406 -22.393 2.682 -6.146 1.00 21.12 O ATOM 174 CB SER A 406 -19.215 3.417 -6.890 1.00 15.42 C ATOM 175 OG SER A 406 -19.455 4.307 -5.815 1.00 14.46 O ATOM 0 H SER A 406 -21.875 4.479 -7.411 1.00 16.51 H new ATOM 0 HA SER A 406 -20.314 2.536 -8.391 1.00 16.62 H new ATOM 0 HB2 SER A 406 -18.779 2.615 -6.560 1.00 15.42 H new ATOM 0 HB3 SER A 406 -18.609 3.828 -7.526 1.00 15.42 H new ATOM 0 HG SER A 406 -19.276 3.925 -5.089 1.00 14.46 H new ATOM 176 N LEU A 407 -20.977 0.965 -6.437 1.00 16.94 N ATOM 177 CA LEU A 407 -21.721 0.091 -5.554 1.00 17.66 C ATOM 178 C LEU A 407 -20.806 -0.796 -4.720 1.00 17.44 C ATOM 179 O LEU A 407 -19.973 -1.518 -5.252 1.00 17.74 O ATOM 180 CB LEU A 407 -22.676 -0.792 -6.361 1.00 17.97 C ATOM 181 CG LEU A 407 -23.284 -1.958 -5.577 1.00 19.20 C ATOM 182 CD1 LEU A 407 -24.406 -1.442 -4.691 1.00 19.81 C ATOM 183 CD2 LEU A 407 -23.793 -3.021 -6.534 1.00 22.23 C ATOM 0 H LEU A 407 -20.275 0.612 -6.788 1.00 16.94 H new ATOM 0 HA LEU A 407 -22.224 0.660 -4.950 1.00 17.66 H new ATOM 0 HB2 LEU A 407 -23.395 -0.240 -6.705 1.00 17.97 H new ATOM 0 HB3 LEU A 407 -22.199 -1.147 -7.128 1.00 17.97 H new ATOM 0 HG LEU A 407 -22.604 -2.361 -5.015 1.00 19.20 H new ATOM 0 HD11 LEU A 407 -24.792 -2.180 -4.194 1.00 19.81 H new ATOM 0 HD12 LEU A 407 -24.053 -0.785 -4.071 1.00 19.81 H new ATOM 0 HD13 LEU A 407 -25.091 -1.031 -5.242 1.00 19.81 H new ATOM 0 HD21 LEU A 407 -24.176 -3.755 -6.029 1.00 22.23 H new ATOM 0 HD22 LEU A 407 -24.471 -2.638 -7.112 1.00 22.23 H new ATOM 0 HD23 LEU A 407 -23.057 -3.350 -7.074 1.00 22.23 H new ATOM 184 N ILE A 408 -20.970 -0.735 -3.405 1.00 16.72 N ATOM 185 CA ILE A 408 -20.188 -1.569 -2.511 1.00 17.38 C ATOM 186 C ILE A 408 -21.193 -2.475 -1.804 1.00 16.06 C ATOM 187 O ILE A 408 -22.007 -2.013 -1.011 1.00 17.13 O ATOM 188 CB ILE A 408 -19.392 -0.713 -1.474 1.00 17.20 C ATOM 189 CG1 ILE A 408 -18.317 0.114 -2.191 1.00 15.39 C ATOM 190 CG2 ILE A 408 -18.724 -1.629 -0.440 1.00 18.66 C ATOM 191 CD1 ILE A 408 -17.617 1.132 -1.318 1.00 13.61 C ATOM 0 H ILE A 408 -21.531 -0.215 -3.011 1.00 16.72 H new ATOM 0 HA ILE A 408 -19.525 -2.079 -3.003 1.00 17.38 H new ATOM 0 HB ILE A 408 -20.010 -0.116 -1.023 1.00 17.20 H new ATOM 0 HG12 ILE A 408 -17.653 -0.490 -2.559 1.00 15.39 H new ATOM 0 HG13 ILE A 408 -18.727 0.575 -2.940 1.00 15.39 H new ATOM 0 HG21 ILE A 408 -18.232 -1.091 0.200 1.00 18.66 H new ATOM 0 HG22 ILE A 408 -19.403 -2.142 0.025 1.00 18.66 H new ATOM 0 HG23 ILE A 408 -18.114 -2.234 -0.890 1.00 18.66 H new ATOM 0 HD11 ILE A 408 -16.956 1.610 -1.844 1.00 13.61 H new ATOM 0 HD12 ILE A 408 -18.268 1.761 -0.968 1.00 13.61 H new ATOM 0 HD13 ILE A 408 -17.177 0.679 -0.581 1.00 13.61 H new ATOM 192 N ASN A 409 -21.141 -3.765 -2.111 1.00 16.38 N ATOM 193 CA ASN A 409 -22.056 -4.737 -1.520 1.00 20.55 C ATOM 194 C ASN A 409 -21.353 -5.696 -0.561 1.00 19.73 C ATOM 195 O ASN A 409 -20.478 -6.458 -0.969 1.00 20.78 O ATOM 196 CB ASN A 409 -22.740 -5.539 -2.632 1.00 22.10 C ATOM 197 CG ASN A 409 -23.610 -6.656 -2.094 1.00 26.36 C ATOM 198 OD1 ASN A 409 -23.609 -7.774 -2.621 1.00 30.89 O ATOM 199 ND2 ASN A 409 -24.363 -6.361 -1.040 1.00 28.81 N ATOM 0 H ASN A 409 -20.577 -4.102 -2.666 1.00 16.38 H new ATOM 0 HA ASN A 409 -22.711 -4.240 -1.006 1.00 20.55 H new ATOM 0 HB2 ASN A 409 -23.283 -4.942 -3.170 1.00 22.10 H new ATOM 0 HB3 ASN A 409 -22.064 -5.914 -3.218 1.00 22.10 H new ATOM 0 HD21 ASN A 409 -24.877 -6.960 -0.697 1.00 28.81 H new ATOM 0 HD22 ASN A 409 -24.337 -5.571 -0.700 1.00 28.81 H new ATOM 200 N VAL A 410 -21.752 -5.676 0.707 1.00 19.93 N ATOM 201 CA VAL A 410 -21.138 -6.549 1.702 1.00 20.18 C ATOM 202 C VAL A 410 -22.012 -7.758 1.999 1.00 21.50 C ATOM 203 O VAL A 410 -23.176 -7.609 2.368 1.00 24.16 O ATOM 204 CB VAL A 410 -20.882 -5.792 3.036 1.00 20.65 C ATOM 205 CG1 VAL A 410 -20.182 -6.701 4.037 1.00 19.23 C ATOM 206 CG2 VAL A 410 -20.046 -4.553 2.783 1.00 19.61 C ATOM 0 H VAL A 410 -22.374 -5.166 1.011 1.00 19.93 H new ATOM 0 HA VAL A 410 -20.294 -6.844 1.325 1.00 20.18 H new ATOM 0 HB VAL A 410 -21.737 -5.523 3.407 1.00 20.65 H new ATOM 0 HG11 VAL A 410 -20.029 -6.216 4.863 1.00 19.23 H new ATOM 0 HG12 VAL A 410 -20.738 -7.475 4.215 1.00 19.23 H new ATOM 0 HG13 VAL A 410 -19.332 -6.992 3.671 1.00 19.23 H new ATOM 0 HG21 VAL A 410 -19.893 -4.089 3.621 1.00 19.61 H new ATOM 0 HG22 VAL A 410 -19.195 -4.810 2.396 1.00 19.61 H new ATOM 0 HG23 VAL A 410 -20.515 -3.966 2.170 1.00 19.61 H new ATOM 207 N ASN A 411 -21.456 -8.954 1.839 1.00 21.13 N ATOM 208 CA ASN A 411 -22.190 -10.182 2.123 1.00 24.19 C ATOM 209 C ASN A 411 -22.005 -10.533 3.603 1.00 25.97 C ATOM 210 O ASN A 411 -21.025 -10.114 4.229 1.00 25.32 O ATOM 211 CB ASN A 411 -21.678 -11.328 1.243 1.00 24.64 C ATOM 212 CG ASN A 411 -21.770 -11.012 -0.242 1.00 29.06 C ATOM 213 OD1 ASN A 411 -20.775 -11.078 -0.965 1.00 31.32 O ATOM 214 ND2 ASN A 411 -22.966 -10.666 -0.702 1.00 27.73 N ATOM 0 H ASN A 411 -20.650 -9.077 1.565 1.00 21.13 H new ATOM 0 HA ASN A 411 -23.131 -10.050 1.929 1.00 24.19 H new ATOM 0 HB2 ASN A 411 -20.755 -11.520 1.473 1.00 24.64 H new ATOM 0 HB3 ASN A 411 -22.190 -12.130 1.432 1.00 24.64 H new ATOM 0 HD21 ASN A 411 -23.068 -10.477 -1.535 1.00 27.73 H new ATOM 0 HD22 ASN A 411 -23.639 -10.631 -0.167 1.00 27.73 H new ATOM 215 N GLU A 412 -22.939 -11.288 4.175 1.00 27.51 N ATOM 216 CA GLU A 412 -22.798 -11.649 5.580 1.00 29.71 C ATOM 217 C GLU A 412 -21.698 -12.680 5.733 1.00 29.32 C ATOM 218 O GLU A 412 -21.336 -13.365 4.774 1.00 26.11 O ATOM 219 CB GLU A 412 -24.104 -12.202 6.163 1.00 33.05 C ATOM 220 CG GLU A 412 -25.158 -12.627 5.162 1.00 37.72 C ATOM 221 CD GLU A 412 -26.411 -13.147 5.850 1.00 40.25 C ATOM 222 OE1 GLU A 412 -26.409 -14.319 6.288 1.00 40.73 O ATOM 223 OE2 GLU A 412 -27.395 -12.383 5.960 1.00 42.48 O ATOM 0 H GLU A 412 -23.640 -11.593 3.782 1.00 27.51 H new ATOM 0 HA GLU A 412 -22.572 -10.843 6.070 1.00 29.71 H new ATOM 0 HB2 GLU A 412 -23.889 -12.965 6.722 1.00 33.05 H new ATOM 0 HB3 GLU A 412 -24.489 -11.526 6.742 1.00 33.05 H new ATOM 0 HG2 GLU A 412 -25.389 -11.874 4.595 1.00 37.72 H new ATOM 0 HG3 GLU A 412 -24.796 -13.317 4.584 1.00 37.72 H new ATOM 224 N PHE A 413 -21.159 -12.784 6.942 1.00 30.43 N ATOM 225 CA PHE A 413 -20.096 -13.742 7.200 1.00 33.35 C ATOM 226 C PHE A 413 -20.577 -15.148 6.857 1.00 35.35 C ATOM 227 O PHE A 413 -21.703 -15.521 7.185 1.00 35.65 O ATOM 228 CB PHE A 413 -19.665 -13.675 8.669 1.00 33.00 C ATOM 229 CG PHE A 413 -18.461 -14.506 8.975 1.00 32.98 C ATOM 230 CD1 PHE A 413 -18.599 -15.845 9.316 1.00 33.35 C ATOM 231 CD2 PHE A 413 -17.185 -13.967 8.873 1.00 30.87 C ATOM 232 CE1 PHE A 413 -17.483 -16.640 9.545 1.00 33.56 C ATOM 233 CE2 PHE A 413 -16.063 -14.755 9.100 1.00 31.90 C ATOM 234 CZ PHE A 413 -16.212 -16.093 9.436 1.00 32.68 C ATOM 0 H PHE A 413 -21.393 -12.312 7.622 1.00 30.43 H new ATOM 0 HA PHE A 413 -19.332 -13.523 6.644 1.00 33.35 H new ATOM 0 HB2 PHE A 413 -19.480 -12.752 8.903 1.00 33.00 H new ATOM 0 HB3 PHE A 413 -20.402 -13.967 9.228 1.00 33.00 H new ATOM 0 HD1 PHE A 413 -19.449 -16.214 9.392 1.00 33.35 H new ATOM 0 HD2 PHE A 413 -17.080 -13.070 8.651 1.00 30.87 H new ATOM 0 HE1 PHE A 413 -17.587 -17.536 9.771 1.00 33.56 H new ATOM 0 HE2 PHE A 413 -15.213 -14.386 9.027 1.00 31.90 H new ATOM 0 HZ PHE A 413 -15.462 -16.622 9.588 1.00 32.68 H new ATOM 235 N ASP A 414 -19.724 -15.922 6.193 1.00 38.24 N ATOM 236 CA ASP A 414 -20.071 -17.287 5.806 1.00 41.85 C ATOM 237 C ASP A 414 -19.229 -18.325 6.537 1.00 42.81 C ATOM 238 O ASP A 414 -18.025 -18.429 6.307 1.00 40.79 O ATOM 239 CB ASP A 414 -19.895 -17.473 4.297 1.00 44.29 C ATOM 240 CG ASP A 414 -20.045 -18.923 3.866 1.00 47.90 C ATOM 241 OD1 ASP A 414 -19.156 -19.429 3.147 1.00 49.84 O ATOM 242 OD2 ASP A 414 -21.056 -19.559 4.243 1.00 48.76 O ATOM 0 H ASP A 414 -18.935 -15.675 5.956 1.00 38.24 H new ATOM 0 HA ASP A 414 -20.999 -17.422 6.053 1.00 41.85 H new ATOM 0 HB2 ASP A 414 -20.549 -16.931 3.829 1.00 44.29 H new ATOM 0 HB3 ASP A 414 -19.019 -17.150 4.035 1.00 44.29 H new ATOM 243 N ASP A 415 -19.876 -19.097 7.408 1.00 45.93 N ATOM 244 CA ASP A 415 -19.202 -20.137 8.184 1.00 48.64 C ATOM 245 C ASP A 415 -18.698 -21.259 7.290 1.00 48.85 C ATOM 246 O ASP A 415 -17.715 -21.929 7.611 1.00 48.43 O ATOM 247 CB ASP A 415 -20.152 -20.708 9.236 1.00 50.47 C ATOM 248 CG ASP A 415 -21.187 -19.699 9.685 1.00 53.67 C ATOM 249 OD1 ASP A 415 -20.795 -18.692 10.314 1.00 53.98 O ATOM 250 OD2 ASP A 415 -22.388 -19.908 9.406 1.00 55.07 O ATOM 0 H ASP A 415 -20.719 -19.033 7.566 1.00 45.93 H new ATOM 0 HA ASP A 415 -18.438 -19.730 8.622 1.00 48.64 H new ATOM 0 HB2 ASP A 415 -20.600 -21.488 8.874 1.00 50.47 H new ATOM 0 HB3 ASP A 415 -19.639 -21.006 10.004 1.00 50.47 H new ATOM 251 N ASN A 416 -19.385 -21.470 6.173 1.00 50.46 N ATOM 252 CA ASN A 416 -18.985 -22.496 5.222 1.00 51.04 C ATOM 253 C ASN A 416 -17.587 -22.118 4.761 1.00 50.73 C ATOM 254 O ASN A 416 -16.720 -22.972 4.599 1.00 50.94 O ATOM 255 CB ASN A 416 -19.932 -22.500 4.025 1.00 53.83 C ATOM 256 CG ASN A 416 -20.769 -23.750 3.955 1.00 57.25 C ATOM 257 OD1 ASN A 416 -20.586 -24.582 3.064 1.00 59.08 O ATOM 258 ND2 ASN A 416 -21.695 -23.897 4.897 1.00 59.49 N ATOM 0 H ASN A 416 -20.087 -21.028 5.948 1.00 50.46 H new ATOM 0 HA ASN A 416 -19.008 -23.378 5.624 1.00 51.04 H new ATOM 0 HB2 ASN A 416 -20.515 -21.726 4.075 1.00 53.83 H new ATOM 0 HB3 ASN A 416 -19.416 -22.414 3.208 1.00 53.83 H new ATOM 0 HD21 ASN A 416 -22.197 -24.595 4.901 1.00 59.49 H new ATOM 0 HD22 ASN A 416 -21.792 -23.294 5.502 1.00 59.49 H new ATOM 259 N SER A 417 -17.387 -20.816 4.573 1.00 49.24 N ATOM 260 CA SER A 417 -16.115 -20.249 4.129 1.00 46.88 C ATOM 261 C SER A 417 -15.137 -19.966 5.281 1.00 45.22 C ATOM 262 O SER A 417 -14.022 -20.500 5.330 1.00 44.99 O ATOM 263 CB SER A 417 -16.379 -18.938 3.383 1.00 46.49 C ATOM 264 OG SER A 417 -16.128 -19.064 1.998 1.00 50.53 O ATOM 0 H SER A 417 -17.999 -20.226 4.702 1.00 49.24 H new ATOM 0 HA SER A 417 -15.702 -20.912 3.554 1.00 46.88 H new ATOM 0 HB2 SER A 417 -17.300 -18.666 3.522 1.00 46.49 H new ATOM 0 HB3 SER A 417 -15.818 -18.237 3.751 1.00 46.49 H new ATOM 0 HG SER A 417 -16.283 -18.331 1.617 1.00 50.53 H new ATOM 265 N GLY A 418 -15.568 -19.110 6.201 1.00 41.44 N ATOM 266 CA GLY A 418 -14.735 -18.734 7.324 1.00 35.48 C ATOM 267 C GLY A 418 -14.342 -17.289 7.103 1.00 31.60 C ATOM 268 O GLY A 418 -13.693 -16.669 7.940 1.00 31.20 O ATOM 0 H GLY A 418 -16.343 -18.737 6.189 1.00 41.44 H new ATOM 0 HA2 GLY A 418 -15.216 -18.837 8.160 1.00 35.48 H new ATOM 0 HA3 GLY A 418 -13.950 -19.301 7.377 1.00 35.48 H new ATOM 269 N VAL A 419 -14.751 -16.750 5.958 1.00 27.89 N ATOM 270 CA VAL A 419 -14.443 -15.370 5.612 1.00 24.21 C ATOM 271 C VAL A 419 -15.725 -14.633 5.259 1.00 21.97 C ATOM 272 O VAL A 419 -16.786 -15.242 5.162 1.00 22.72 O ATOM 273 CB VAL A 419 -13.479 -15.293 4.396 1.00 26.56 C ATOM 274 CG1 VAL A 419 -12.210 -16.090 4.679 1.00 26.79 C ATOM 275 CG2 VAL A 419 -14.168 -15.819 3.146 1.00 24.91 C ATOM 0 H VAL A 419 -15.211 -17.171 5.366 1.00 27.89 H new ATOM 0 HA VAL A 419 -14.014 -14.961 6.380 1.00 24.21 H new ATOM 0 HB VAL A 419 -13.235 -14.366 4.248 1.00 26.56 H new ATOM 0 HG11 VAL A 419 -11.616 -16.035 3.914 1.00 26.79 H new ATOM 0 HG12 VAL A 419 -11.766 -15.725 5.460 1.00 26.79 H new ATOM 0 HG13 VAL A 419 -12.440 -17.018 4.843 1.00 26.79 H new ATOM 0 HG21 VAL A 419 -13.558 -15.766 2.394 1.00 24.91 H new ATOM 0 HG22 VAL A 419 -14.430 -16.742 3.285 1.00 24.91 H new ATOM 0 HG23 VAL A 419 -14.956 -15.284 2.961 1.00 24.91 H new ATOM 276 N GLN A 420 -15.623 -13.322 5.076 1.00 19.79 N ATOM 277 CA GLN A 420 -16.769 -12.500 4.716 1.00 18.07 C ATOM 278 C GLN A 420 -16.415 -11.808 3.414 1.00 19.66 C ATOM 279 O GLN A 420 -15.358 -11.189 3.306 1.00 19.61 O ATOM 280 CB GLN A 420 -17.047 -11.456 5.790 1.00 17.99 C ATOM 281 CG GLN A 420 -18.396 -10.783 5.634 1.00 17.71 C ATOM 282 CD GLN A 420 -18.789 -9.988 6.854 1.00 19.26 C ATOM 283 OE1 GLN A 420 -18.171 -10.108 7.912 1.00 19.96 O ATOM 284 NE2 GLN A 420 -19.821 -9.163 6.716 1.00 18.91 N ATOM 0 H GLN A 420 -14.887 -12.885 5.157 1.00 19.79 H new ATOM 0 HA GLN A 420 -17.565 -13.048 4.627 1.00 18.07 H new ATOM 0 HB2 GLN A 420 -17.002 -11.878 6.662 1.00 17.99 H new ATOM 0 HB3 GLN A 420 -16.351 -10.781 5.765 1.00 17.99 H new ATOM 0 HG2 GLN A 420 -18.374 -10.196 4.862 1.00 17.71 H new ATOM 0 HG3 GLN A 420 -19.072 -11.456 5.459 1.00 17.71 H new ATOM 0 HE21 GLN A 420 -20.228 -9.106 5.961 1.00 18.91 H new ATOM 0 HE22 GLN A 420 -20.082 -8.686 7.382 1.00 18.91 H new ATOM 285 N SER A 421 -17.305 -11.898 2.435 1.00 17.54 N ATOM 286 CA SER A 421 -17.068 -11.310 1.130 1.00 17.54 C ATOM 287 C SER A 421 -17.765 -9.985 0.897 1.00 18.12 C ATOM 288 O SER A 421 -18.753 -9.662 1.547 1.00 17.49 O ATOM 289 CB SER A 421 -17.502 -12.288 0.042 1.00 17.53 C ATOM 290 OG SER A 421 -16.815 -12.017 -1.163 1.00 28.40 O ATOM 0 H SER A 421 -18.061 -12.301 2.510 1.00 17.54 H new ATOM 0 HA SER A 421 -16.115 -11.130 1.096 1.00 17.54 H new ATOM 0 HB2 SER A 421 -17.323 -13.198 0.326 1.00 17.53 H new ATOM 0 HB3 SER A 421 -18.459 -12.219 -0.101 1.00 17.53 H new ATOM 0 HG SER A 421 -17.060 -12.561 -1.754 1.00 28.40 H new ATOM 291 N MET A 422 -17.231 -9.219 -0.045 1.00 17.66 N ATOM 292 CA MET A 422 -17.799 -7.939 -0.416 1.00 18.37 C ATOM 293 C MET A 422 -17.543 -7.734 -1.904 1.00 19.94 C ATOM 294 O MET A 422 -16.605 -8.303 -2.466 1.00 20.69 O ATOM 295 CB MET A 422 -17.180 -6.809 0.411 1.00 18.23 C ATOM 296 CG MET A 422 -15.759 -6.431 0.030 1.00 15.81 C ATOM 297 SD MET A 422 -15.101 -5.197 1.158 1.00 17.63 S ATOM 298 CE MET A 422 -15.905 -3.735 0.538 1.00 10.93 C ATOM 0 H MET A 422 -16.525 -9.431 -0.488 1.00 17.66 H new ATOM 0 HA MET A 422 -18.752 -7.928 -0.238 1.00 18.37 H new ATOM 0 HB2 MET A 422 -17.742 -6.022 0.329 1.00 18.23 H new ATOM 0 HB3 MET A 422 -17.191 -7.068 1.346 1.00 18.23 H new ATOM 0 HG2 MET A 422 -15.195 -7.220 0.043 1.00 15.81 H new ATOM 0 HG3 MET A 422 -15.744 -6.087 -0.877 1.00 15.81 H new ATOM 0 HE1 MET A 422 -15.265 -3.008 0.492 1.00 10.93 H new ATOM 0 HE2 MET A 422 -16.258 -3.911 -0.348 1.00 10.93 H new ATOM 0 HE3 MET A 422 -16.631 -3.489 1.132 1.00 10.93 H new ATOM 299 N GLU A 423 -18.385 -6.932 -2.542 1.00 20.51 N ATOM 300 CA GLU A 423 -18.264 -6.677 -3.969 1.00 20.57 C ATOM 301 C GLU A 423 -18.303 -5.190 -4.287 1.00 19.75 C ATOM 302 O GLU A 423 -19.155 -4.458 -3.777 1.00 20.58 O ATOM 303 CB GLU A 423 -19.394 -7.392 -4.721 1.00 21.63 C ATOM 304 CG GLU A 423 -19.564 -8.842 -4.321 1.00 28.48 C ATOM 305 CD GLU A 423 -20.875 -9.426 -4.787 1.00 32.69 C ATOM 306 OE1 GLU A 423 -21.002 -10.667 -4.772 1.00 35.65 O ATOM 307 OE2 GLU A 423 -21.775 -8.647 -5.169 1.00 37.25 O ATOM 0 H GLU A 423 -19.039 -6.523 -2.162 1.00 20.51 H new ATOM 0 HA GLU A 423 -17.403 -7.019 -4.256 1.00 20.57 H new ATOM 0 HB2 GLU A 423 -20.227 -6.921 -4.563 1.00 21.63 H new ATOM 0 HB3 GLU A 423 -19.219 -7.345 -5.674 1.00 21.63 H new ATOM 0 HG2 GLU A 423 -18.833 -9.363 -4.689 1.00 28.48 H new ATOM 0 HG3 GLU A 423 -19.506 -8.916 -3.356 1.00 28.48 H new ATOM 308 N VAL A 424 -17.368 -4.752 -5.125 1.00 15.78 N ATOM 309 CA VAL A 424 -17.287 -3.359 -5.535 1.00 15.49 C ATOM 310 C VAL A 424 -17.436 -3.270 -7.052 1.00 15.56 C ATOM 311 O VAL A 424 -16.785 -3.999 -7.800 1.00 14.34 O ATOM 312 CB VAL A 424 -15.947 -2.733 -5.115 1.00 12.56 C ATOM 313 CG1 VAL A 424 -15.894 -1.286 -5.555 1.00 12.00 C ATOM 314 CG2 VAL A 424 -15.785 -2.833 -3.600 1.00 13.70 C ATOM 0 H VAL A 424 -16.763 -5.256 -5.471 1.00 15.78 H new ATOM 0 HA VAL A 424 -18.002 -2.869 -5.099 1.00 15.49 H new ATOM 0 HB VAL A 424 -15.220 -3.214 -5.541 1.00 12.56 H new ATOM 0 HG11 VAL A 424 -15.047 -0.897 -5.287 1.00 12.00 H new ATOM 0 HG12 VAL A 424 -15.981 -1.238 -6.520 1.00 12.00 H new ATOM 0 HG13 VAL A 424 -16.620 -0.795 -5.140 1.00 12.00 H new ATOM 0 HG21 VAL A 424 -14.939 -2.437 -3.338 1.00 13.70 H new ATOM 0 HG22 VAL A 424 -16.511 -2.360 -3.165 1.00 13.70 H new ATOM 0 HG23 VAL A 424 -15.802 -3.766 -3.333 1.00 13.70 H new ATOM 315 N THR A 425 -18.306 -2.372 -7.490 1.00 15.80 N ATOM 316 CA THR A 425 -18.568 -2.183 -8.910 1.00 17.64 C ATOM 317 C THR A 425 -18.634 -0.704 -9.238 1.00 16.67 C ATOM 318 O THR A 425 -19.219 0.076 -8.482 1.00 15.37 O ATOM 319 CB THR A 425 -19.919 -2.811 -9.313 1.00 18.22 C ATOM 320 OG1 THR A 425 -20.017 -4.127 -8.764 1.00 19.44 O ATOM 321 CG2 THR A 425 -20.035 -2.890 -10.834 1.00 23.67 C ATOM 0 H THR A 425 -18.761 -1.855 -6.975 1.00 15.80 H new ATOM 0 HA THR A 425 -17.846 -2.611 -9.396 1.00 17.64 H new ATOM 0 HB THR A 425 -20.636 -2.256 -8.969 1.00 18.22 H new ATOM 0 HG1 THR A 425 -20.270 -4.079 -7.965 1.00 19.44 H new ATOM 0 HG21 THR A 425 -20.887 -3.286 -11.074 1.00 23.67 H new ATOM 0 HG22 THR A 425 -19.976 -1.998 -11.210 1.00 23.67 H new ATOM 0 HG23 THR A 425 -19.315 -3.436 -11.186 1.00 23.67 H new ATOM 322 N LYS A 426 -18.034 -0.318 -10.364 1.00 16.12 N ATOM 323 CA LYS A 426 -18.060 1.075 -10.804 1.00 17.67 C ATOM 324 C LYS A 426 -19.125 1.179 -11.888 1.00 18.61 C ATOM 325 O LYS A 426 -19.216 0.303 -12.746 1.00 18.42 O ATOM 326 CB LYS A 426 -16.700 1.485 -11.359 1.00 20.83 C ATOM 327 CG LYS A 426 -15.660 1.731 -10.279 1.00 25.42 C ATOM 328 CD LYS A 426 -14.382 2.288 -10.868 1.00 27.60 C ATOM 329 CE LYS A 426 -14.449 3.794 -10.976 1.00 29.95 C ATOM 330 NZ LYS A 426 -13.269 4.336 -11.704 1.00 33.41 N ATOM 0 H LYS A 426 -17.606 -0.849 -10.888 1.00 16.12 H new ATOM 0 HA LYS A 426 -18.262 1.666 -10.062 1.00 17.67 H new ATOM 0 HB2 LYS A 426 -16.379 0.792 -11.956 1.00 20.83 H new ATOM 0 HB3 LYS A 426 -16.803 2.291 -11.889 1.00 20.83 H new ATOM 0 HG2 LYS A 426 -16.013 2.350 -9.621 1.00 25.42 H new ATOM 0 HG3 LYS A 426 -15.470 0.901 -9.814 1.00 25.42 H new ATOM 0 HD2 LYS A 426 -13.628 2.033 -10.314 1.00 27.60 H new ATOM 0 HD3 LYS A 426 -14.232 1.903 -11.746 1.00 27.60 H new ATOM 0 HE2 LYS A 426 -15.263 4.052 -11.437 1.00 29.95 H new ATOM 0 HE3 LYS A 426 -14.491 4.183 -10.088 1.00 29.95 H new ATOM 0 HZ1 LYS A 426 -13.435 5.173 -11.958 1.00 33.41 H new ATOM 0 HZ2 LYS A 426 -12.558 4.324 -11.168 1.00 33.41 H new ATOM 0 HZ3 LYS A 426 -13.107 3.835 -12.422 1.00 33.41 H new ATOM 331 N ILE A 427 -19.925 2.241 -11.842 1.00 20.01 N ATOM 332 CA ILE A 427 -21.013 2.439 -12.803 1.00 24.83 C ATOM 333 C ILE A 427 -20.600 2.446 -14.278 1.00 27.35 C ATOM 334 O ILE A 427 -21.392 2.071 -15.144 1.00 27.52 O ATOM 335 CB ILE A 427 -21.800 3.750 -12.493 1.00 25.40 C ATOM 336 CG1 ILE A 427 -23.197 3.679 -13.109 1.00 28.79 C ATOM 337 CG2 ILE A 427 -21.056 4.964 -13.034 1.00 26.51 C ATOM 338 CD1 ILE A 427 -24.239 3.119 -12.174 1.00 29.37 C ATOM 0 H ILE A 427 -19.855 2.866 -11.256 1.00 20.01 H new ATOM 0 HA ILE A 427 -21.573 1.656 -12.684 1.00 24.83 H new ATOM 0 HB ILE A 427 -21.879 3.840 -11.530 1.00 25.40 H new ATOM 0 HG12 ILE A 427 -23.466 4.569 -13.386 1.00 28.79 H new ATOM 0 HG13 ILE A 427 -23.163 3.131 -13.909 1.00 28.79 H new ATOM 0 HG21 ILE A 427 -21.559 5.768 -12.832 1.00 26.51 H new ATOM 0 HG22 ILE A 427 -20.181 5.018 -12.620 1.00 26.51 H new ATOM 0 HG23 ILE A 427 -20.954 4.879 -13.995 1.00 26.51 H new ATOM 0 HD11 ILE A 427 -25.099 3.100 -12.622 1.00 29.37 H new ATOM 0 HD12 ILE A 427 -23.990 2.218 -11.914 1.00 29.37 H new ATOM 0 HD13 ILE A 427 -24.299 3.678 -11.384 1.00 29.37 H new ATOM 339 N GLN A 428 -19.371 2.861 -14.571 1.00 28.41 N ATOM 340 CA GLN A 428 -18.912 2.909 -15.955 1.00 29.44 C ATOM 341 C GLN A 428 -18.595 1.527 -16.514 1.00 29.89 C ATOM 342 O GLN A 428 -18.045 1.408 -17.605 1.00 32.33 O ATOM 343 CB GLN A 428 -17.681 3.808 -16.086 1.00 32.85 C ATOM 344 CG GLN A 428 -17.629 4.945 -15.080 1.00 41.20 C ATOM 345 CD GLN A 428 -17.343 4.452 -13.675 1.00 42.94 C ATOM 346 OE1 GLN A 428 -16.664 3.316 -13.578 1.00 43.83 O flip ATOM 347 NE2 GLN A 428 -17.732 5.078 -12.690 1.00 46.97 N flip ATOM 0 H GLN A 428 -18.792 3.117 -13.989 1.00 28.41 H new ATOM 0 HA GLN A 428 -19.643 3.278 -16.475 1.00 29.44 H new ATOM 0 HB2 GLN A 428 -16.884 3.264 -15.986 1.00 32.85 H new ATOM 0 HB3 GLN A 428 -17.659 4.181 -16.981 1.00 32.85 H new ATOM 0 HG2 GLN A 428 -16.944 5.578 -15.345 1.00 41.20 H new ATOM 0 HG3 GLN A 428 -18.474 5.421 -15.088 1.00 41.20 H new ATOM 0 HE21 GLN A 428 -18.170 5.811 -12.792 1.00 46.97 H new ATOM 0 HE22 GLN A 428 -17.566 4.782 -11.900 1.00 46.97 H new ATOM 348 N ASN A 429 -18.940 0.484 -15.767 1.00 28.47 N ATOM 349 CA ASN A 429 -18.702 -0.884 -16.211 1.00 27.35 C ATOM 350 C ASN A 429 -19.224 -1.861 -15.172 1.00 26.25 C ATOM 351 O ASN A 429 -18.457 -2.643 -14.600 1.00 27.37 O ATOM 352 CB ASN A 429 -17.203 -1.130 -16.443 1.00 30.98 C ATOM 353 CG ASN A 429 -16.918 -2.519 -17.022 1.00 36.34 C ATOM 354 OD1 ASN A 429 -17.763 -3.109 -17.703 1.00 40.49 O ATOM 355 ND2 ASN A 429 -15.722 -3.047 -16.748 1.00 41.33 N ATOM 0 H ASN A 429 -19.315 0.548 -14.996 1.00 28.47 H new ATOM 0 HA ASN A 429 -19.171 -1.019 -17.049 1.00 27.35 H new ATOM 0 HB2 ASN A 429 -16.857 -0.454 -17.047 1.00 30.98 H new ATOM 0 HB3 ASN A 429 -16.728 -1.030 -15.603 1.00 30.98 H new ATOM 0 HD21 ASN A 429 -15.517 -3.826 -17.049 1.00 41.33 H new ATOM 0 HD22 ASN A 429 -15.157 -2.608 -16.270 1.00 41.33 H new ATOM 356 N THR A 430 -20.533 -1.828 -14.938 1.00 21.38 N ATOM 357 CA THR A 430 -21.141 -2.699 -13.948 1.00 18.13 C ATOM 358 C THR A 430 -20.939 -4.185 -14.201 1.00 16.32 C ATOM 359 O THR A 430 -21.314 -5.013 -13.377 1.00 16.41 O ATOM 360 CB THR A 430 -22.643 -2.410 -13.809 1.00 20.30 C ATOM 361 OG1 THR A 430 -23.236 -2.303 -15.108 1.00 21.23 O ATOM 362 CG2 THR A 430 -22.851 -1.105 -13.052 1.00 19.01 C ATOM 0 H THR A 430 -21.084 -1.307 -15.344 1.00 21.38 H new ATOM 0 HA THR A 430 -20.676 -2.493 -13.122 1.00 18.13 H new ATOM 0 HB THR A 430 -23.060 -3.136 -13.320 1.00 20.30 H new ATOM 0 HG1 THR A 430 -24.058 -2.146 -15.029 1.00 21.23 H new ATOM 0 HG21 THR A 430 -23.801 -0.928 -12.967 1.00 19.01 H new ATOM 0 HG22 THR A 430 -22.456 -1.176 -12.169 1.00 19.01 H new ATOM 0 HG23 THR A 430 -22.429 -0.379 -13.537 1.00 19.01 H new ATOM 363 N ALA A 431 -20.337 -4.527 -15.335 1.00 15.39 N ATOM 364 CA ALA A 431 -20.073 -5.925 -15.659 1.00 16.84 C ATOM 365 C ALA A 431 -18.812 -6.408 -14.932 1.00 17.68 C ATOM 366 O ALA A 431 -18.620 -7.600 -14.717 1.00 17.96 O ATOM 367 CB ALA A 431 -19.896 -6.082 -17.171 1.00 19.51 C ATOM 0 H ALA A 431 -20.073 -3.965 -15.930 1.00 15.39 H new ATOM 0 HA ALA A 431 -20.826 -6.463 -15.369 1.00 16.84 H new ATOM 0 HB1 ALA A 431 -19.721 -7.013 -17.382 1.00 19.51 H new ATOM 0 HB2 ALA A 431 -20.705 -5.795 -17.623 1.00 19.51 H new ATOM 0 HB3 ALA A 431 -19.150 -5.538 -17.468 1.00 19.51 H new ATOM 368 N GLN A 432 -17.957 -5.468 -14.557 1.00 18.65 N ATOM 369 CA GLN A 432 -16.721 -5.797 -13.860 1.00 22.22 C ATOM 370 C GLN A 432 -16.884 -5.630 -12.351 1.00 18.04 C ATOM 371 O GLN A 432 -16.824 -4.517 -11.823 1.00 18.35 O ATOM 372 CB GLN A 432 -15.594 -4.903 -14.368 1.00 25.98 C ATOM 373 CG GLN A 432 -14.252 -5.171 -13.718 1.00 37.14 C ATOM 374 CD GLN A 432 -13.097 -4.653 -14.554 1.00 43.46 C ATOM 375 OE1 GLN A 432 -12.581 -3.556 -14.314 1.00 46.48 O ATOM 376 NE2 GLN A 432 -12.683 -5.440 -15.545 1.00 46.74 N ATOM 0 H GLN A 432 -18.074 -4.628 -14.697 1.00 18.65 H new ATOM 0 HA GLN A 432 -16.503 -6.725 -14.038 1.00 22.22 H new ATOM 0 HB2 GLN A 432 -15.508 -5.021 -15.327 1.00 25.98 H new ATOM 0 HB3 GLN A 432 -15.836 -3.976 -14.217 1.00 25.98 H new ATOM 0 HG2 GLN A 432 -14.229 -4.753 -12.843 1.00 37.14 H new ATOM 0 HG3 GLN A 432 -14.146 -6.125 -13.579 1.00 37.14 H new ATOM 0 HE21 GLN A 432 -13.067 -6.197 -15.682 1.00 46.74 H new ATOM 0 HE22 GLN A 432 -12.032 -5.191 -16.048 1.00 46.74 H new ATOM 377 N VAL A 433 -17.095 -6.747 -11.667 1.00 19.00 N ATOM 378 CA VAL A 433 -17.279 -6.741 -10.219 1.00 19.77 C ATOM 379 C VAL A 433 -16.003 -7.200 -9.535 1.00 17.91 C ATOM 380 O VAL A 433 -15.517 -8.292 -9.807 1.00 19.35 O ATOM 381 CB VAL A 433 -18.406 -7.705 -9.780 1.00 19.88 C ATOM 382 CG1 VAL A 433 -18.730 -7.491 -8.299 1.00 16.85 C ATOM 383 CG2 VAL A 433 -19.638 -7.486 -10.631 1.00 20.98 C ATOM 0 H VAL A 433 -17.136 -7.528 -12.026 1.00 19.00 H new ATOM 0 HA VAL A 433 -17.511 -5.833 -9.967 1.00 19.77 H new ATOM 0 HB VAL A 433 -18.107 -8.620 -9.902 1.00 19.88 H new ATOM 0 HG11 VAL A 433 -19.437 -8.099 -8.031 1.00 16.85 H new ATOM 0 HG12 VAL A 433 -17.938 -7.663 -7.766 1.00 16.85 H new ATOM 0 HG13 VAL A 433 -19.021 -6.576 -8.160 1.00 16.85 H new ATOM 0 HG21 VAL A 433 -20.339 -8.094 -10.349 1.00 20.98 H new ATOM 0 HG22 VAL A 433 -19.944 -6.571 -10.529 1.00 20.98 H new ATOM 0 HG23 VAL A 433 -19.422 -7.652 -11.562 1.00 20.98 H new ATOM 384 N HIS A 434 -15.470 -6.367 -8.649 1.00 18.46 N ATOM 385 CA HIS A 434 -14.251 -6.709 -7.912 1.00 18.16 C ATOM 386 C HIS A 434 -14.614 -7.315 -6.560 1.00 16.68 C ATOM 387 O HIS A 434 -15.112 -6.618 -5.680 1.00 19.10 O ATOM 388 CB HIS A 434 -13.406 -5.463 -7.699 1.00 15.80 C ATOM 389 CG HIS A 434 -13.110 -4.723 -8.961 1.00 17.60 C ATOM 390 ND1 HIS A 434 -13.681 -3.505 -9.260 1.00 23.43 N ATOM 391 CD2 HIS A 434 -12.293 -5.020 -9.998 1.00 19.52 C ATOM 392 CE1 HIS A 434 -13.233 -3.084 -10.429 1.00 21.86 C ATOM 393 NE2 HIS A 434 -12.389 -3.985 -10.897 1.00 21.94 N ATOM 0 H HIS A 434 -15.797 -5.595 -8.457 1.00 18.46 H new ATOM 0 HA HIS A 434 -13.744 -7.355 -8.428 1.00 18.16 H new ATOM 0 HB2 HIS A 434 -13.866 -4.870 -7.085 1.00 15.80 H new ATOM 0 HB3 HIS A 434 -12.570 -5.716 -7.277 1.00 15.80 H new ATOM 0 HD2 HIS A 434 -11.766 -5.781 -10.086 1.00 19.52 H new ATOM 0 HE1 HIS A 434 -13.471 -2.290 -10.850 1.00 21.86 H new ATOM 0 HE2 HIS A 434 -11.967 -3.933 -11.645 1.00 21.94 H new ATOM 394 N GLU A 435 -14.364 -8.609 -6.400 1.00 16.89 N ATOM 395 CA GLU A 435 -14.677 -9.306 -5.157 1.00 19.87 C ATOM 396 C GLU A 435 -13.474 -9.339 -4.196 1.00 19.91 C ATOM 397 O GLU A 435 -12.321 -9.484 -4.617 1.00 17.96 O ATOM 398 CB GLU A 435 -15.151 -10.733 -5.472 1.00 23.66 C ATOM 399 CG GLU A 435 -15.584 -11.550 -4.255 1.00 32.16 C ATOM 400 CD GLU A 435 -15.580 -13.057 -4.511 1.00 37.26 C ATOM 401 OE1 GLU A 435 -15.523 -13.826 -3.528 1.00 41.76 O ATOM 402 OE2 GLU A 435 -15.635 -13.478 -5.689 1.00 40.30 O ATOM 0 H GLU A 435 -14.010 -9.107 -7.005 1.00 16.89 H new ATOM 0 HA GLU A 435 -15.386 -8.818 -4.710 1.00 19.87 H new ATOM 0 HB2 GLU A 435 -15.894 -10.683 -6.093 1.00 23.66 H new ATOM 0 HB3 GLU A 435 -14.435 -11.205 -5.924 1.00 23.66 H new ATOM 0 HG2 GLU A 435 -14.992 -11.352 -3.512 1.00 32.16 H new ATOM 0 HG3 GLU A 435 -16.475 -11.275 -3.988 1.00 32.16 H new ATOM 403 N PHE A 436 -13.761 -9.203 -2.905 1.00 17.67 N ATOM 404 CA PHE A 436 -12.732 -9.203 -1.876 1.00 17.61 C ATOM 405 C PHE A 436 -13.178 -10.031 -0.683 1.00 18.27 C ATOM 406 O PHE A 436 -14.351 -10.022 -0.321 1.00 19.34 O ATOM 407 CB PHE A 436 -12.445 -7.770 -1.441 1.00 16.88 C ATOM 408 CG PHE A 436 -11.861 -6.916 -2.528 1.00 17.88 C ATOM 409 CD1 PHE A 436 -10.514 -7.031 -2.876 1.00 18.50 C ATOM 410 CD2 PHE A 436 -12.648 -5.976 -3.189 1.00 18.70 C ATOM 411 CE1 PHE A 436 -9.956 -6.218 -3.870 1.00 16.95 C ATOM 412 CE2 PHE A 436 -12.105 -5.156 -4.185 1.00 16.71 C ATOM 413 CZ PHE A 436 -10.756 -5.277 -4.523 1.00 19.24 C ATOM 0 H PHE A 436 -14.560 -9.108 -2.602 1.00 17.67 H new ATOM 0 HA PHE A 436 -11.923 -9.596 -2.238 1.00 17.61 H new ATOM 0 HB2 PHE A 436 -13.269 -7.364 -1.129 1.00 16.88 H new ATOM 0 HB3 PHE A 436 -11.833 -7.785 -0.688 1.00 16.88 H new ATOM 0 HD1 PHE A 436 -9.980 -7.656 -2.442 1.00 18.50 H new ATOM 0 HD2 PHE A 436 -13.547 -5.892 -2.965 1.00 18.70 H new ATOM 0 HE1 PHE A 436 -9.058 -6.304 -4.094 1.00 16.95 H new ATOM 0 HE2 PHE A 436 -12.641 -4.533 -4.620 1.00 16.71 H new ATOM 0 HZ PHE A 436 -10.390 -4.732 -5.182 1.00 19.24 H new ATOM 414 N LYS A 437 -12.243 -10.760 -0.080 1.00 18.17 N ATOM 415 CA LYS A 437 -12.557 -11.598 1.071 1.00 20.62 C ATOM 416 C LYS A 437 -11.741 -11.175 2.287 1.00 20.94 C ATOM 417 O LYS A 437 -10.559 -10.870 2.168 1.00 22.56 O ATOM 418 CB LYS A 437 -12.281 -13.063 0.742 1.00 23.71 C ATOM 419 CG LYS A 437 -13.072 -13.585 -0.446 1.00 25.79 C ATOM 420 CD LYS A 437 -13.868 -14.828 -0.091 1.00 28.85 C ATOM 421 CE LYS A 437 -14.578 -15.404 -1.312 1.00 30.12 C ATOM 422 NZ LYS A 437 -13.608 -15.855 -2.351 1.00 34.21 N ATOM 0 H LYS A 437 -11.418 -10.783 -0.323 1.00 18.17 H new ATOM 0 HA LYS A 437 -13.498 -11.490 1.280 1.00 20.62 H new ATOM 0 HB2 LYS A 437 -11.334 -13.172 0.562 1.00 23.71 H new ATOM 0 HB3 LYS A 437 -12.487 -13.605 1.520 1.00 23.71 H new ATOM 0 HG2 LYS A 437 -13.675 -12.894 -0.762 1.00 25.79 H new ATOM 0 HG3 LYS A 437 -12.465 -13.787 -1.175 1.00 25.79 H new ATOM 0 HD2 LYS A 437 -13.275 -15.497 0.286 1.00 28.85 H new ATOM 0 HD3 LYS A 437 -14.521 -14.611 0.592 1.00 28.85 H new ATOM 0 HE2 LYS A 437 -15.134 -16.152 -1.041 1.00 30.12 H new ATOM 0 HE3 LYS A 437 -15.169 -14.734 -1.689 1.00 30.12 H new ATOM 0 HZ1 LYS A 437 -14.025 -16.374 -2.941 1.00 34.21 H new ATOM 0 HZ2 LYS A 437 -13.268 -15.146 -2.768 1.00 34.21 H new ATOM 0 HZ3 LYS A 437 -12.951 -16.314 -1.965 1.00 34.21 H new ATOM 423 N PHE A 438 -12.381 -11.156 3.453 1.00 19.24 N ATOM 424 CA PHE A 438 -11.729 -10.760 4.698 1.00 16.83 C ATOM 425 C PHE A 438 -12.239 -11.602 5.859 1.00 18.44 C ATOM 426 O PHE A 438 -13.271 -12.260 5.760 1.00 18.33 O ATOM 427 CB PHE A 438 -12.011 -9.287 4.995 1.00 17.66 C ATOM 428 CG PHE A 438 -11.497 -8.349 3.947 1.00 18.97 C ATOM 429 CD1 PHE A 438 -10.137 -8.076 3.851 1.00 21.91 C ATOM 430 CD2 PHE A 438 -12.371 -7.725 3.062 1.00 18.97 C ATOM 431 CE1 PHE A 438 -9.659 -7.196 2.886 1.00 23.86 C ATOM 432 CE2 PHE A 438 -11.904 -6.844 2.094 1.00 17.74 C ATOM 433 CZ PHE A 438 -10.547 -6.577 2.005 1.00 23.24 C ATOM 0 H PHE A 438 -13.208 -11.373 3.545 1.00 19.24 H new ATOM 0 HA PHE A 438 -10.774 -10.897 4.595 1.00 16.83 H new ATOM 0 HB2 PHE A 438 -12.968 -9.162 5.087 1.00 17.66 H new ATOM 0 HB3 PHE A 438 -11.611 -9.056 5.848 1.00 17.66 H new ATOM 0 HD1 PHE A 438 -9.542 -8.485 4.437 1.00 21.91 H new ATOM 0 HD2 PHE A 438 -13.283 -7.900 3.119 1.00 18.97 H new ATOM 0 HE1 PHE A 438 -8.748 -7.020 2.828 1.00 23.86 H new ATOM 0 HE2 PHE A 438 -12.500 -6.435 1.508 1.00 17.74 H new ATOM 0 HZ PHE A 438 -10.229 -5.987 1.360 1.00 23.24 H new ATOM 434 N ASP A 439 -11.516 -11.579 6.970 1.00 17.83 N ATOM 435 CA ASP A 439 -11.928 -12.348 8.134 1.00 17.46 C ATOM 436 C ASP A 439 -13.182 -11.732 8.723 1.00 14.62 C ATOM 437 O ASP A 439 -13.978 -12.414 9.361 1.00 15.39 O ATOM 438 CB ASP A 439 -10.805 -12.373 9.163 1.00 17.32 C ATOM 439 CG ASP A 439 -9.546 -12.988 8.611 1.00 14.97 C ATOM 440 OD1 ASP A 439 -9.498 -14.229 8.475 1.00 15.54 O ATOM 441 OD2 ASP A 439 -8.613 -12.226 8.294 1.00 16.61 O ATOM 0 H ASP A 439 -10.790 -11.129 7.070 1.00 17.83 H new ATOM 0 HA ASP A 439 -12.120 -13.262 7.872 1.00 17.46 H new ATOM 0 HB2 ASP A 439 -10.619 -11.468 9.459 1.00 17.32 H new ATOM 0 HB3 ASP A 439 -11.093 -12.873 9.943 1.00 17.32 H new ATOM 442 N LYS A 440 -13.355 -10.438 8.484 1.00 15.10 N ATOM 443 CA LYS A 440 -14.519 -9.715 8.964 1.00 17.93 C ATOM 444 C LYS A 440 -14.655 -8.364 8.266 1.00 15.86 C ATOM 445 O LYS A 440 -13.665 -7.689 7.996 1.00 16.68 O ATOM 446 CB LYS A 440 -14.421 -9.511 10.475 1.00 21.20 C ATOM 447 CG LYS A 440 -15.360 -8.455 11.014 1.00 26.18 C ATOM 448 CD LYS A 440 -16.571 -9.097 11.659 1.00 30.71 C ATOM 449 CE LYS A 440 -17.805 -8.204 11.557 1.00 32.47 C ATOM 450 NZ LYS A 440 -19.046 -9.020 11.392 1.00 37.74 N ATOM 0 H LYS A 440 -12.799 -9.956 8.038 1.00 15.10 H new ATOM 0 HA LYS A 440 -15.307 -10.243 8.760 1.00 17.93 H new ATOM 0 HB2 LYS A 440 -14.607 -10.353 10.919 1.00 21.20 H new ATOM 0 HB3 LYS A 440 -13.510 -9.267 10.701 1.00 21.20 H new ATOM 0 HG2 LYS A 440 -14.896 -7.903 11.663 1.00 26.18 H new ATOM 0 HG3 LYS A 440 -15.643 -7.869 10.295 1.00 26.18 H new ATOM 0 HD2 LYS A 440 -16.752 -9.949 11.232 1.00 30.71 H new ATOM 0 HD3 LYS A 440 -16.381 -9.282 12.592 1.00 30.71 H new ATOM 0 HE2 LYS A 440 -17.878 -7.656 12.354 1.00 32.47 H new ATOM 0 HE3 LYS A 440 -17.709 -7.599 10.805 1.00 32.47 H new ATOM 0 HZ1 LYS A 440 -19.751 -8.480 11.335 1.00 37.74 H new ATOM 0 HZ2 LYS A 440 -18.985 -9.507 10.650 1.00 37.74 H new ATOM 0 HZ3 LYS A 440 -19.142 -9.560 12.093 1.00 37.74 H new ATOM 451 N ILE A 441 -15.891 -7.979 7.955 1.00 16.41 N ATOM 452 CA ILE A 441 -16.136 -6.696 7.313 1.00 15.71 C ATOM 453 C ILE A 441 -17.149 -5.914 8.118 1.00 15.05 C ATOM 454 O ILE A 441 -18.229 -6.410 8.415 1.00 16.42 O ATOM 455 CB ILE A 441 -16.682 -6.848 5.875 1.00 14.95 C ATOM 456 CG1 ILE A 441 -15.694 -7.648 5.025 1.00 16.01 C ATOM 457 CG2 ILE A 441 -16.916 -5.465 5.261 1.00 12.34 C ATOM 458 CD1 ILE A 441 -16.213 -8.001 3.647 1.00 18.36 C ATOM 0 H ILE A 441 -16.597 -8.446 8.108 1.00 16.41 H new ATOM 0 HA ILE A 441 -15.284 -6.235 7.270 1.00 15.71 H new ATOM 0 HB ILE A 441 -17.526 -7.325 5.901 1.00 14.95 H new ATOM 0 HG12 ILE A 441 -14.875 -7.137 4.931 1.00 16.01 H new ATOM 0 HG13 ILE A 441 -15.466 -8.466 5.494 1.00 16.01 H new ATOM 0 HG21 ILE A 441 -17.258 -5.565 4.359 1.00 12.34 H new ATOM 0 HG22 ILE A 441 -17.559 -4.977 5.798 1.00 12.34 H new ATOM 0 HG23 ILE A 441 -16.079 -4.976 5.236 1.00 12.34 H new ATOM 0 HD11 ILE A 441 -15.538 -8.505 3.166 1.00 18.36 H new ATOM 0 HD12 ILE A 441 -17.017 -8.537 3.731 1.00 18.36 H new ATOM 0 HD13 ILE A 441 -16.417 -7.187 3.160 1.00 18.36 H new ATOM 459 N PHE A 442 -16.792 -4.691 8.484 1.00 14.95 N ATOM 460 CA PHE A 442 -17.700 -3.836 9.234 1.00 16.07 C ATOM 461 C PHE A 442 -18.258 -2.798 8.268 1.00 14.36 C ATOM 462 O PHE A 442 -17.509 -2.213 7.488 1.00 11.65 O ATOM 463 CB PHE A 442 -16.964 -3.123 10.379 1.00 16.87 C ATOM 464 CG PHE A 442 -16.235 -4.052 11.311 1.00 19.15 C ATOM 465 CD1 PHE A 442 -16.895 -4.636 12.387 1.00 18.73 C ATOM 466 CD2 PHE A 442 -14.879 -4.329 11.123 1.00 18.34 C ATOM 467 CE1 PHE A 442 -16.219 -5.480 13.273 1.00 21.40 C ATOM 468 CE2 PHE A 442 -14.188 -5.170 11.996 1.00 18.67 C ATOM 469 CZ PHE A 442 -14.860 -5.751 13.078 1.00 20.62 C ATOM 0 H PHE A 442 -16.028 -4.337 8.308 1.00 14.95 H new ATOM 0 HA PHE A 442 -18.409 -4.372 9.623 1.00 16.07 H new ATOM 0 HB2 PHE A 442 -16.329 -2.495 10.001 1.00 16.87 H new ATOM 0 HB3 PHE A 442 -17.605 -2.605 10.890 1.00 16.87 H new ATOM 0 HD1 PHE A 442 -17.799 -4.463 12.519 1.00 18.73 H new ATOM 0 HD2 PHE A 442 -14.429 -3.947 10.404 1.00 18.34 H new ATOM 0 HE1 PHE A 442 -16.672 -5.861 13.991 1.00 21.40 H new ATOM 0 HE2 PHE A 442 -13.285 -5.344 11.860 1.00 18.67 H new ATOM 0 HZ PHE A 442 -14.406 -6.313 13.663 1.00 20.62 H new ATOM 470 N ASP A 443 -19.568 -2.562 8.319 1.00 15.07 N ATOM 471 CA ASP A 443 -20.180 -1.583 7.428 1.00 14.73 C ATOM 472 C ASP A 443 -20.549 -0.281 8.131 1.00 16.27 C ATOM 473 O ASP A 443 -20.251 -0.092 9.313 1.00 16.40 O ATOM 474 CB ASP A 443 -21.414 -2.184 6.746 1.00 16.07 C ATOM 475 CG ASP A 443 -22.475 -2.614 7.734 1.00 16.72 C ATOM 476 OD1 ASP A 443 -22.670 -1.913 8.748 1.00 18.53 O ATOM 477 OD2 ASP A 443 -23.115 -3.658 7.493 1.00 20.70 O ATOM 0 H ASP A 443 -20.113 -2.954 8.856 1.00 15.07 H new ATOM 0 HA ASP A 443 -19.512 -1.360 6.761 1.00 14.73 H new ATOM 0 HB2 ASP A 443 -21.791 -1.532 6.135 1.00 16.07 H new ATOM 0 HB3 ASP A 443 -21.144 -2.949 6.213 1.00 16.07 H new ATOM 478 N GLN A 444 -21.200 0.620 7.400 1.00 14.75 N ATOM 479 CA GLN A 444 -21.587 1.912 7.940 1.00 14.54 C ATOM 480 C GLN A 444 -22.364 1.808 9.248 1.00 13.44 C ATOM 481 O GLN A 444 -22.398 2.761 10.015 1.00 15.47 O ATOM 482 CB GLN A 444 -22.411 2.695 6.910 1.00 16.80 C ATOM 483 CG GLN A 444 -21.801 2.731 5.510 1.00 20.50 C ATOM 484 CD GLN A 444 -22.455 3.769 4.586 1.00 24.68 C ATOM 485 OE1 GLN A 444 -22.804 4.879 5.007 1.00 23.70 O ATOM 486 NE2 GLN A 444 -22.616 3.405 3.317 1.00 24.85 N ATOM 0 H GLN A 444 -21.428 0.497 6.580 1.00 14.75 H new ATOM 0 HA GLN A 444 -20.763 2.384 8.136 1.00 14.54 H new ATOM 0 HB2 GLN A 444 -23.297 2.303 6.855 1.00 16.80 H new ATOM 0 HB3 GLN A 444 -22.523 3.605 7.226 1.00 16.80 H new ATOM 0 HG2 GLN A 444 -20.853 2.924 5.582 1.00 20.50 H new ATOM 0 HG3 GLN A 444 -21.882 1.853 5.107 1.00 20.50 H new ATOM 0 HE21 GLN A 444 -22.362 2.625 3.058 1.00 24.85 H new ATOM 0 HE22 GLN A 444 -22.974 3.949 2.756 1.00 24.85 H new ATOM 487 N GLN A 445 -22.965 0.650 9.505 1.00 14.49 N ATOM 488 CA GLN A 445 -23.755 0.444 10.725 1.00 18.14 C ATOM 489 C GLN A 445 -22.934 0.039 11.943 1.00 17.47 C ATOM 490 O GLN A 445 -23.400 0.137 13.078 1.00 20.15 O ATOM 491 CB GLN A 445 -24.839 -0.620 10.496 1.00 18.83 C ATOM 492 CG GLN A 445 -25.685 -0.403 9.248 1.00 25.46 C ATOM 493 CD GLN A 445 -26.898 0.463 9.504 1.00 24.57 C ATOM 494 OE1 GLN A 445 -26.836 1.430 10.263 1.00 26.65 O ATOM 495 NE2 GLN A 445 -28.012 0.118 8.871 1.00 25.45 N ATOM 0 H GLN A 445 -22.930 -0.034 8.985 1.00 14.49 H new ATOM 0 HA GLN A 445 -24.148 1.310 10.916 1.00 18.14 H new ATOM 0 HB2 GLN A 445 -24.415 -1.490 10.438 1.00 18.83 H new ATOM 0 HB3 GLN A 445 -25.424 -0.641 11.270 1.00 18.83 H new ATOM 0 HG2 GLN A 445 -25.139 0.008 8.560 1.00 25.46 H new ATOM 0 HG3 GLN A 445 -25.974 -1.263 8.905 1.00 25.46 H new ATOM 0 HE21 GLN A 445 -28.016 -0.565 8.348 1.00 25.45 H new ATOM 0 HE22 GLN A 445 -28.730 0.577 8.983 1.00 25.45 H new ATOM 496 N ASP A 446 -21.714 -0.420 11.709 1.00 16.12 N ATOM 497 CA ASP A 446 -20.850 -0.847 12.795 1.00 14.11 C ATOM 498 C ASP A 446 -20.165 0.325 13.485 1.00 13.72 C ATOM 499 O ASP A 446 -19.447 1.107 12.862 1.00 15.93 O ATOM 500 CB ASP A 446 -19.821 -1.841 12.265 1.00 13.55 C ATOM 501 CG ASP A 446 -20.433 -3.186 11.964 1.00 14.09 C ATOM 502 OD1 ASP A 446 -21.113 -3.723 12.851 1.00 17.48 O ATOM 503 OD2 ASP A 446 -20.250 -3.717 10.854 1.00 15.73 O ATOM 0 H ASP A 446 -21.367 -0.492 10.925 1.00 16.12 H new ATOM 0 HA ASP A 446 -21.403 -1.278 13.466 1.00 14.11 H new ATOM 0 HB2 ASP A 446 -19.414 -1.485 11.460 1.00 13.55 H new ATOM 0 HB3 ASP A 446 -19.111 -1.949 12.918 1.00 13.55 H new ATOM 504 N THR A 447 -20.415 0.447 14.784 1.00 10.87 N ATOM 505 CA THR A 447 -19.829 1.507 15.592 1.00 10.19 C ATOM 506 C THR A 447 -18.475 1.025 16.105 1.00 7.64 C ATOM 507 O THR A 447 -18.109 -0.136 15.911 1.00 8.92 O ATOM 508 CB THR A 447 -20.702 1.841 16.825 1.00 8.43 C ATOM 509 OG1 THR A 447 -20.691 0.731 17.731 1.00 10.48 O ATOM 510 CG2 THR A 447 -22.138 2.123 16.407 1.00 12.67 C ATOM 0 H THR A 447 -20.931 -0.084 15.222 1.00 10.87 H new ATOM 0 HA THR A 447 -19.753 2.300 15.038 1.00 10.19 H new ATOM 0 HB THR A 447 -20.338 2.630 17.256 1.00 8.43 H new ATOM 0 HG1 THR A 447 -21.164 0.912 18.402 1.00 10.48 H new ATOM 0 HG21 THR A 447 -22.669 2.330 17.192 1.00 12.67 H new ATOM 0 HG22 THR A 447 -22.156 2.877 15.797 1.00 12.67 H new ATOM 0 HG23 THR A 447 -22.506 1.342 15.965 1.00 12.67 H new ATOM 511 N ASN A 448 -17.747 1.922 16.760 1.00 12.79 N ATOM 512 CA ASN A 448 -16.449 1.575 17.322 1.00 11.93 C ATOM 513 C ASN A 448 -16.693 0.493 18.365 1.00 12.59 C ATOM 514 O ASN A 448 -15.944 -0.483 18.455 1.00 10.88 O ATOM 515 CB ASN A 448 -15.788 2.814 17.941 1.00 12.51 C ATOM 516 CG ASN A 448 -15.038 3.658 16.901 1.00 11.23 C ATOM 517 OD1 ASN A 448 -15.049 3.348 15.712 1.00 15.76 O ATOM 518 ND2 ASN A 448 -14.392 4.724 17.350 1.00 8.57 N ATOM 0 H ASN A 448 -17.987 2.737 16.890 1.00 12.79 H new ATOM 0 HA ASN A 448 -15.844 1.249 16.638 1.00 11.93 H new ATOM 0 HB2 ASN A 448 -16.466 3.360 18.369 1.00 12.51 H new ATOM 0 HB3 ASN A 448 -15.170 2.535 18.634 1.00 12.51 H new ATOM 0 HD21 ASN A 448 -13.960 5.227 16.802 1.00 8.57 H new ATOM 0 HD22 ASN A 448 -14.405 4.913 18.189 1.00 8.57 H new ATOM 519 N VAL A 449 -17.768 0.643 19.134 1.00 10.11 N ATOM 520 CA VAL A 449 -18.087 -0.356 20.140 1.00 9.91 C ATOM 521 C VAL A 449 -18.290 -1.711 19.469 1.00 11.01 C ATOM 522 O VAL A 449 -17.885 -2.749 19.992 1.00 10.86 O ATOM 523 CB VAL A 449 -19.362 0.022 20.925 1.00 10.85 C ATOM 524 CG1 VAL A 449 -19.954 -1.212 21.578 1.00 12.40 C ATOM 525 CG2 VAL A 449 -19.031 1.073 21.968 1.00 12.73 C ATOM 0 H VAL A 449 -18.315 1.305 19.089 1.00 10.11 H new ATOM 0 HA VAL A 449 -17.346 -0.400 20.765 1.00 9.91 H new ATOM 0 HB VAL A 449 -20.018 0.389 20.313 1.00 10.85 H new ATOM 0 HG11 VAL A 449 -20.754 -0.966 22.069 1.00 12.40 H new ATOM 0 HG12 VAL A 449 -20.181 -1.862 20.895 1.00 12.40 H new ATOM 0 HG13 VAL A 449 -19.306 -1.598 22.188 1.00 12.40 H new ATOM 0 HG21 VAL A 449 -19.835 1.307 22.458 1.00 12.73 H new ATOM 0 HG22 VAL A 449 -18.368 0.721 22.583 1.00 12.73 H new ATOM 0 HG23 VAL A 449 -18.678 1.863 21.530 1.00 12.73 H new ATOM 526 N ASP A 450 -18.925 -1.698 18.302 1.00 11.44 N ATOM 527 CA ASP A 450 -19.164 -2.926 17.558 1.00 12.30 C ATOM 528 C ASP A 450 -17.846 -3.516 17.076 1.00 10.40 C ATOM 529 O ASP A 450 -17.641 -4.728 17.116 1.00 11.73 O ATOM 530 CB ASP A 450 -20.053 -2.637 16.355 1.00 14.01 C ATOM 531 CG ASP A 450 -21.456 -2.296 16.760 1.00 15.18 C ATOM 532 OD1 ASP A 450 -21.977 -2.995 17.652 1.00 18.06 O ATOM 533 OD2 ASP A 450 -22.020 -1.338 16.197 1.00 18.72 O ATOM 0 H ASP A 450 -19.226 -0.986 17.924 1.00 11.44 H new ATOM 0 HA ASP A 450 -19.604 -3.562 18.144 1.00 12.30 H new ATOM 0 HB2 ASP A 450 -19.677 -1.902 15.845 1.00 14.01 H new ATOM 0 HB3 ASP A 450 -20.065 -3.411 15.770 1.00 14.01 H new ATOM 534 N VAL A 451 -16.962 -2.646 16.610 1.00 12.78 N ATOM 535 CA VAL A 451 -15.658 -3.075 16.115 1.00 12.98 C ATOM 536 C VAL A 451 -14.842 -3.753 17.224 1.00 11.93 C ATOM 537 O VAL A 451 -14.305 -4.840 17.029 1.00 11.01 O ATOM 538 CB VAL A 451 -14.851 -1.872 15.565 1.00 13.79 C ATOM 539 CG1 VAL A 451 -13.372 -2.239 15.467 1.00 15.53 C ATOM 540 CG2 VAL A 451 -15.391 -1.453 14.202 1.00 11.89 C ATOM 0 H VAL A 451 -17.097 -1.798 16.571 1.00 12.78 H new ATOM 0 HA VAL A 451 -15.819 -3.711 15.400 1.00 12.98 H new ATOM 0 HB VAL A 451 -14.946 -1.123 16.174 1.00 13.79 H new ATOM 0 HG11 VAL A 451 -12.873 -1.482 15.122 1.00 15.53 H new ATOM 0 HG12 VAL A 451 -13.037 -2.473 16.347 1.00 15.53 H new ATOM 0 HG13 VAL A 451 -13.265 -2.996 14.869 1.00 15.53 H new ATOM 0 HG21 VAL A 451 -14.879 -0.700 13.868 1.00 11.89 H new ATOM 0 HG22 VAL A 451 -15.316 -2.195 13.582 1.00 11.89 H new ATOM 0 HG23 VAL A 451 -16.323 -1.197 14.288 1.00 11.89 H new ATOM 541 N PHE A 452 -14.783 -3.131 18.397 1.00 12.25 N ATOM 542 CA PHE A 452 -13.995 -3.703 19.483 1.00 14.73 C ATOM 543 C PHE A 452 -14.454 -5.080 19.929 1.00 16.37 C ATOM 544 O PHE A 452 -13.665 -5.862 20.457 1.00 15.97 O ATOM 545 CB PHE A 452 -13.939 -2.761 20.692 1.00 14.13 C ATOM 546 CG PHE A 452 -12.845 -3.116 21.664 1.00 15.35 C ATOM 547 CD1 PHE A 452 -11.509 -2.876 21.337 1.00 14.36 C ATOM 548 CD2 PHE A 452 -13.137 -3.764 22.865 1.00 15.00 C ATOM 549 CE1 PHE A 452 -10.474 -3.283 22.188 1.00 11.50 C ATOM 550 CE2 PHE A 452 -12.115 -4.177 23.727 1.00 13.26 C ATOM 551 CZ PHE A 452 -10.779 -3.936 23.385 1.00 13.85 C ATOM 0 H PHE A 452 -15.183 -2.392 18.583 1.00 12.25 H new ATOM 0 HA PHE A 452 -13.106 -3.813 19.111 1.00 14.73 H new ATOM 0 HB2 PHE A 452 -13.806 -1.852 20.381 1.00 14.13 H new ATOM 0 HB3 PHE A 452 -14.793 -2.782 21.152 1.00 14.13 H new ATOM 0 HD1 PHE A 452 -11.303 -2.439 20.542 1.00 14.36 H new ATOM 0 HD2 PHE A 452 -14.024 -3.924 23.096 1.00 15.00 H new ATOM 0 HE1 PHE A 452 -9.588 -3.119 21.958 1.00 11.50 H new ATOM 0 HE2 PHE A 452 -12.322 -4.610 24.524 1.00 13.26 H new ATOM 0 HZ PHE A 452 -10.096 -4.210 23.953 1.00 13.85 H new ATOM 552 N LYS A 453 -15.730 -5.386 19.718 1.00 17.71 N ATOM 553 CA LYS A 453 -16.256 -6.691 20.094 1.00 17.91 C ATOM 554 C LYS A 453 -15.455 -7.795 19.407 1.00 16.40 C ATOM 555 O LYS A 453 -15.448 -8.936 19.855 1.00 18.13 O ATOM 556 CB LYS A 453 -17.729 -6.811 19.699 1.00 20.33 C ATOM 557 CG LYS A 453 -18.674 -5.949 20.529 1.00 22.79 C ATOM 558 CD LYS A 453 -20.119 -6.436 20.399 1.00 26.83 C ATOM 559 CE LYS A 453 -21.125 -5.287 20.426 1.00 28.69 C ATOM 560 NZ LYS A 453 -22.279 -5.553 19.505 1.00 35.98 N ATOM 0 H LYS A 453 -16.304 -4.855 19.360 1.00 17.71 H new ATOM 0 HA LYS A 453 -16.179 -6.785 21.056 1.00 17.91 H new ATOM 0 HB2 LYS A 453 -17.823 -6.568 18.765 1.00 20.33 H new ATOM 0 HB3 LYS A 453 -18.000 -7.739 19.779 1.00 20.33 H new ATOM 0 HG2 LYS A 453 -18.404 -5.972 21.460 1.00 22.79 H new ATOM 0 HG3 LYS A 453 -18.613 -5.025 20.239 1.00 22.79 H new ATOM 0 HD2 LYS A 453 -20.218 -6.930 19.570 1.00 26.83 H new ATOM 0 HD3 LYS A 453 -20.316 -7.052 21.122 1.00 26.83 H new ATOM 0 HE2 LYS A 453 -21.452 -5.162 21.330 1.00 28.69 H new ATOM 0 HE3 LYS A 453 -20.685 -4.462 20.167 1.00 28.69 H new ATOM 0 HZ1 LYS A 453 -22.365 -4.876 18.934 1.00 35.98 H new ATOM 0 HZ2 LYS A 453 -22.131 -6.305 19.053 1.00 35.98 H new ATOM 0 HZ3 LYS A 453 -23.026 -5.636 19.981 1.00 35.98 H new ATOM 561 N GLU A 454 -14.776 -7.461 18.318 1.00 16.93 N ATOM 562 CA GLU A 454 -13.984 -8.455 17.604 1.00 20.00 C ATOM 563 C GLU A 454 -12.495 -8.275 17.886 1.00 20.49 C ATOM 564 O GLU A 454 -11.674 -9.093 17.490 1.00 24.14 O ATOM 565 CB GLU A 454 -14.230 -8.342 16.101 1.00 22.50 C ATOM 566 CG GLU A 454 -15.670 -8.594 15.683 1.00 25.61 C ATOM 567 CD GLU A 454 -16.044 -10.069 15.721 1.00 28.64 C ATOM 568 OE1 GLU A 454 -15.257 -10.882 16.246 1.00 30.73 O ATOM 569 OE2 GLU A 454 -17.135 -10.416 15.222 1.00 33.61 O ATOM 0 H GLU A 454 -14.759 -6.672 17.977 1.00 16.93 H new ATOM 0 HA GLU A 454 -14.256 -9.333 17.915 1.00 20.00 H new ATOM 0 HB2 GLU A 454 -13.969 -7.455 15.807 1.00 22.50 H new ATOM 0 HB3 GLU A 454 -13.655 -8.974 15.641 1.00 22.50 H new ATOM 0 HG2 GLU A 454 -16.264 -8.099 16.268 1.00 25.61 H new ATOM 0 HG3 GLU A 454 -15.807 -8.253 14.785 1.00 25.61 H new ATOM 570 N VAL A 455 -12.157 -7.201 18.582 1.00 21.23 N ATOM 571 CA VAL A 455 -10.765 -6.897 18.888 1.00 20.31 C ATOM 572 C VAL A 455 -10.356 -7.281 20.313 1.00 23.64 C ATOM 573 O VAL A 455 -9.192 -7.622 20.570 1.00 21.74 O ATOM 574 CB VAL A 455 -10.511 -5.392 18.681 1.00 18.28 C ATOM 575 CG1 VAL A 455 -9.109 -5.014 19.154 1.00 18.05 C ATOM 576 CG2 VAL A 455 -10.710 -5.043 17.221 1.00 19.72 C ATOM 0 H VAL A 455 -12.722 -6.630 18.889 1.00 21.23 H new ATOM 0 HA VAL A 455 -10.226 -7.431 18.284 1.00 20.31 H new ATOM 0 HB VAL A 455 -11.145 -4.883 19.211 1.00 18.28 H new ATOM 0 HG11 VAL A 455 -8.966 -4.064 19.017 1.00 18.05 H new ATOM 0 HG12 VAL A 455 -9.019 -5.221 20.097 1.00 18.05 H new ATOM 0 HG13 VAL A 455 -8.451 -5.516 18.649 1.00 18.05 H new ATOM 0 HG21 VAL A 455 -10.550 -4.095 17.090 1.00 19.72 H new ATOM 0 HG22 VAL A 455 -10.089 -5.553 16.678 1.00 19.72 H new ATOM 0 HG23 VAL A 455 -11.619 -5.257 16.958 1.00 19.72 H new ATOM 577 N GLY A 456 -11.319 -7.225 21.233 1.00 24.04 N ATOM 578 CA GLY A 456 -11.059 -7.536 22.630 1.00 21.66 C ATOM 579 C GLY A 456 -10.295 -8.811 22.928 1.00 21.44 C ATOM 580 O GLY A 456 -9.372 -8.805 23.739 1.00 20.09 O ATOM 0 H GLY A 456 -12.133 -7.007 21.063 1.00 24.04 H new ATOM 0 HA2 GLY A 456 -10.567 -6.794 23.016 1.00 21.66 H new ATOM 0 HA3 GLY A 456 -11.911 -7.582 23.091 1.00 21.66 H new ATOM 581 N GLN A 457 -10.673 -9.909 22.289 1.00 21.34 N ATOM 582 CA GLN A 457 -10.003 -11.178 22.533 1.00 23.88 C ATOM 583 C GLN A 457 -8.581 -11.159 22.009 1.00 23.00 C ATOM 584 O GLN A 457 -7.725 -11.903 22.492 1.00 25.17 O ATOM 585 CB GLN A 457 -10.777 -12.331 21.888 1.00 27.87 C ATOM 586 CG GLN A 457 -11.490 -13.222 22.890 1.00 33.80 C ATOM 587 CD GLN A 457 -12.561 -14.078 22.245 1.00 39.64 C ATOM 588 OE1 GLN A 457 -13.540 -13.564 21.701 1.00 43.44 O ATOM 589 NE2 GLN A 457 -12.379 -15.391 22.299 1.00 40.55 N ATOM 0 H GLN A 457 -11.311 -9.942 21.713 1.00 21.34 H new ATOM 0 HA GLN A 457 -9.975 -11.313 23.493 1.00 23.88 H new ATOM 0 HB2 GLN A 457 -11.429 -11.966 21.270 1.00 27.87 H new ATOM 0 HB3 GLN A 457 -10.163 -12.871 21.367 1.00 27.87 H new ATOM 0 HG2 GLN A 457 -10.841 -13.796 23.327 1.00 33.80 H new ATOM 0 HG3 GLN A 457 -11.892 -12.671 23.580 1.00 33.80 H new ATOM 0 HE21 GLN A 457 -11.683 -15.713 22.688 1.00 40.55 H new ATOM 0 HE22 GLN A 457 -12.957 -15.920 21.945 1.00 40.55 H new ATOM 590 N LEU A 458 -8.326 -10.304 21.026 1.00 21.08 N ATOM 591 CA LEU A 458 -6.994 -10.201 20.446 1.00 20.39 C ATOM 592 C LEU A 458 -6.036 -9.500 21.397 1.00 19.12 C ATOM 593 O LEU A 458 -4.974 -10.032 21.710 1.00 19.14 O ATOM 594 CB LEU A 458 -7.040 -9.431 19.128 1.00 18.89 C ATOM 595 CG LEU A 458 -5.693 -9.170 18.451 1.00 17.29 C ATOM 596 CD1 LEU A 458 -5.083 -10.487 18.005 1.00 18.51 C ATOM 597 CD2 LEU A 458 -5.885 -8.229 17.270 1.00 16.78 C ATOM 0 H LEU A 458 -8.910 -9.775 20.681 1.00 21.08 H new ATOM 0 HA LEU A 458 -6.676 -11.103 20.284 1.00 20.39 H new ATOM 0 HB2 LEU A 458 -7.603 -9.921 18.508 1.00 18.89 H new ATOM 0 HB3 LEU A 458 -7.471 -8.577 19.289 1.00 18.89 H new ATOM 0 HG LEU A 458 -5.086 -8.749 19.080 1.00 17.29 H new ATOM 0 HD11 LEU A 458 -4.229 -10.320 17.576 1.00 18.51 H new ATOM 0 HD12 LEU A 458 -4.950 -11.060 18.776 1.00 18.51 H new ATOM 0 HD13 LEU A 458 -5.680 -10.924 17.377 1.00 18.51 H new ATOM 0 HD21 LEU A 458 -5.029 -8.066 16.843 1.00 16.78 H new ATOM 0 HD22 LEU A 458 -6.493 -8.632 16.630 1.00 16.78 H new ATOM 0 HD23 LEU A 458 -6.255 -7.389 17.582 1.00 16.78 H new ATOM 598 N VAL A 459 -6.420 -8.310 21.857 1.00 18.36 N ATOM 599 CA VAL A 459 -5.577 -7.526 22.751 1.00 17.93 C ATOM 600 C VAL A 459 -5.423 -8.120 24.145 1.00 18.58 C ATOM 601 O VAL A 459 -4.449 -7.834 24.836 1.00 18.99 O ATOM 602 CB VAL A 459 -6.087 -6.069 22.890 1.00 18.24 C ATOM 603 CG1 VAL A 459 -6.102 -5.390 21.523 1.00 15.93 C ATOM 604 CG2 VAL A 459 -7.465 -6.050 23.522 1.00 17.23 C ATOM 0 H VAL A 459 -7.170 -7.939 21.660 1.00 18.36 H new ATOM 0 HA VAL A 459 -4.705 -7.539 22.327 1.00 17.93 H new ATOM 0 HB VAL A 459 -5.485 -5.577 23.470 1.00 18.24 H new ATOM 0 HG11 VAL A 459 -6.422 -4.479 21.617 1.00 15.93 H new ATOM 0 HG12 VAL A 459 -5.204 -5.380 21.156 1.00 15.93 H new ATOM 0 HG13 VAL A 459 -6.690 -5.878 20.925 1.00 15.93 H new ATOM 0 HG21 VAL A 459 -7.772 -5.133 23.603 1.00 17.23 H new ATOM 0 HG22 VAL A 459 -8.083 -6.549 22.966 1.00 17.23 H new ATOM 0 HG23 VAL A 459 -7.423 -6.455 24.402 1.00 17.23 H new ATOM 605 N GLN A 460 -6.366 -8.952 24.568 1.00 18.38 N ATOM 606 CA GLN A 460 -6.243 -9.531 25.896 1.00 20.11 C ATOM 607 C GLN A 460 -5.206 -10.642 25.913 1.00 17.80 C ATOM 608 O GLN A 460 -4.753 -11.049 26.974 1.00 18.44 O ATOM 609 CB GLN A 460 -7.601 -10.031 26.411 1.00 19.91 C ATOM 610 CG GLN A 460 -8.002 -11.424 25.984 1.00 24.43 C ATOM 611 CD GLN A 460 -9.463 -11.725 26.309 1.00 29.31 C ATOM 612 OE1 GLN A 460 -10.332 -10.848 26.220 1.00 30.05 O ATOM 613 NE2 GLN A 460 -9.738 -12.967 26.691 1.00 29.12 N ATOM 0 H GLN A 460 -7.061 -9.188 24.120 1.00 18.38 H new ATOM 0 HA GLN A 460 -5.939 -8.833 26.497 1.00 20.11 H new ATOM 0 HB2 GLN A 460 -7.590 -10.000 27.380 1.00 19.91 H new ATOM 0 HB3 GLN A 460 -8.287 -9.412 26.115 1.00 19.91 H new ATOM 0 HG2 GLN A 460 -7.857 -11.523 25.030 1.00 24.43 H new ATOM 0 HG3 GLN A 460 -7.433 -12.073 26.426 1.00 24.43 H new ATOM 0 HE21 GLN A 460 -9.108 -13.551 26.742 1.00 29.12 H new ATOM 0 HE22 GLN A 460 -10.546 -13.187 26.888 1.00 29.12 H new ATOM 614 N SER A 461 -4.815 -11.116 24.733 1.00 18.99 N ATOM 615 CA SER A 461 -3.811 -12.176 24.638 1.00 18.69 C ATOM 616 C SER A 461 -2.449 -11.644 25.095 1.00 18.04 C ATOM 617 O SER A 461 -1.532 -12.416 25.384 1.00 19.07 O ATOM 618 CB SER A 461 -3.724 -12.718 23.196 1.00 18.59 C ATOM 619 OG SER A 461 -3.059 -11.828 22.314 1.00 20.72 O ATOM 0 H SER A 461 -5.117 -10.839 23.977 1.00 18.99 H new ATOM 0 HA SER A 461 -4.074 -12.908 25.218 1.00 18.69 H new ATOM 0 HB2 SER A 461 -3.258 -13.569 23.202 1.00 18.59 H new ATOM 0 HB3 SER A 461 -4.620 -12.887 22.864 1.00 18.59 H new ATOM 0 HG SER A 461 -3.595 -11.233 22.059 1.00 20.72 H new ATOM 620 N SER A 462 -2.332 -10.321 25.172 1.00 15.68 N ATOM 621 CA SER A 462 -1.098 -9.682 25.615 1.00 17.84 C ATOM 622 C SER A 462 -0.817 -9.983 27.085 1.00 17.99 C ATOM 623 O SER A 462 0.322 -9.895 27.547 1.00 16.11 O ATOM 624 CB SER A 462 -1.187 -8.177 25.404 1.00 20.49 C ATOM 625 OG SER A 462 -0.772 -7.849 24.090 1.00 28.10 O ATOM 0 H SER A 462 -2.962 -9.772 24.970 1.00 15.68 H new ATOM 0 HA SER A 462 -0.367 -10.040 25.087 1.00 17.84 H new ATOM 0 HB2 SER A 462 -2.097 -7.875 25.549 1.00 20.49 H new ATOM 0 HB3 SER A 462 -0.630 -7.718 26.052 1.00 20.49 H new ATOM 0 HG SER A 462 -0.099 -8.309 23.885 1.00 28.10 H new ATOM 626 N LEU A 463 -1.866 -10.333 27.822 1.00 18.25 N ATOM 627 CA LEU A 463 -1.727 -10.673 29.232 1.00 15.65 C ATOM 628 C LEU A 463 -1.179 -12.088 29.319 1.00 15.70 C ATOM 629 O LEU A 463 -0.691 -12.508 30.365 1.00 14.78 O ATOM 630 CB LEU A 463 -3.083 -10.575 29.949 1.00 15.40 C ATOM 631 CG LEU A 463 -3.660 -9.153 29.977 1.00 15.25 C ATOM 632 CD1 LEU A 463 -5.172 -9.221 30.122 1.00 20.79 C ATOM 633 CD2 LEU A 463 -3.043 -8.364 31.127 1.00 14.55 C ATOM 0 H LEU A 463 -2.671 -10.380 27.522 1.00 18.25 H new ATOM 0 HA LEU A 463 -1.122 -10.052 29.667 1.00 15.65 H new ATOM 0 HB2 LEU A 463 -3.716 -11.165 29.510 1.00 15.40 H new ATOM 0 HB3 LEU A 463 -2.983 -10.894 30.860 1.00 15.40 H new ATOM 0 HG LEU A 463 -3.446 -8.700 29.147 1.00 15.25 H new ATOM 0 HD11 LEU A 463 -5.536 -8.322 30.140 1.00 20.79 H new ATOM 0 HD12 LEU A 463 -5.548 -9.707 29.371 1.00 20.79 H new ATOM 0 HD13 LEU A 463 -5.398 -9.677 30.948 1.00 20.79 H new ATOM 0 HD21 LEU A 463 -3.412 -7.467 31.139 1.00 14.55 H new ATOM 0 HD22 LEU A 463 -3.243 -8.806 31.967 1.00 14.55 H new ATOM 0 HD23 LEU A 463 -2.082 -8.316 31.008 1.00 14.55 H new ATOM 634 N ASP A 464 -1.262 -12.822 28.211 1.00 16.39 N ATOM 635 CA ASP A 464 -0.747 -14.187 28.154 1.00 17.61 C ATOM 636 C ASP A 464 0.712 -14.178 27.686 1.00 17.78 C ATOM 637 O ASP A 464 1.350 -15.228 27.584 1.00 18.02 O ATOM 638 CB ASP A 464 -1.584 -15.040 27.199 1.00 21.41 C ATOM 639 CG ASP A 464 -2.967 -15.341 27.744 1.00 28.57 C ATOM 640 OD1 ASP A 464 -3.223 -15.028 28.928 1.00 29.12 O ATOM 641 OD2 ASP A 464 -3.797 -15.890 26.984 1.00 33.47 O ATOM 0 H ASP A 464 -1.615 -12.545 27.477 1.00 16.39 H new ATOM 0 HA ASP A 464 -0.799 -14.570 29.044 1.00 17.61 H new ATOM 0 HB2 ASP A 464 -1.668 -14.580 26.349 1.00 21.41 H new ATOM 0 HB3 ASP A 464 -1.120 -15.874 27.025 1.00 21.41 H new ATOM 642 N GLY A 465 1.236 -12.987 27.405 1.00 17.58 N ATOM 643 CA GLY A 465 2.615 -12.874 26.963 1.00 17.43 C ATOM 644 C GLY A 465 2.779 -12.742 25.460 1.00 17.98 C ATOM 645 O GLY A 465 3.889 -12.830 24.937 1.00 16.99 O ATOM 0 H GLY A 465 0.812 -12.241 27.464 1.00 17.58 H new ATOM 0 HA2 GLY A 465 3.019 -12.103 27.391 1.00 17.43 H new ATOM 0 HA3 GLY A 465 3.105 -13.655 27.264 1.00 17.43 H new ATOM 646 N TYR A 466 1.671 -12.535 24.753 1.00 17.66 N ATOM 647 CA TYR A 466 1.716 -12.389 23.296 1.00 15.06 C ATOM 648 C TYR A 466 1.934 -10.943 22.898 1.00 11.44 C ATOM 649 O TYR A 466 1.491 -10.029 23.581 1.00 14.49 O ATOM 650 CB TYR A 466 0.394 -12.840 22.650 1.00 14.68 C ATOM 651 CG TYR A 466 0.178 -14.323 22.630 1.00 12.80 C ATOM 652 CD1 TYR A 466 -0.512 -14.951 23.658 1.00 15.23 C ATOM 653 CD2 TYR A 466 0.661 -15.101 21.586 1.00 16.16 C ATOM 654 CE1 TYR A 466 -0.716 -16.312 23.654 1.00 17.15 C ATOM 655 CE2 TYR A 466 0.462 -16.473 21.572 1.00 19.25 C ATOM 656 CZ TYR A 466 -0.227 -17.068 22.614 1.00 19.15 C ATOM 657 OH TYR A 466 -0.408 -18.425 22.633 1.00 26.29 O ATOM 0 H TYR A 466 0.884 -12.476 25.095 1.00 17.66 H new ATOM 0 HA TYR A 466 2.451 -12.942 22.988 1.00 15.06 H new ATOM 0 HB2 TYR A 466 -0.342 -12.425 23.126 1.00 14.68 H new ATOM 0 HB3 TYR A 466 0.365 -12.509 21.739 1.00 14.68 H new ATOM 0 HD1 TYR A 466 -0.843 -14.442 24.363 1.00 15.23 H new ATOM 0 HD2 TYR A 466 1.124 -14.697 20.888 1.00 16.16 H new ATOM 0 HE1 TYR A 466 -1.181 -16.718 24.350 1.00 17.15 H new ATOM 0 HE2 TYR A 466 0.788 -16.988 20.870 1.00 19.25 H new ATOM 0 HH TYR A 466 -0.065 -18.763 21.945 1.00 26.29 H new ATOM 658 N ASN A 467 2.623 -10.734 21.787 1.00 9.36 N ATOM 659 CA ASN A 467 2.807 -9.385 21.287 1.00 8.17 C ATOM 660 C ASN A 467 1.674 -9.219 20.281 1.00 7.47 C ATOM 661 O ASN A 467 1.219 -10.194 19.689 1.00 8.33 O ATOM 662 CB ASN A 467 4.157 -9.232 20.589 1.00 11.36 C ATOM 663 CG ASN A 467 5.303 -9.237 21.570 1.00 11.15 C ATOM 664 OD1 ASN A 467 5.134 -8.869 22.731 1.00 11.70 O ATOM 665 ND2 ASN A 467 6.472 -9.658 21.115 1.00 9.87 N ATOM 0 H ASN A 467 2.988 -11.352 21.313 1.00 9.36 H new ATOM 0 HA ASN A 467 2.794 -8.723 21.996 1.00 8.17 H new ATOM 0 HB2 ASN A 467 4.275 -9.954 19.952 1.00 11.36 H new ATOM 0 HB3 ASN A 467 4.168 -8.404 20.085 1.00 11.36 H new ATOM 0 HD21 ASN A 467 7.154 -9.682 21.639 1.00 9.87 H new ATOM 0 HD22 ASN A 467 6.550 -9.907 20.296 1.00 9.87 H new ATOM 666 N VAL A 468 1.229 -7.990 20.102 1.00 7.90 N ATOM 667 CA VAL A 468 0.141 -7.725 19.189 1.00 9.54 C ATOM 668 C VAL A 468 0.378 -6.438 18.418 1.00 8.93 C ATOM 669 O VAL A 468 0.928 -5.463 18.947 1.00 10.96 O ATOM 670 CB VAL A 468 -1.200 -7.596 19.971 1.00 9.49 C ATOM 671 CG1 VAL A 468 -2.286 -6.973 19.071 1.00 11.34 C ATOM 672 CG2 VAL A 468 -1.619 -8.964 20.513 1.00 6.44 C ATOM 0 H VAL A 468 1.544 -7.296 20.500 1.00 7.90 H new ATOM 0 HA VAL A 468 0.093 -8.467 18.566 1.00 9.54 H new ATOM 0 HB VAL A 468 -1.079 -7.003 20.729 1.00 9.49 H new ATOM 0 HG11 VAL A 468 -3.115 -6.898 19.569 1.00 11.34 H new ATOM 0 HG12 VAL A 468 -2.001 -6.092 18.783 1.00 11.34 H new ATOM 0 HG13 VAL A 468 -2.426 -7.537 18.294 1.00 11.34 H new ATOM 0 HG21 VAL A 468 -2.454 -8.878 20.999 1.00 6.44 H new ATOM 0 HG22 VAL A 468 -1.737 -9.582 19.775 1.00 6.44 H new ATOM 0 HG23 VAL A 468 -0.932 -9.300 21.109 1.00 6.44 H new ATOM 673 N CYS A 469 -0.042 -6.458 17.155 1.00 9.79 N ATOM 674 CA CYS A 469 0.040 -5.309 16.272 1.00 7.55 C ATOM 675 C CYS A 469 -1.338 -5.119 15.630 1.00 6.68 C ATOM 676 O CYS A 469 -1.946 -6.082 15.187 1.00 8.20 O ATOM 677 CB CYS A 469 1.065 -5.548 15.173 1.00 9.83 C ATOM 678 SG CYS A 469 2.774 -5.380 15.767 1.00 12.57 S ATOM 0 H CYS A 469 -0.388 -7.153 16.785 1.00 9.79 H new ATOM 0 HA CYS A 469 0.308 -4.526 16.778 1.00 7.55 H new ATOM 0 HB2 CYS A 469 0.939 -6.437 14.805 1.00 9.83 H new ATOM 0 HB3 CYS A 469 0.913 -4.918 14.451 1.00 9.83 H new ATOM 0 HG CYS A 469 3.275 -6.467 15.858 1.00 12.57 H new ATOM 679 N ILE A 470 -1.821 -3.886 15.623 1.00 7.71 N ATOM 680 CA ILE A 470 -3.090 -3.543 14.989 1.00 9.25 C ATOM 681 C ILE A 470 -2.783 -2.323 14.135 1.00 9.13 C ATOM 682 O ILE A 470 -2.418 -1.259 14.649 1.00 10.25 O ATOM 683 CB ILE A 470 -4.202 -3.184 16.005 1.00 8.07 C ATOM 684 CG1 ILE A 470 -4.546 -4.401 16.864 1.00 7.39 C ATOM 685 CG2 ILE A 470 -5.461 -2.745 15.240 1.00 7.78 C ATOM 686 CD1 ILE A 470 -5.643 -4.143 17.878 1.00 7.03 C ATOM 0 H ILE A 470 -1.421 -3.218 15.988 1.00 7.71 H new ATOM 0 HA ILE A 470 -3.426 -4.302 14.487 1.00 9.25 H new ATOM 0 HB ILE A 470 -3.887 -2.467 16.577 1.00 8.07 H new ATOM 0 HG12 ILE A 470 -4.818 -5.129 16.284 1.00 7.39 H new ATOM 0 HG13 ILE A 470 -3.748 -4.693 17.331 1.00 7.39 H new ATOM 0 HG21 ILE A 470 -6.161 -2.519 15.872 1.00 7.78 H new ATOM 0 HG22 ILE A 470 -5.255 -1.969 14.695 1.00 7.78 H new ATOM 0 HG23 ILE A 470 -5.762 -3.469 14.670 1.00 7.78 H new ATOM 0 HD11 ILE A 470 -5.811 -4.952 18.387 1.00 7.03 H new ATOM 0 HD12 ILE A 470 -5.367 -3.434 18.480 1.00 7.03 H new ATOM 0 HD13 ILE A 470 -6.454 -3.878 17.417 1.00 7.03 H new ATOM 687 N PHE A 471 -2.910 -2.491 12.822 1.00 10.50 N ATOM 688 CA PHE A 471 -2.626 -1.417 11.876 1.00 9.65 C ATOM 689 C PHE A 471 -3.893 -0.880 11.223 1.00 9.51 C ATOM 690 O PHE A 471 -4.745 -1.655 10.798 1.00 13.93 O ATOM 691 CB PHE A 471 -1.717 -1.927 10.753 1.00 9.66 C ATOM 692 CG PHE A 471 -0.384 -2.459 11.219 1.00 9.69 C ATOM 693 CD1 PHE A 471 0.700 -1.602 11.368 1.00 10.22 C ATOM 694 CD2 PHE A 471 -0.201 -3.823 11.440 1.00 8.52 C ATOM 695 CE1 PHE A 471 1.954 -2.095 11.723 1.00 8.72 C ATOM 696 CE2 PHE A 471 1.048 -4.330 11.796 1.00 7.11 C ATOM 697 CZ PHE A 471 2.128 -3.462 11.936 1.00 6.31 C ATOM 0 H PHE A 471 -3.162 -3.227 12.456 1.00 10.50 H new ATOM 0 HA PHE A 471 -2.198 -0.709 12.383 1.00 9.65 H new ATOM 0 HB2 PHE A 471 -2.181 -2.628 10.270 1.00 9.66 H new ATOM 0 HB3 PHE A 471 -1.562 -1.205 10.125 1.00 9.66 H new ATOM 0 HD1 PHE A 471 0.587 -0.689 11.229 1.00 10.22 H new ATOM 0 HD2 PHE A 471 -0.922 -4.403 11.349 1.00 8.52 H new ATOM 0 HE1 PHE A 471 2.674 -1.513 11.818 1.00 8.72 H new ATOM 0 HE2 PHE A 471 1.159 -5.242 11.939 1.00 7.11 H new ATOM 0 HZ PHE A 471 2.964 -3.794 12.171 1.00 6.31 H new ATOM 698 N ALA A 472 -4.009 0.439 11.151 1.00 9.76 N ATOM 699 CA ALA A 472 -5.148 1.062 10.488 1.00 9.67 C ATOM 700 C ALA A 472 -4.612 1.591 9.160 1.00 11.10 C ATOM 701 O ALA A 472 -3.841 2.546 9.126 1.00 11.33 O ATOM 702 CB ALA A 472 -5.716 2.202 11.327 1.00 11.63 C ATOM 0 H ALA A 472 -3.439 0.993 11.480 1.00 9.76 H new ATOM 0 HA ALA A 472 -5.871 0.428 10.360 1.00 9.67 H new ATOM 0 HB1 ALA A 472 -6.471 2.599 10.865 1.00 11.63 H new ATOM 0 HB2 ALA A 472 -6.008 1.858 12.186 1.00 11.63 H new ATOM 0 HB3 ALA A 472 -5.031 2.875 11.464 1.00 11.63 H new ATOM 703 N TYR A 473 -5.028 0.959 8.069 1.00 10.70 N ATOM 704 CA TYR A 473 -4.581 1.323 6.729 1.00 9.25 C ATOM 705 C TYR A 473 -5.729 1.865 5.866 1.00 13.10 C ATOM 706 O TYR A 473 -6.842 1.347 5.906 1.00 11.09 O ATOM 707 CB TYR A 473 -3.988 0.085 6.068 1.00 10.15 C ATOM 708 CG TYR A 473 -3.510 0.281 4.652 1.00 15.25 C ATOM 709 CD1 TYR A 473 -2.152 0.411 4.372 1.00 16.18 C ATOM 710 CD2 TYR A 473 -4.411 0.307 3.583 1.00 17.06 C ATOM 711 CE1 TYR A 473 -1.695 0.560 3.069 1.00 17.22 C ATOM 712 CE2 TYR A 473 -3.965 0.459 2.265 1.00 17.57 C ATOM 713 CZ TYR A 473 -2.608 0.584 2.021 1.00 21.06 C ATOM 714 OH TYR A 473 -2.155 0.731 0.732 1.00 19.75 O ATOM 0 H TYR A 473 -5.582 0.301 8.085 1.00 10.70 H new ATOM 0 HA TYR A 473 -3.919 2.028 6.806 1.00 9.25 H new ATOM 0 HB2 TYR A 473 -3.243 -0.226 6.606 1.00 10.15 H new ATOM 0 HB3 TYR A 473 -4.655 -0.619 6.074 1.00 10.15 H new ATOM 0 HD1 TYR A 473 -1.539 0.398 5.071 1.00 16.18 H new ATOM 0 HD2 TYR A 473 -5.322 0.222 3.751 1.00 17.06 H new ATOM 0 HE1 TYR A 473 -0.784 0.643 2.899 1.00 17.22 H new ATOM 0 HE2 TYR A 473 -4.573 0.476 1.562 1.00 17.57 H new ATOM 0 HH TYR A 473 -2.779 0.565 0.195 1.00 19.75 H new ATOM 715 N GLY A 474 -5.442 2.901 5.084 1.00 11.92 N ATOM 716 CA GLY A 474 -6.454 3.482 4.216 1.00 13.10 C ATOM 717 C GLY A 474 -6.106 4.898 3.819 1.00 13.35 C ATOM 718 O GLY A 474 -5.218 5.517 4.405 1.00 15.89 O ATOM 0 H GLY A 474 -4.671 3.279 5.043 1.00 11.92 H new ATOM 0 HA2 GLY A 474 -6.549 2.937 3.419 1.00 13.10 H new ATOM 0 HA3 GLY A 474 -7.312 3.474 4.669 1.00 13.10 H new ATOM 719 N GLN A 475 -6.801 5.425 2.820 1.00 12.59 N ATOM 720 CA GLN A 475 -6.556 6.786 2.357 1.00 13.27 C ATOM 721 C GLN A 475 -6.953 7.823 3.409 1.00 13.56 C ATOM 722 O GLN A 475 -7.809 7.567 4.272 1.00 14.11 O ATOM 723 CB GLN A 475 -7.345 7.060 1.061 1.00 14.39 C ATOM 724 CG GLN A 475 -8.784 7.542 1.307 1.00 17.21 C ATOM 725 CD GLN A 475 -9.589 7.723 0.026 1.00 15.19 C ATOM 726 OE1 GLN A 475 -10.500 6.799 -0.227 1.00 17.09 O flip ATOM 727 NE2 GLN A 475 -9.392 8.685 -0.720 1.00 12.35 N flip ATOM 0 H GLN A 475 -7.422 5.010 2.394 1.00 12.59 H new ATOM 0 HA GLN A 475 -5.604 6.865 2.190 1.00 13.27 H new ATOM 0 HB2 GLN A 475 -6.873 7.728 0.539 1.00 14.39 H new ATOM 0 HB3 GLN A 475 -7.370 6.249 0.529 1.00 14.39 H new ATOM 0 HG2 GLN A 475 -9.238 6.904 1.879 1.00 17.21 H new ATOM 0 HG3 GLN A 475 -8.758 8.385 1.787 1.00 17.21 H new ATOM 0 HE21 GLN A 475 -8.790 9.266 -0.522 1.00 12.35 H new ATOM 0 HE22 GLN A 475 -9.857 8.774 -1.438 1.00 12.35 H new ATOM 728 N THR A 476 -6.327 8.993 3.345 1.00 12.06 N ATOM 729 CA THR A 476 -6.658 10.063 4.269 1.00 11.52 C ATOM 730 C THR A 476 -8.167 10.273 4.114 1.00 14.19 C ATOM 731 O THR A 476 -8.669 10.399 2.996 1.00 13.41 O ATOM 732 CB THR A 476 -5.932 11.356 3.900 1.00 11.70 C ATOM 733 OG1 THR A 476 -4.519 11.154 4.009 1.00 15.70 O ATOM 734 CG2 THR A 476 -6.337 12.475 4.836 1.00 13.36 C ATOM 0 H THR A 476 -5.711 9.184 2.776 1.00 12.06 H new ATOM 0 HA THR A 476 -6.397 9.835 5.175 1.00 11.52 H new ATOM 0 HB THR A 476 -6.169 11.597 2.991 1.00 11.70 H new ATOM 0 HG1 THR A 476 -4.143 11.414 3.304 1.00 15.70 H new ATOM 0 HG21 THR A 476 -5.869 13.288 4.590 1.00 13.36 H new ATOM 0 HG22 THR A 476 -7.294 12.621 4.771 1.00 13.36 H new ATOM 0 HG23 THR A 476 -6.108 12.234 5.747 1.00 13.36 H new ATOM 735 N GLY A 477 -8.889 10.284 5.227 1.00 13.91 N ATOM 736 CA GLY A 477 -10.324 10.481 5.156 1.00 16.16 C ATOM 737 C GLY A 477 -11.148 9.213 5.297 1.00 16.13 C ATOM 738 O GLY A 477 -12.371 9.290 5.460 1.00 19.39 O ATOM 0 H GLY A 477 -8.572 10.181 6.020 1.00 13.91 H new ATOM 0 HA2 GLY A 477 -10.587 11.102 5.853 1.00 16.16 H new ATOM 0 HA3 GLY A 477 -10.539 10.899 4.307 1.00 16.16 H new ATOM 739 N SER A 478 -10.493 8.054 5.254 1.00 15.90 N ATOM 740 CA SER A 478 -11.191 6.771 5.367 1.00 12.92 C ATOM 741 C SER A 478 -11.634 6.416 6.789 1.00 13.68 C ATOM 742 O SER A 478 -12.505 5.571 6.976 1.00 14.38 O ATOM 743 CB SER A 478 -10.321 5.651 4.804 1.00 12.98 C ATOM 744 OG SER A 478 -9.101 5.575 5.509 1.00 11.96 O ATOM 0 H SER A 478 -9.641 7.988 5.160 1.00 15.90 H new ATOM 0 HA SER A 478 -12.005 6.868 4.848 1.00 12.92 H new ATOM 0 HB2 SER A 478 -10.791 4.805 4.867 1.00 12.98 H new ATOM 0 HB3 SER A 478 -10.148 5.810 3.863 1.00 12.98 H new ATOM 0 HG SER A 478 -8.573 6.161 5.220 1.00 11.96 H new ATOM 745 N GLY A 479 -11.032 7.056 7.788 1.00 14.11 N ATOM 746 CA GLY A 479 -11.419 6.797 9.165 1.00 13.01 C ATOM 747 C GLY A 479 -10.408 6.073 10.040 1.00 12.14 C ATOM 748 O GLY A 479 -10.782 5.464 11.037 1.00 12.15 O ATOM 0 H GLY A 479 -10.405 7.636 7.689 1.00 14.11 H new ATOM 0 HA2 GLY A 479 -11.628 7.646 9.585 1.00 13.01 H new ATOM 0 HA3 GLY A 479 -12.237 6.276 9.156 1.00 13.01 H new ATOM 749 N LYS A 480 -9.132 6.131 9.684 1.00 9.80 N ATOM 750 CA LYS A 480 -8.098 5.461 10.473 1.00 8.28 C ATOM 751 C LYS A 480 -8.011 5.984 11.914 1.00 5.59 C ATOM 752 O LYS A 480 -8.060 5.206 12.862 1.00 7.76 O ATOM 753 CB LYS A 480 -6.729 5.627 9.801 1.00 8.03 C ATOM 754 CG LYS A 480 -6.512 4.772 8.559 1.00 9.21 C ATOM 755 CD LYS A 480 -5.229 5.152 7.805 1.00 10.41 C ATOM 756 CE LYS A 480 -5.021 6.660 7.727 1.00 11.38 C ATOM 757 NZ LYS A 480 -5.814 7.300 6.628 1.00 8.91 N ATOM 0 H LYS A 480 -8.841 6.551 8.992 1.00 9.80 H new ATOM 0 HA LYS A 480 -8.348 4.525 10.513 1.00 8.28 H new ATOM 0 HB2 LYS A 480 -6.614 6.559 9.559 1.00 8.03 H new ATOM 0 HB3 LYS A 480 -6.038 5.414 10.448 1.00 8.03 H new ATOM 0 HG2 LYS A 480 -6.469 3.838 8.816 1.00 9.21 H new ATOM 0 HG3 LYS A 480 -7.273 4.868 7.966 1.00 9.21 H new ATOM 0 HD2 LYS A 480 -4.466 4.746 8.246 1.00 10.41 H new ATOM 0 HD3 LYS A 480 -5.265 4.787 6.907 1.00 10.41 H new ATOM 0 HE2 LYS A 480 -5.269 7.061 8.575 1.00 11.38 H new ATOM 0 HE3 LYS A 480 -4.079 6.846 7.591 1.00 11.38 H new ATOM 0 HZ1 LYS A 480 -5.443 8.079 6.409 1.00 8.91 H new ATOM 0 HZ2 LYS A 480 -5.822 6.765 5.917 1.00 8.91 H new ATOM 0 HZ3 LYS A 480 -6.649 7.437 6.905 1.00 8.91 H new ATOM 758 N THR A 481 -7.887 7.295 12.074 1.00 7.71 N ATOM 759 CA THR A 481 -7.753 7.894 13.399 1.00 9.02 C ATOM 760 C THR A 481 -9.013 7.815 14.240 1.00 13.26 C ATOM 761 O THR A 481 -8.956 7.711 15.469 1.00 11.73 O ATOM 762 CB THR A 481 -7.332 9.352 13.283 1.00 10.17 C ATOM 763 OG1 THR A 481 -6.133 9.422 12.511 1.00 11.77 O ATOM 764 CG2 THR A 481 -7.088 9.965 14.659 1.00 12.79 C ATOM 0 H THR A 481 -7.878 7.860 11.425 1.00 7.71 H new ATOM 0 HA THR A 481 -7.072 7.372 13.851 1.00 9.02 H new ATOM 0 HB THR A 481 -8.044 9.851 12.853 1.00 10.17 H new ATOM 0 HG21 THR A 481 -6.822 10.892 14.558 1.00 12.79 H new ATOM 0 HG22 THR A 481 -7.903 9.919 15.183 1.00 12.79 H new ATOM 0 HG23 THR A 481 -6.384 9.474 15.112 1.00 12.79 H new ATOM 765 N PHE A 482 -10.161 7.899 13.580 1.00 13.61 N ATOM 766 CA PHE A 482 -11.420 7.807 14.299 1.00 11.27 C ATOM 767 C PHE A 482 -11.493 6.404 14.886 1.00 9.42 C ATOM 768 O PHE A 482 -11.868 6.217 16.043 1.00 11.76 O ATOM 769 CB PHE A 482 -12.593 8.029 13.346 1.00 9.93 C ATOM 770 CG PHE A 482 -13.923 7.955 14.020 1.00 12.09 C ATOM 771 CD1 PHE A 482 -14.512 6.721 14.291 1.00 13.65 C ATOM 772 CD2 PHE A 482 -14.577 9.112 14.417 1.00 13.55 C ATOM 773 CE1 PHE A 482 -15.738 6.640 14.958 1.00 11.15 C ATOM 774 CE2 PHE A 482 -15.802 9.044 15.085 1.00 14.17 C ATOM 775 CZ PHE A 482 -16.379 7.804 15.352 1.00 11.51 C ATOM 0 H PHE A 482 -10.232 8.007 12.730 1.00 13.61 H new ATOM 0 HA PHE A 482 -11.468 8.482 14.994 1.00 11.27 H new ATOM 0 HB2 PHE A 482 -12.499 8.897 12.924 1.00 9.93 H new ATOM 0 HB3 PHE A 482 -12.558 7.365 12.640 1.00 9.93 H new ATOM 0 HD1 PHE A 482 -14.083 5.940 14.024 1.00 13.65 H new ATOM 0 HD2 PHE A 482 -14.196 9.941 14.237 1.00 13.55 H new ATOM 0 HE1 PHE A 482 -16.121 5.811 15.136 1.00 11.15 H new ATOM 0 HE2 PHE A 482 -16.232 9.825 15.351 1.00 14.17 H new ATOM 0 HZ PHE A 482 -17.195 7.757 15.795 1.00 11.51 H new ATOM 776 N THR A 483 -11.123 5.418 14.074 1.00 9.83 N ATOM 777 CA THR A 483 -11.140 4.020 14.483 1.00 8.49 C ATOM 778 C THR A 483 -10.175 3.732 15.642 1.00 11.67 C ATOM 779 O THR A 483 -10.508 3.005 16.581 1.00 9.72 O ATOM 780 CB THR A 483 -10.769 3.107 13.299 1.00 8.41 C ATOM 781 OG1 THR A 483 -11.849 3.097 12.355 1.00 12.11 O ATOM 782 CG2 THR A 483 -10.513 1.684 13.760 1.00 4.79 C ATOM 0 H THR A 483 -10.854 5.543 13.267 1.00 9.83 H new ATOM 0 HA THR A 483 -12.043 3.836 14.785 1.00 8.49 H new ATOM 0 HB THR A 483 -9.959 3.453 12.892 1.00 8.41 H new ATOM 0 HG1 THR A 483 -11.754 3.732 11.813 1.00 12.11 H new ATOM 0 HG21 THR A 483 -10.282 1.133 12.996 1.00 4.79 H new ATOM 0 HG22 THR A 483 -9.781 1.677 14.397 1.00 4.79 H new ATOM 0 HG23 THR A 483 -11.312 1.332 14.183 1.00 4.79 H new ATOM 783 N MET A 484 -8.981 4.310 15.576 1.00 12.57 N ATOM 784 CA MET A 484 -7.973 4.074 16.603 1.00 14.03 C ATOM 785 C MET A 484 -8.031 4.962 17.843 1.00 14.51 C ATOM 786 O MET A 484 -7.749 4.502 18.952 1.00 16.72 O ATOM 787 CB MET A 484 -6.569 4.200 15.988 1.00 13.86 C ATOM 788 CG MET A 484 -6.276 3.237 14.844 1.00 13.99 C ATOM 789 SD MET A 484 -6.234 1.484 15.274 1.00 21.71 S ATOM 790 CE MET A 484 -5.175 1.542 16.688 1.00 16.93 C ATOM 0 H MET A 484 -8.735 4.841 14.946 1.00 12.57 H new ATOM 0 HA MET A 484 -8.172 3.179 16.919 1.00 14.03 H new ATOM 0 HB2 MET A 484 -6.452 5.108 15.666 1.00 13.86 H new ATOM 0 HB3 MET A 484 -5.911 4.060 16.687 1.00 13.86 H new ATOM 0 HG2 MET A 484 -6.947 3.367 14.156 1.00 13.99 H new ATOM 0 HG3 MET A 484 -5.421 3.477 14.454 1.00 13.99 H new ATOM 0 HE1 MET A 484 -4.902 0.642 16.925 1.00 16.93 H new ATOM 0 HE2 MET A 484 -4.390 2.074 16.483 1.00 16.93 H new ATOM 0 HE3 MET A 484 -5.651 1.942 17.433 1.00 16.93 H new ATOM 791 N LEU A 485 -8.400 6.224 17.657 1.00 14.43 N ATOM 792 CA LEU A 485 -8.400 7.183 18.749 1.00 15.31 C ATOM 793 C LEU A 485 -9.685 7.888 19.154 1.00 14.75 C ATOM 794 O LEU A 485 -9.639 8.748 20.038 1.00 15.58 O ATOM 795 CB LEU A 485 -7.355 8.257 18.449 1.00 15.66 C ATOM 796 CG LEU A 485 -5.978 8.097 19.090 1.00 16.82 C ATOM 797 CD1 LEU A 485 -5.062 9.193 18.556 1.00 15.96 C ATOM 798 CD2 LEU A 485 -6.102 8.167 20.610 1.00 14.91 C ATOM 0 H LEU A 485 -8.655 6.545 16.901 1.00 14.43 H new ATOM 0 HA LEU A 485 -8.219 6.614 19.514 1.00 15.31 H new ATOM 0 HB2 LEU A 485 -7.235 8.298 17.487 1.00 15.66 H new ATOM 0 HB3 LEU A 485 -7.717 9.113 18.726 1.00 15.66 H new ATOM 0 HG LEU A 485 -5.598 7.233 18.866 1.00 16.82 H new ATOM 0 HD11 LEU A 485 -4.183 9.103 18.955 1.00 15.96 H new ATOM 0 HD12 LEU A 485 -4.989 9.113 17.592 1.00 15.96 H new ATOM 0 HD13 LEU A 485 -5.431 10.061 18.780 1.00 15.96 H new ATOM 0 HD21 LEU A 485 -5.225 8.065 21.011 1.00 14.91 H new ATOM 0 HD22 LEU A 485 -6.476 9.025 20.865 1.00 14.91 H new ATOM 0 HD23 LEU A 485 -6.684 7.456 20.920 1.00 14.91 H new ATOM 799 N ASN A 486 -10.818 7.570 18.530 1.00 14.36 N ATOM 800 CA ASN A 486 -12.046 8.262 18.913 1.00 14.15 C ATOM 801 C ASN A 486 -12.212 8.186 20.428 1.00 12.39 C ATOM 802 O ASN A 486 -12.235 7.099 20.996 1.00 13.71 O ATOM 803 CB ASN A 486 -13.271 7.645 18.238 1.00 11.10 C ATOM 804 CG ASN A 486 -14.492 8.538 18.344 1.00 9.60 C ATOM 805 OD1 ASN A 486 -14.432 9.729 18.031 1.00 11.04 O ATOM 806 ND2 ASN A 486 -15.601 7.973 18.805 1.00 8.86 N ATOM 0 H ASN A 486 -10.898 6.982 17.908 1.00 14.36 H new ATOM 0 HA ASN A 486 -11.977 9.186 18.625 1.00 14.15 H new ATOM 0 HB2 ASN A 486 -13.074 7.479 17.303 1.00 11.10 H new ATOM 0 HB3 ASN A 486 -13.464 6.786 18.644 1.00 11.10 H new ATOM 0 HD21 ASN A 486 -16.317 8.441 18.896 1.00 8.86 H new ATOM 0 HD22 ASN A 486 -15.604 7.139 19.013 1.00 8.86 H new ATOM 807 N PRO A 487 -12.336 9.348 21.097 1.00 15.14 N ATOM 808 CA PRO A 487 -12.494 9.414 22.556 1.00 17.29 C ATOM 809 C PRO A 487 -13.403 8.344 23.158 1.00 19.75 C ATOM 810 O PRO A 487 -14.553 8.186 22.738 1.00 20.51 O ATOM 811 CB PRO A 487 -13.030 10.820 22.782 1.00 16.58 C ATOM 812 CG PRO A 487 -12.417 11.606 21.694 1.00 15.87 C ATOM 813 CD PRO A 487 -12.349 10.692 20.498 1.00 14.47 C ATOM 0 HA PRO A 487 -11.654 9.235 23.007 1.00 17.29 H new ATOM 0 HB2 PRO A 487 -13.999 10.844 22.737 1.00 16.58 H new ATOM 0 HB3 PRO A 487 -12.778 11.162 23.654 1.00 16.58 H new ATOM 0 HG2 PRO A 487 -12.946 12.395 21.497 1.00 15.87 H new ATOM 0 HG3 PRO A 487 -11.532 11.913 21.945 1.00 15.87 H new ATOM 0 HD2 PRO A 487 -13.111 10.814 19.911 1.00 14.47 H new ATOM 0 HD3 PRO A 487 -11.553 10.855 19.968 1.00 14.47 H new ATOM 814 N GLY A 488 -12.863 7.622 24.142 1.00 21.57 N ATOM 815 CA GLY A 488 -13.588 6.565 24.829 1.00 21.91 C ATOM 816 C GLY A 488 -13.974 5.378 23.966 1.00 22.84 C ATOM 817 O GLY A 488 -14.143 4.274 24.474 1.00 25.94 O ATOM 0 H GLY A 488 -12.060 7.737 24.428 1.00 21.57 H new ATOM 0 HA2 GLY A 488 -13.045 6.247 25.567 1.00 21.91 H new ATOM 0 HA3 GLY A 488 -14.395 6.943 25.213 1.00 21.91 H new ATOM 818 N ASP A 489 -14.079 5.607 22.660 1.00 20.89 N ATOM 819 CA ASP A 489 -14.496 4.597 21.682 1.00 20.30 C ATOM 820 C ASP A 489 -13.411 3.852 20.894 1.00 15.87 C ATOM 821 O ASP A 489 -13.505 2.636 20.690 1.00 15.05 O ATOM 822 CB ASP A 489 -15.433 5.264 20.664 1.00 18.28 C ATOM 823 CG ASP A 489 -16.800 4.691 20.700 1.00 23.18 C ATOM 824 OD1 ASP A 489 -16.956 3.604 21.294 1.00 29.91 O ATOM 825 OD2 ASP A 489 -17.710 5.319 20.137 1.00 25.60 O ATOM 0 H ASP A 489 -13.906 6.372 22.307 1.00 20.89 H new ATOM 0 HA ASP A 489 -14.907 3.911 22.231 1.00 20.30 H new ATOM 0 HB2 ASP A 489 -15.478 6.216 20.844 1.00 18.28 H new ATOM 0 HB3 ASP A 489 -15.065 5.161 19.773 1.00 18.28 H new ATOM 826 N GLY A 490 -12.423 4.604 20.414 1.00 15.84 N ATOM 827 CA GLY A 490 -11.343 4.039 19.621 1.00 14.22 C ATOM 828 C GLY A 490 -10.754 2.720 20.086 1.00 14.98 C ATOM 829 O GLY A 490 -10.962 2.287 21.218 1.00 15.49 O ATOM 0 H GLY A 490 -12.363 5.453 20.540 1.00 15.84 H new ATOM 0 HA2 GLY A 490 -11.667 3.920 18.714 1.00 14.22 H new ATOM 0 HA3 GLY A 490 -10.626 4.691 19.583 1.00 14.22 H new ATOM 830 N ILE A 491 -10.002 2.069 19.206 1.00 13.39 N ATOM 831 CA ILE A 491 -9.386 0.796 19.552 1.00 13.36 C ATOM 832 C ILE A 491 -8.381 0.995 20.692 1.00 12.31 C ATOM 833 O ILE A 491 -8.240 0.123 21.546 1.00 13.38 O ATOM 834 CB ILE A 491 -8.678 0.153 18.326 1.00 13.83 C ATOM 835 CG1 ILE A 491 -9.700 -0.635 17.505 1.00 14.44 C ATOM 836 CG2 ILE A 491 -7.586 -0.814 18.776 1.00 13.18 C ATOM 837 CD1 ILE A 491 -9.210 -1.020 16.147 1.00 15.04 C ATOM 0 H ILE A 491 -9.837 2.345 18.409 1.00 13.39 H new ATOM 0 HA ILE A 491 -10.089 0.193 19.840 1.00 13.36 H new ATOM 0 HB ILE A 491 -8.283 0.864 17.797 1.00 13.83 H new ATOM 0 HG12 ILE A 491 -9.944 -1.438 17.992 1.00 14.44 H new ATOM 0 HG13 ILE A 491 -10.506 -0.104 17.411 1.00 14.44 H new ATOM 0 HG21 ILE A 491 -7.158 -1.203 17.998 1.00 13.18 H new ATOM 0 HG22 ILE A 491 -6.926 -0.335 19.302 1.00 13.18 H new ATOM 0 HG23 ILE A 491 -7.979 -1.518 19.315 1.00 13.18 H new ATOM 0 HD11 ILE A 491 -9.902 -1.515 15.681 1.00 15.04 H new ATOM 0 HD12 ILE A 491 -8.990 -0.221 15.644 1.00 15.04 H new ATOM 0 HD13 ILE A 491 -8.419 -1.575 16.233 1.00 15.04 H new ATOM 838 N ILE A 492 -7.710 2.144 20.721 1.00 11.50 N ATOM 839 CA ILE A 492 -6.724 2.402 21.778 1.00 13.55 C ATOM 840 C ILE A 492 -7.389 2.608 23.150 1.00 14.36 C ATOM 841 O ILE A 492 -7.057 1.915 24.111 1.00 14.87 O ATOM 842 CB ILE A 492 -5.813 3.596 21.410 1.00 11.53 C ATOM 843 CG1 ILE A 492 -4.934 3.205 20.213 1.00 9.91 C ATOM 844 CG2 ILE A 492 -4.942 3.980 22.597 1.00 10.57 C ATOM 845 CD1 ILE A 492 -4.305 4.368 19.465 1.00 8.54 C ATOM 0 H ILE A 492 -7.806 2.780 20.150 1.00 11.50 H new ATOM 0 HA ILE A 492 -6.167 1.611 21.850 1.00 13.55 H new ATOM 0 HB ILE A 492 -6.362 4.361 21.174 1.00 11.53 H new ATOM 0 HG12 ILE A 492 -4.226 2.620 20.527 1.00 9.91 H new ATOM 0 HG13 ILE A 492 -5.471 2.691 19.590 1.00 9.91 H new ATOM 0 HG21 ILE A 492 -4.376 4.729 22.354 1.00 10.57 H new ATOM 0 HG22 ILE A 492 -5.506 4.231 23.345 1.00 10.57 H new ATOM 0 HG23 ILE A 492 -4.388 3.225 22.850 1.00 10.57 H new ATOM 0 HD11 ILE A 492 -3.771 4.029 18.730 1.00 8.54 H new ATOM 0 HD12 ILE A 492 -5.003 4.945 19.118 1.00 8.54 H new ATOM 0 HD13 ILE A 492 -3.739 4.873 20.069 1.00 8.54 H new ATOM 846 N PRO A 493 -8.338 3.563 23.257 1.00 15.61 N ATOM 847 CA PRO A 493 -9.001 3.773 24.552 1.00 14.23 C ATOM 848 C PRO A 493 -9.681 2.494 25.040 1.00 15.05 C ATOM 849 O PRO A 493 -9.603 2.137 26.223 1.00 15.97 O ATOM 850 CB PRO A 493 -10.007 4.887 24.258 1.00 15.39 C ATOM 851 CG PRO A 493 -9.460 5.586 23.039 1.00 17.21 C ATOM 852 CD PRO A 493 -8.808 4.512 22.233 1.00 13.94 C ATOM 0 HA PRO A 493 -8.386 4.010 25.264 1.00 14.23 H new ATOM 0 HB2 PRO A 493 -10.892 4.527 24.090 1.00 15.39 H new ATOM 0 HB3 PRO A 493 -10.086 5.497 25.008 1.00 15.39 H new ATOM 0 HG2 PRO A 493 -10.167 6.021 22.537 1.00 17.21 H new ATOM 0 HG3 PRO A 493 -8.823 6.275 23.286 1.00 17.21 H new ATOM 0 HD2 PRO A 493 -9.432 4.096 21.618 1.00 13.94 H new ATOM 0 HD3 PRO A 493 -8.074 4.858 21.701 1.00 13.94 H new ATOM 853 N SER A 494 -10.327 1.790 24.119 1.00 13.09 N ATOM 854 CA SER A 494 -11.028 0.561 24.451 1.00 13.31 C ATOM 855 C SER A 494 -10.081 -0.514 24.939 1.00 11.26 C ATOM 856 O SER A 494 -10.382 -1.226 25.896 1.00 9.96 O ATOM 857 CB SER A 494 -11.802 0.043 23.234 1.00 12.07 C ATOM 858 OG SER A 494 -12.796 0.979 22.853 1.00 15.11 O ATOM 0 H SER A 494 -10.371 2.011 23.289 1.00 13.09 H new ATOM 0 HA SER A 494 -11.646 0.769 25.169 1.00 13.31 H new ATOM 0 HB2 SER A 494 -11.192 -0.110 22.495 1.00 12.07 H new ATOM 0 HB3 SER A 494 -12.214 -0.810 23.443 1.00 12.07 H new ATOM 0 HG SER A 494 -12.501 1.465 22.235 1.00 15.11 H new ATOM 859 N THR A 495 -8.948 -0.647 24.256 1.00 12.65 N ATOM 860 CA THR A 495 -7.942 -1.637 24.623 1.00 13.42 C ATOM 861 C THR A 495 -7.457 -1.412 26.053 1.00 11.59 C ATOM 862 O THR A 495 -7.368 -2.356 26.836 1.00 14.11 O ATOM 863 CB THR A 495 -6.725 -1.572 23.681 1.00 13.12 C ATOM 864 OG1 THR A 495 -7.133 -1.959 22.367 1.00 12.11 O ATOM 865 CG2 THR A 495 -5.606 -2.519 24.158 1.00 8.52 C ATOM 0 H THR A 495 -8.742 -0.169 23.571 1.00 12.65 H new ATOM 0 HA THR A 495 -8.361 -2.509 24.549 1.00 13.42 H new ATOM 0 HB THR A 495 -6.383 -0.664 23.679 1.00 13.12 H new ATOM 0 HG1 THR A 495 -7.297 -1.273 21.911 1.00 12.11 H new ATOM 0 HG21 THR A 495 -4.852 -2.461 23.551 1.00 8.52 H new ATOM 0 HG22 THR A 495 -5.323 -2.263 25.050 1.00 8.52 H new ATOM 0 HG23 THR A 495 -5.938 -3.430 24.174 1.00 8.52 H new ATOM 866 N ILE A 496 -7.155 -0.161 26.380 1.00 13.04 N ATOM 867 CA ILE A 496 -6.665 0.183 27.705 1.00 15.68 C ATOM 868 C ILE A 496 -7.702 -0.195 28.763 1.00 18.58 C ATOM 869 O ILE A 496 -7.366 -0.792 29.784 1.00 19.60 O ATOM 870 CB ILE A 496 -6.325 1.694 27.786 1.00 16.67 C ATOM 871 CG1 ILE A 496 -5.061 1.983 26.969 1.00 15.11 C ATOM 872 CG2 ILE A 496 -6.098 2.121 29.237 1.00 18.73 C ATOM 873 CD1 ILE A 496 -4.863 3.446 26.667 1.00 11.45 C ATOM 0 H ILE A 496 -7.228 0.507 25.843 1.00 13.04 H new ATOM 0 HA ILE A 496 -5.852 -0.318 27.876 1.00 15.68 H new ATOM 0 HB ILE A 496 -7.073 2.196 27.426 1.00 16.67 H new ATOM 0 HG12 ILE A 496 -4.288 1.653 27.454 1.00 15.11 H new ATOM 0 HG13 ILE A 496 -5.104 1.491 26.134 1.00 15.11 H new ATOM 0 HG21 ILE A 496 -5.887 3.067 29.267 1.00 18.73 H new ATOM 0 HG22 ILE A 496 -6.902 1.953 29.753 1.00 18.73 H new ATOM 0 HG23 ILE A 496 -5.361 1.614 29.612 1.00 18.73 H new ATOM 0 HD11 ILE A 496 -4.050 3.563 26.150 1.00 11.45 H new ATOM 0 HD12 ILE A 496 -5.620 3.777 26.158 1.00 11.45 H new ATOM 0 HD13 ILE A 496 -4.791 3.941 27.498 1.00 11.45 H new ATOM 874 N SER A 497 -8.968 0.125 28.508 1.00 17.47 N ATOM 875 CA SER A 497 -10.031 -0.204 29.457 1.00 15.95 C ATOM 876 C SER A 497 -10.166 -1.710 29.633 1.00 15.80 C ATOM 877 O SER A 497 -10.249 -2.223 30.753 1.00 18.13 O ATOM 878 CB SER A 497 -11.370 0.362 28.974 1.00 14.57 C ATOM 879 OG SER A 497 -11.330 1.773 28.910 1.00 20.84 O ATOM 0 H SER A 497 -9.232 0.530 27.797 1.00 17.47 H new ATOM 0 HA SER A 497 -9.794 0.193 30.310 1.00 15.95 H new ATOM 0 HB2 SER A 497 -11.581 0.001 28.099 1.00 14.57 H new ATOM 0 HB3 SER A 497 -12.079 0.082 29.574 1.00 14.57 H new ATOM 0 HG SER A 497 -10.905 2.011 28.226 1.00 20.84 H new ATOM 880 N HIS A 498 -10.194 -2.415 28.511 1.00 12.64 N ATOM 881 CA HIS A 498 -10.333 -3.847 28.525 1.00 11.88 C ATOM 882 C HIS A 498 -9.210 -4.465 29.351 1.00 15.57 C ATOM 883 O HIS A 498 -9.449 -5.321 30.210 1.00 13.06 O ATOM 884 CB HIS A 498 -10.300 -4.379 27.091 1.00 13.09 C ATOM 885 CG HIS A 498 -10.739 -5.802 26.961 1.00 10.36 C ATOM 886 ND1 HIS A 498 -11.948 -6.256 27.440 1.00 12.10 N ATOM 887 CD2 HIS A 498 -10.131 -6.874 26.405 1.00 14.22 C ATOM 888 CE1 HIS A 498 -12.066 -7.546 27.185 1.00 10.05 C ATOM 889 NE2 HIS A 498 -10.977 -7.947 26.557 1.00 15.23 N ATOM 0 H HIS A 498 -10.133 -2.071 27.725 1.00 12.64 H new ATOM 0 HA HIS A 498 -11.182 -4.088 28.928 1.00 11.88 H new ATOM 0 HB2 HIS A 498 -10.869 -3.823 26.536 1.00 13.09 H new ATOM 0 HB3 HIS A 498 -9.397 -4.296 26.745 1.00 13.09 H new ATOM 0 HD2 HIS A 498 -9.296 -6.884 25.996 1.00 14.22 H new ATOM 0 HE1 HIS A 498 -12.793 -8.081 27.410 1.00 10.05 H new ATOM 0 HE2 HIS A 498 -10.822 -8.749 26.287 1.00 15.23 H new ATOM 890 N ILE A 499 -7.980 -4.028 29.089 1.00 15.96 N ATOM 891 CA ILE A 499 -6.825 -4.556 29.812 1.00 16.21 C ATOM 892 C ILE A 499 -6.971 -4.276 31.303 1.00 14.11 C ATOM 893 O ILE A 499 -6.750 -5.156 32.126 1.00 17.20 O ATOM 894 CB ILE A 499 -5.509 -3.946 29.272 1.00 16.74 C ATOM 895 CG1 ILE A 499 -5.158 -4.600 27.935 1.00 16.78 C ATOM 896 CG2 ILE A 499 -4.362 -4.173 30.257 1.00 15.95 C ATOM 897 CD1 ILE A 499 -4.184 -3.789 27.124 1.00 21.13 C ATOM 0 H ILE A 499 -7.793 -3.430 28.500 1.00 15.96 H new ATOM 0 HA ILE A 499 -6.788 -5.515 29.674 1.00 16.21 H new ATOM 0 HB ILE A 499 -5.636 -2.992 29.155 1.00 16.74 H new ATOM 0 HG12 ILE A 499 -4.782 -5.479 28.099 1.00 16.78 H new ATOM 0 HG13 ILE A 499 -5.970 -4.730 27.421 1.00 16.78 H new ATOM 0 HG21 ILE A 499 -3.548 -3.784 29.901 1.00 15.95 H new ATOM 0 HG22 ILE A 499 -4.576 -3.754 31.105 1.00 15.95 H new ATOM 0 HG23 ILE A 499 -4.234 -5.125 30.391 1.00 15.95 H new ATOM 0 HD11 ILE A 499 -3.997 -4.247 26.290 1.00 21.13 H new ATOM 0 HD12 ILE A 499 -4.567 -2.918 26.935 1.00 21.13 H new ATOM 0 HD13 ILE A 499 -3.360 -3.678 27.624 1.00 21.13 H new ATOM 898 N PHE A 500 -7.356 -3.053 31.645 1.00 14.98 N ATOM 899 CA PHE A 500 -7.548 -2.681 33.041 1.00 16.81 C ATOM 900 C PHE A 500 -8.521 -3.646 33.749 1.00 18.87 C ATOM 901 O PHE A 500 -8.280 -4.090 34.879 1.00 17.34 O ATOM 902 CB PHE A 500 -8.090 -1.246 33.119 1.00 16.02 C ATOM 903 CG PHE A 500 -7.025 -0.179 33.129 1.00 17.98 C ATOM 904 CD1 PHE A 500 -5.682 -0.497 32.926 1.00 18.00 C ATOM 905 CD2 PHE A 500 -7.368 1.152 33.341 1.00 19.28 C ATOM 906 CE1 PHE A 500 -4.706 0.487 32.926 1.00 13.70 C ATOM 907 CE2 PHE A 500 -6.396 2.144 33.344 1.00 18.04 C ATOM 908 CZ PHE A 500 -5.056 1.801 33.138 1.00 16.42 C ATOM 0 H PHE A 500 -7.512 -2.422 31.082 1.00 14.98 H new ATOM 0 HA PHE A 500 -6.691 -2.735 33.492 1.00 16.81 H new ATOM 0 HB2 PHE A 500 -8.679 -1.093 32.364 1.00 16.02 H new ATOM 0 HB3 PHE A 500 -8.628 -1.158 33.921 1.00 16.02 H new ATOM 0 HD1 PHE A 500 -5.438 -1.384 32.788 1.00 18.00 H new ATOM 0 HD2 PHE A 500 -8.258 1.380 33.482 1.00 19.28 H new ATOM 0 HE1 PHE A 500 -3.816 0.260 32.783 1.00 13.70 H new ATOM 0 HE2 PHE A 500 -6.635 3.032 33.482 1.00 18.04 H new ATOM 0 HZ PHE A 500 -4.401 2.461 33.144 1.00 16.42 H new ATOM 909 N ASN A 501 -9.625 -3.969 33.080 1.00 20.05 N ATOM 910 CA ASN A 501 -10.618 -4.867 33.660 1.00 19.51 C ATOM 911 C ASN A 501 -10.024 -6.249 33.836 1.00 18.31 C ATOM 912 O ASN A 501 -10.299 -6.943 34.807 1.00 18.19 O ATOM 913 CB ASN A 501 -11.851 -4.948 32.760 1.00 20.33 C ATOM 914 CG ASN A 501 -12.572 -3.622 32.642 1.00 25.18 C ATOM 915 OD1 ASN A 501 -12.427 -2.740 33.493 1.00 29.02 O ATOM 916 ND2 ASN A 501 -13.359 -3.471 31.580 1.00 25.36 N ATOM 0 H ASN A 501 -9.817 -3.680 32.293 1.00 20.05 H new ATOM 0 HA ASN A 501 -10.883 -4.519 34.526 1.00 19.51 H new ATOM 0 HB2 ASN A 501 -11.584 -5.247 31.877 1.00 20.33 H new ATOM 0 HB3 ASN A 501 -12.462 -5.614 33.112 1.00 20.33 H new ATOM 0 HD21 ASN A 501 -13.791 -2.736 31.466 1.00 25.36 H new ATOM 0 HD22 ASN A 501 -13.435 -4.108 31.007 1.00 25.36 H new ATOM 917 N TRP A 502 -9.198 -6.651 32.886 1.00 18.42 N ATOM 918 CA TRP A 502 -8.582 -7.961 32.968 1.00 19.77 C ATOM 919 C TRP A 502 -7.549 -8.006 34.085 1.00 20.02 C ATOM 920 O TRP A 502 -7.425 -9.010 34.778 1.00 22.86 O ATOM 921 CB TRP A 502 -7.924 -8.315 31.641 1.00 17.12 C ATOM 922 CG TRP A 502 -8.805 -9.113 30.767 1.00 17.57 C ATOM 923 CD1 TRP A 502 -9.492 -8.670 29.678 1.00 19.46 C ATOM 924 CD2 TRP A 502 -9.126 -10.500 30.914 1.00 19.51 C ATOM 925 NE1 TRP A 502 -10.222 -9.698 29.132 1.00 22.93 N ATOM 926 CE2 TRP A 502 -10.011 -10.832 29.867 1.00 20.46 C ATOM 927 CE3 TRP A 502 -8.745 -11.494 31.823 1.00 19.66 C ATOM 928 CZ2 TRP A 502 -10.531 -12.121 29.711 1.00 22.55 C ATOM 929 CZ3 TRP A 502 -9.258 -12.775 31.665 1.00 20.11 C ATOM 930 CH2 TRP A 502 -10.144 -13.077 30.615 1.00 22.76 C ATOM 0 H TRP A 502 -8.983 -6.188 32.194 1.00 18.42 H new ATOM 0 HA TRP A 502 -9.276 -8.610 33.164 1.00 19.77 H new ATOM 0 HB2 TRP A 502 -7.671 -7.499 31.181 1.00 17.12 H new ATOM 0 HB3 TRP A 502 -7.107 -8.810 31.811 1.00 17.12 H new ATOM 0 HD1 TRP A 502 -9.470 -7.799 29.352 1.00 19.46 H new ATOM 0 HE1 TRP A 502 -10.729 -9.638 28.440 1.00 22.93 H new ATOM 0 HE3 TRP A 502 -8.160 -11.300 32.519 1.00 19.66 H new ATOM 0 HZ2 TRP A 502 -11.118 -12.323 29.019 1.00 22.55 H new ATOM 0 HZ3 TRP A 502 -9.012 -13.444 32.263 1.00 20.11 H new ATOM 0 HH2 TRP A 502 -10.474 -13.943 30.532 1.00 22.76 H new ATOM 931 N ILE A 503 -6.814 -6.915 34.251 1.00 20.50 N ATOM 932 CA ILE A 503 -5.791 -6.834 35.279 1.00 22.05 C ATOM 933 C ILE A 503 -6.418 -7.068 36.652 1.00 25.54 C ATOM 934 O ILE A 503 -5.946 -7.904 37.425 1.00 25.51 O ATOM 935 CB ILE A 503 -5.100 -5.469 35.233 1.00 21.50 C ATOM 936 CG1 ILE A 503 -4.006 -5.497 34.166 1.00 20.77 C ATOM 937 CG2 ILE A 503 -4.527 -5.125 36.586 1.00 22.02 C ATOM 938 CD1 ILE A 503 -3.585 -4.126 33.682 1.00 23.11 C ATOM 0 H ILE A 503 -6.894 -6.205 33.773 1.00 20.50 H new ATOM 0 HA ILE A 503 -5.125 -7.520 35.117 1.00 22.05 H new ATOM 0 HB ILE A 503 -5.747 -4.784 35.003 1.00 21.50 H new ATOM 0 HG12 ILE A 503 -3.230 -5.956 34.523 1.00 20.77 H new ATOM 0 HG13 ILE A 503 -4.319 -6.016 33.408 1.00 20.77 H new ATOM 0 HG21 ILE A 503 -4.093 -4.259 36.543 1.00 22.02 H new ATOM 0 HG22 ILE A 503 -5.241 -5.096 37.242 1.00 22.02 H new ATOM 0 HG23 ILE A 503 -3.879 -5.799 36.844 1.00 22.02 H new ATOM 0 HD11 ILE A 503 -2.892 -4.219 33.010 1.00 23.11 H new ATOM 0 HD12 ILE A 503 -4.349 -3.670 33.297 1.00 23.11 H new ATOM 0 HD13 ILE A 503 -3.244 -3.610 34.429 1.00 23.11 H new ATOM 939 N ASN A 504 -7.494 -6.345 36.944 1.00 26.25 N ATOM 940 CA ASN A 504 -8.178 -6.503 38.222 1.00 27.59 C ATOM 941 C ASN A 504 -8.735 -7.915 38.362 1.00 28.49 C ATOM 942 O ASN A 504 -8.582 -8.555 39.402 1.00 27.12 O ATOM 943 CB ASN A 504 -9.305 -5.482 38.339 1.00 29.48 C ATOM 944 CG ASN A 504 -8.790 -4.065 38.371 1.00 32.31 C ATOM 945 OD1 ASN A 504 -7.930 -3.728 39.185 1.00 37.59 O ATOM 946 ND2 ASN A 504 -9.305 -3.223 37.482 1.00 32.56 N ATOM 0 H ASN A 504 -7.843 -5.760 36.419 1.00 26.25 H new ATOM 0 HA ASN A 504 -7.538 -6.353 38.935 1.00 27.59 H new ATOM 0 HB2 ASN A 504 -9.913 -5.587 37.590 1.00 29.48 H new ATOM 0 HB3 ASN A 504 -9.815 -5.657 39.145 1.00 29.48 H new ATOM 0 HD21 ASN A 504 -9.039 -2.406 37.460 1.00 32.56 H new ATOM 0 HD22 ASN A 504 -9.905 -3.495 36.929 1.00 32.56 H new ATOM 947 N LYS A 505 -9.369 -8.404 37.303 1.00 28.59 N ATOM 948 CA LYS A 505 -9.952 -9.738 37.312 1.00 31.61 C ATOM 949 C LYS A 505 -8.880 -10.811 37.445 1.00 33.84 C ATOM 950 O LYS A 505 -9.175 -11.957 37.774 1.00 36.32 O ATOM 951 CB LYS A 505 -10.777 -9.954 36.036 1.00 33.62 C ATOM 952 CG LYS A 505 -10.414 -11.184 35.220 1.00 36.12 C ATOM 953 CD LYS A 505 -11.657 -11.855 34.643 1.00 38.19 C ATOM 954 CE LYS A 505 -12.196 -12.906 35.599 1.00 38.67 C ATOM 955 NZ LYS A 505 -12.681 -14.124 34.903 1.00 38.22 N ATOM 0 H LYS A 505 -9.473 -7.975 36.565 1.00 28.59 H new ATOM 0 HA LYS A 505 -10.535 -9.811 38.084 1.00 31.61 H new ATOM 0 HB2 LYS A 505 -11.713 -10.013 36.282 1.00 33.62 H new ATOM 0 HB3 LYS A 505 -10.681 -9.171 35.471 1.00 33.62 H new ATOM 0 HG2 LYS A 505 -9.816 -10.931 34.499 1.00 36.12 H new ATOM 0 HG3 LYS A 505 -9.934 -11.815 35.779 1.00 36.12 H new ATOM 0 HD2 LYS A 505 -12.340 -11.188 34.471 1.00 38.19 H new ATOM 0 HD3 LYS A 505 -11.442 -12.266 33.791 1.00 38.19 H new ATOM 0 HE2 LYS A 505 -11.499 -13.153 36.227 1.00 38.67 H new ATOM 0 HE3 LYS A 505 -12.922 -12.524 36.117 1.00 38.67 H new ATOM 0 HZ1 LYS A 505 -12.985 -14.707 35.502 1.00 38.22 H new ATOM 0 HZ2 LYS A 505 -13.337 -13.905 34.343 1.00 38.22 H new ATOM 0 HZ3 LYS A 505 -12.012 -14.491 34.446 1.00 38.22 H new ATOM 956 N LEU A 506 -7.632 -10.432 37.191 1.00 35.05 N ATOM 957 CA LEU A 506 -6.513 -11.362 37.284 1.00 34.64 C ATOM 958 C LEU A 506 -5.828 -11.193 38.634 1.00 35.49 C ATOM 959 O LEU A 506 -5.096 -12.068 39.094 1.00 34.80 O ATOM 960 CB LEU A 506 -5.520 -11.101 36.152 1.00 31.82 C ATOM 961 CG LEU A 506 -6.003 -11.607 34.793 1.00 29.44 C ATOM 962 CD1 LEU A 506 -5.109 -11.083 33.681 1.00 28.52 C ATOM 963 CD2 LEU A 506 -6.019 -13.113 34.807 1.00 26.50 C ATOM 0 H LEU A 506 -7.411 -9.633 36.961 1.00 35.05 H new ATOM 0 HA LEU A 506 -6.841 -12.271 37.203 1.00 34.64 H new ATOM 0 HB2 LEU A 506 -5.350 -10.148 36.093 1.00 31.82 H new ATOM 0 HB3 LEU A 506 -4.675 -11.527 36.367 1.00 31.82 H new ATOM 0 HG LEU A 506 -6.901 -11.281 34.625 1.00 29.44 H new ATOM 0 HD11 LEU A 506 -5.428 -11.413 32.826 1.00 28.52 H new ATOM 0 HD12 LEU A 506 -5.128 -10.113 33.680 1.00 28.52 H new ATOM 0 HD13 LEU A 506 -4.200 -11.388 33.825 1.00 28.52 H new ATOM 0 HD21 LEU A 506 -6.325 -13.442 33.947 1.00 26.50 H new ATOM 0 HD22 LEU A 506 -5.124 -13.445 34.980 1.00 26.50 H new ATOM 0 HD23 LEU A 506 -6.619 -13.424 35.503 1.00 26.50 H new ATOM 964 N LYS A 507 -6.081 -10.055 39.265 1.00 37.41 N ATOM 965 CA LYS A 507 -5.512 -9.763 40.566 1.00 38.48 C ATOM 966 C LYS A 507 -5.948 -10.842 41.554 1.00 40.37 C ATOM 967 O LYS A 507 -5.202 -11.197 42.462 1.00 43.14 O ATOM 968 CB LYS A 507 -5.990 -8.392 41.045 1.00 37.52 C ATOM 969 CG LYS A 507 -4.886 -7.503 41.587 1.00 38.20 C ATOM 970 CD LYS A 507 -4.927 -6.119 40.964 1.00 38.76 C ATOM 971 CE LYS A 507 -6.136 -5.333 41.438 1.00 39.62 C ATOM 972 NZ LYS A 507 -6.050 -3.900 41.034 1.00 41.94 N ATOM 0 H LYS A 507 -6.586 -9.434 38.951 1.00 37.41 H new ATOM 0 HA LYS A 507 -4.544 -9.752 40.504 1.00 38.48 H new ATOM 0 HB2 LYS A 507 -6.425 -7.937 40.307 1.00 37.52 H new ATOM 0 HB3 LYS A 507 -6.659 -8.517 41.736 1.00 37.52 H new ATOM 0 HG2 LYS A 507 -4.973 -7.428 42.550 1.00 38.20 H new ATOM 0 HG3 LYS A 507 -4.024 -7.912 41.411 1.00 38.20 H new ATOM 0 HD2 LYS A 507 -4.117 -5.637 41.190 1.00 38.76 H new ATOM 0 HD3 LYS A 507 -4.949 -6.198 39.997 1.00 38.76 H new ATOM 0 HE2 LYS A 507 -6.943 -5.726 41.070 1.00 39.62 H new ATOM 0 HE3 LYS A 507 -6.205 -5.394 42.404 1.00 39.62 H new ATOM 0 HZ1 LYS A 507 -6.383 -3.388 41.682 1.00 41.94 H new ATOM 0 HZ2 LYS A 507 -5.199 -3.682 40.892 1.00 41.94 H new ATOM 0 HZ3 LYS A 507 -6.517 -3.773 40.287 1.00 41.94 H new ATOM 973 N THR A 508 -7.153 -11.372 41.362 1.00 40.73 N ATOM 974 CA THR A 508 -7.693 -12.403 42.244 1.00 39.83 C ATOM 975 C THR A 508 -7.135 -13.779 41.928 1.00 39.37 C ATOM 976 O THR A 508 -7.717 -14.790 42.314 1.00 41.14 O ATOM 977 CB THR A 508 -9.232 -12.488 42.138 1.00 40.32 C ATOM 978 OG1 THR A 508 -9.588 -13.315 41.022 1.00 38.24 O ATOM 979 CG2 THR A 508 -9.840 -11.099 41.962 1.00 39.69 C ATOM 0 H THR A 508 -7.678 -11.145 40.720 1.00 40.73 H new ATOM 0 HA THR A 508 -7.430 -12.143 43.141 1.00 39.83 H new ATOM 0 HB THR A 508 -9.579 -12.874 42.958 1.00 40.32 H new ATOM 0 HG1 THR A 508 -10.425 -13.363 40.964 1.00 38.24 H new ATOM 0 HG21 THR A 508 -10.805 -11.174 41.898 1.00 39.69 H new ATOM 0 HG22 THR A 508 -9.609 -10.546 42.724 1.00 39.69 H new ATOM 0 HG23 THR A 508 -9.493 -10.694 41.152 1.00 39.69 H new ATOM 980 N LYS A 509 -6.011 -13.821 41.222 1.00 38.28 N ATOM 981 CA LYS A 509 -5.389 -15.089 40.861 1.00 35.71 C ATOM 982 C LYS A 509 -3.911 -15.083 41.244 1.00 33.49 C ATOM 983 O LYS A 509 -3.191 -16.044 41.001 1.00 31.68 O ATOM 984 CB LYS A 509 -5.542 -15.336 39.361 1.00 36.47 C ATOM 985 CG LYS A 509 -5.993 -16.741 38.998 1.00 40.47 C ATOM 986 CD LYS A 509 -5.320 -17.212 37.716 1.00 42.51 C ATOM 987 CE LYS A 509 -5.562 -16.245 36.565 1.00 42.74 C ATOM 988 NZ LYS A 509 -6.714 -16.682 35.730 1.00 43.89 N ATOM 0 H LYS A 509 -5.592 -13.125 40.942 1.00 38.28 H new ATOM 0 HA LYS A 509 -5.832 -15.803 41.346 1.00 35.71 H new ATOM 0 HB2 LYS A 509 -6.182 -14.700 39.003 1.00 36.47 H new ATOM 0 HB3 LYS A 509 -4.693 -15.159 38.927 1.00 36.47 H new ATOM 0 HG2 LYS A 509 -5.781 -17.350 39.722 1.00 40.47 H new ATOM 0 HG3 LYS A 509 -6.956 -16.757 38.887 1.00 40.47 H new ATOM 0 HD2 LYS A 509 -4.366 -17.305 37.866 1.00 42.51 H new ATOM 0 HD3 LYS A 509 -5.656 -18.090 37.477 1.00 42.51 H new ATOM 0 HE2 LYS A 509 -5.732 -15.357 36.916 1.00 42.74 H new ATOM 0 HE3 LYS A 509 -4.765 -16.186 36.016 1.00 42.74 H new ATOM 0 HZ1 LYS A 509 -6.836 -16.103 35.065 1.00 43.89 H new ATOM 0 HZ2 LYS A 509 -6.548 -17.489 35.393 1.00 43.89 H new ATOM 0 HZ3 LYS A 509 -7.448 -16.716 36.232 1.00 43.89 H new ATOM 989 N GLY A 510 -3.471 -13.990 41.853 1.00 32.69 N ATOM 990 CA GLY A 510 -2.085 -13.883 42.268 1.00 32.10 C ATOM 991 C GLY A 510 -1.267 -13.063 41.297 1.00 30.45 C ATOM 992 O GLY A 510 -0.086 -12.820 41.520 1.00 29.45 O ATOM 0 H GLY A 510 -3.957 -13.304 42.034 1.00 32.69 H new ATOM 0 HA2 GLY A 510 -2.042 -13.479 43.149 1.00 32.10 H new ATOM 0 HA3 GLY A 510 -1.701 -14.771 42.344 1.00 32.10 H new ATOM 993 N TRP A 511 -1.907 -12.628 40.217 1.00 28.86 N ATOM 994 CA TRP A 511 -1.237 -11.838 39.197 1.00 24.89 C ATOM 995 C TRP A 511 -1.209 -10.347 39.493 1.00 24.71 C ATOM 996 O TRP A 511 -2.219 -9.752 39.864 1.00 23.31 O ATOM 997 CB TRP A 511 -1.920 -12.045 37.849 1.00 25.87 C ATOM 998 CG TRP A 511 -1.458 -13.249 37.124 1.00 24.75 C ATOM 999 CD1 TRP A 511 -2.165 -14.392 36.911 1.00 26.09 C ATOM 1000 CD2 TRP A 511 -0.179 -13.438 36.502 1.00 26.19 C ATOM 1001 NE1 TRP A 511 -1.406 -15.291 36.199 1.00 28.72 N ATOM 1002 CE2 TRP A 511 -0.187 -14.736 35.944 1.00 26.95 C ATOM 1003 CE3 TRP A 511 0.967 -12.645 36.378 1.00 24.61 C ATOM 1004 CZ2 TRP A 511 0.918 -15.250 35.255 1.00 26.47 C ATOM 1005 CZ3 TRP A 511 2.059 -13.160 35.702 1.00 23.73 C ATOM 1006 CH2 TRP A 511 2.024 -14.449 35.141 1.00 25.09 C ATOM 0 H TRP A 511 -2.738 -12.783 40.057 1.00 28.86 H new ATOM 0 HA TRP A 511 -0.318 -12.149 39.184 1.00 24.89 H new ATOM 0 HB2 TRP A 511 -2.878 -12.109 37.988 1.00 25.87 H new ATOM 0 HB3 TRP A 511 -1.765 -11.264 37.294 1.00 25.87 H new ATOM 0 HD1 TRP A 511 -3.035 -14.543 37.204 1.00 26.09 H new ATOM 0 HE1 TRP A 511 -1.659 -16.076 35.954 1.00 28.72 H new ATOM 0 HE3 TRP A 511 0.994 -11.790 36.742 1.00 24.61 H new ATOM 0 HZ2 TRP A 511 0.902 -16.104 34.888 1.00 26.47 H new ATOM 0 HZ3 TRP A 511 2.829 -12.645 35.617 1.00 23.73 H new ATOM 0 HH2 TRP A 511 2.769 -14.765 34.682 1.00 25.09 H new ATOM 1007 N ASP A 512 -0.038 -9.749 39.320 1.00 22.81 N ATOM 1008 CA ASP A 512 0.132 -8.324 39.504 1.00 23.21 C ATOM 1009 C ASP A 512 0.695 -7.819 38.180 1.00 24.16 C ATOM 1010 O ASP A 512 1.837 -8.126 37.832 1.00 24.62 O ATOM 1011 CB ASP A 512 1.113 -8.029 40.636 1.00 25.28 C ATOM 1012 CG ASP A 512 1.232 -6.541 40.928 1.00 30.30 C ATOM 1013 OD1 ASP A 512 0.506 -5.749 40.291 1.00 33.23 O ATOM 1014 OD2 ASP A 512 2.049 -6.159 41.794 1.00 33.76 O ATOM 0 H ASP A 512 0.680 -10.163 39.092 1.00 22.81 H new ATOM 0 HA ASP A 512 -0.704 -7.893 39.742 1.00 23.21 H new ATOM 0 HB2 ASP A 512 0.825 -8.491 41.439 1.00 25.28 H new ATOM 0 HB3 ASP A 512 1.986 -8.381 40.404 1.00 25.28 H new ATOM 1015 N TYR A 513 -0.113 -7.060 37.441 1.00 20.78 N ATOM 1016 CA TYR A 513 0.298 -6.526 36.143 1.00 16.95 C ATOM 1017 C TYR A 513 0.636 -5.048 36.183 1.00 17.94 C ATOM 1018 O TYR A 513 -0.024 -4.262 36.868 1.00 18.08 O ATOM 1019 CB TYR A 513 -0.809 -6.742 35.107 1.00 13.63 C ATOM 1020 CG TYR A 513 -0.835 -8.130 34.555 1.00 10.61 C ATOM 1021 CD1 TYR A 513 -0.102 -8.465 33.416 1.00 10.33 C ATOM 1022 CD2 TYR A 513 -1.577 -9.122 35.175 1.00 10.61 C ATOM 1023 CE1 TYR A 513 -0.112 -9.758 32.912 1.00 10.36 C ATOM 1024 CE2 TYR A 513 -1.594 -10.417 34.680 1.00 13.90 C ATOM 1025 CZ TYR A 513 -0.864 -10.728 33.549 1.00 13.71 C ATOM 1026 OH TYR A 513 -0.918 -12.007 33.051 1.00 19.23 O ATOM 0 H TYR A 513 -0.911 -6.841 37.676 1.00 20.78 H new ATOM 0 HA TYR A 513 1.103 -7.009 35.898 1.00 16.95 H new ATOM 0 HB2 TYR A 513 -1.667 -6.546 35.514 1.00 13.63 H new ATOM 0 HB3 TYR A 513 -0.690 -6.113 34.379 1.00 13.63 H new ATOM 0 HD1 TYR A 513 0.402 -7.811 32.987 1.00 10.33 H new ATOM 0 HD2 TYR A 513 -2.072 -8.916 35.935 1.00 10.61 H new ATOM 0 HE1 TYR A 513 0.382 -9.970 32.153 1.00 10.36 H new ATOM 0 HE2 TYR A 513 -2.095 -11.074 35.108 1.00 13.90 H new ATOM 0 HH TYR A 513 -0.840 -11.986 32.215 1.00 19.23 H new ATOM 1027 N LYS A 514 1.664 -4.667 35.433 1.00 16.95 N ATOM 1028 CA LYS A 514 2.071 -3.275 35.364 1.00 16.89 C ATOM 1029 C LYS A 514 1.961 -2.869 33.902 1.00 15.22 C ATOM 1030 O LYS A 514 2.259 -3.663 33.016 1.00 15.53 O ATOM 1031 CB LYS A 514 3.509 -3.117 35.860 1.00 21.61 C ATOM 1032 CG LYS A 514 3.615 -2.537 37.264 1.00 26.45 C ATOM 1033 CD LYS A 514 3.120 -3.518 38.315 1.00 29.60 C ATOM 1034 CE LYS A 514 3.218 -2.933 39.721 1.00 30.91 C ATOM 1035 NZ LYS A 514 2.019 -2.128 40.086 1.00 32.81 N ATOM 0 H LYS A 514 2.139 -5.203 34.956 1.00 16.95 H new ATOM 0 HA LYS A 514 1.512 -2.715 35.925 1.00 16.89 H new ATOM 0 HB2 LYS A 514 3.945 -3.983 35.843 1.00 21.61 H new ATOM 0 HB3 LYS A 514 3.993 -2.544 35.245 1.00 21.61 H new ATOM 0 HG2 LYS A 514 4.538 -2.302 37.449 1.00 26.45 H new ATOM 0 HG3 LYS A 514 3.098 -1.718 37.316 1.00 26.45 H new ATOM 0 HD2 LYS A 514 2.199 -3.757 38.127 1.00 29.60 H new ATOM 0 HD3 LYS A 514 3.641 -4.335 38.267 1.00 29.60 H new ATOM 0 HE2 LYS A 514 3.328 -3.653 40.361 1.00 30.91 H new ATOM 0 HE3 LYS A 514 4.010 -2.376 39.782 1.00 30.91 H new ATOM 0 HZ1 LYS A 514 2.180 -1.678 40.837 1.00 32.81 H new ATOM 0 HZ2 LYS A 514 1.836 -1.554 39.431 1.00 32.81 H new ATOM 0 HZ3 LYS A 514 1.324 -2.670 40.209 1.00 32.81 H new ATOM 1036 N VAL A 515 1.537 -1.636 33.659 1.00 15.53 N ATOM 1037 CA VAL A 515 1.358 -1.140 32.307 1.00 14.32 C ATOM 1038 C VAL A 515 2.044 0.188 32.088 1.00 14.19 C ATOM 1039 O VAL A 515 1.867 1.124 32.870 1.00 15.48 O ATOM 1040 CB VAL A 515 -0.146 -0.937 31.979 1.00 15.64 C ATOM 1041 CG1 VAL A 515 -0.319 -0.506 30.527 1.00 15.61 C ATOM 1042 CG2 VAL A 515 -0.911 -2.211 32.246 1.00 18.77 C ATOM 0 H VAL A 515 1.346 -1.066 34.274 1.00 15.53 H new ATOM 0 HA VAL A 515 1.751 -1.812 31.728 1.00 14.32 H new ATOM 0 HB VAL A 515 -0.499 -0.237 32.550 1.00 15.64 H new ATOM 0 HG11 VAL A 515 -1.262 -0.383 30.336 1.00 15.61 H new ATOM 0 HG12 VAL A 515 0.152 0.329 30.379 1.00 15.61 H new ATOM 0 HG13 VAL A 515 0.043 -1.189 29.941 1.00 15.61 H new ATOM 0 HG21 VAL A 515 -1.849 -2.075 32.039 1.00 18.77 H new ATOM 0 HG22 VAL A 515 -0.557 -2.923 31.691 1.00 18.77 H new ATOM 0 HG23 VAL A 515 -0.819 -2.454 33.181 1.00 18.77 H new ATOM 1043 N ASN A 516 2.833 0.274 31.021 1.00 11.87 N ATOM 1044 CA ASN A 516 3.493 1.521 30.687 1.00 12.77 C ATOM 1045 C ASN A 516 3.356 1.704 29.181 1.00 13.36 C ATOM 1046 O ASN A 516 3.164 0.731 28.459 1.00 15.24 O ATOM 1047 CB ASN A 516 4.965 1.522 31.159 1.00 13.36 C ATOM 1048 CG ASN A 516 5.867 0.605 30.351 1.00 10.46 C ATOM 1049 OD1 ASN A 516 5.664 -0.702 30.470 1.00 19.22 O flip ATOM 1050 ND2 ASN A 516 6.758 1.074 29.648 1.00 11.70 N flip ATOM 0 H ASN A 516 2.996 -0.377 30.483 1.00 11.87 H new ATOM 0 HA ASN A 516 3.081 2.270 31.146 1.00 12.77 H new ATOM 0 HB2 ASN A 516 5.311 2.427 31.111 1.00 13.36 H new ATOM 0 HB3 ASN A 516 4.997 1.255 32.091 1.00 13.36 H new ATOM 0 HD21 ASN A 516 6.860 1.926 29.595 1.00 11.70 H new ATOM 0 HD22 ASN A 516 7.280 0.550 29.209 1.00 11.70 H new ATOM 1051 N CYS A 517 3.430 2.940 28.705 1.00 13.46 N ATOM 1052 CA CYS A 517 3.253 3.188 27.275 1.00 13.45 C ATOM 1053 C CYS A 517 4.104 4.309 26.703 1.00 12.86 C ATOM 1054 O CYS A 517 4.658 5.133 27.429 1.00 13.58 O ATOM 1055 CB CYS A 517 1.774 3.507 26.998 1.00 12.43 C ATOM 1056 SG CYS A 517 1.231 5.116 27.649 1.00 15.62 S ATOM 0 H CYS A 517 3.579 3.640 29.181 1.00 13.46 H new ATOM 0 HA CYS A 517 3.547 2.376 26.834 1.00 13.45 H new ATOM 0 HB2 CYS A 517 1.622 3.488 26.040 1.00 12.43 H new ATOM 0 HB3 CYS A 517 1.224 2.809 27.386 1.00 12.43 H new ATOM 0 HG CYS A 517 0.072 5.283 27.388 1.00 15.62 H new ATOM 1057 N GLU A 518 4.199 4.324 25.378 1.00 12.10 N ATOM 1058 CA GLU A 518 4.922 5.358 24.653 1.00 13.25 C ATOM 1059 C GLU A 518 4.064 5.703 23.448 1.00 13.63 C ATOM 1060 O GLU A 518 3.337 4.854 22.940 1.00 14.42 O ATOM 1061 CB GLU A 518 6.270 4.845 24.153 1.00 15.71 C ATOM 1062 CG GLU A 518 7.194 4.341 25.243 1.00 17.28 C ATOM 1063 CD GLU A 518 6.994 2.872 25.536 1.00 19.04 C ATOM 1064 OE1 GLU A 518 7.048 2.058 24.588 1.00 17.44 O ATOM 1065 OE2 GLU A 518 6.779 2.526 26.715 1.00 21.50 O ATOM 0 H GLU A 518 3.842 3.728 24.871 1.00 12.10 H new ATOM 0 HA GLU A 518 5.088 6.119 25.231 1.00 13.25 H new ATOM 0 HB2 GLU A 518 6.115 4.128 23.519 1.00 15.71 H new ATOM 0 HB3 GLU A 518 6.716 5.559 23.671 1.00 15.71 H new ATOM 0 HG2 GLU A 518 8.115 4.493 24.978 1.00 17.28 H new ATOM 0 HG3 GLU A 518 7.044 4.853 26.053 1.00 17.28 H new ATOM 1066 N PHE A 519 4.129 6.945 23.004 1.00 12.56 N ATOM 1067 CA PHE A 519 3.378 7.338 21.825 1.00 15.48 C ATOM 1068 C PHE A 519 4.339 8.080 20.915 1.00 14.92 C ATOM 1069 O PHE A 519 4.785 9.182 21.233 1.00 15.58 O ATOM 1070 CB PHE A 519 2.190 8.242 22.181 1.00 12.06 C ATOM 1071 CG PHE A 519 1.267 8.519 21.015 1.00 12.78 C ATOM 1072 CD1 PHE A 519 0.963 7.520 20.097 1.00 13.31 C ATOM 1073 CD2 PHE A 519 0.709 9.778 20.834 1.00 12.16 C ATOM 1074 CE1 PHE A 519 0.101 7.773 19.011 1.00 12.24 C ATOM 1075 CE2 PHE A 519 -0.154 10.043 19.751 1.00 15.33 C ATOM 1076 CZ PHE A 519 -0.452 9.037 18.842 1.00 9.57 C ATOM 0 H PHE A 519 4.596 7.571 23.365 1.00 12.56 H new ATOM 0 HA PHE A 519 3.011 6.551 21.392 1.00 15.48 H new ATOM 0 HB2 PHE A 519 1.681 7.828 22.895 1.00 12.06 H new ATOM 0 HB3 PHE A 519 2.526 9.085 22.524 1.00 12.06 H new ATOM 0 HD1 PHE A 519 1.333 6.673 20.201 1.00 13.31 H new ATOM 0 HD2 PHE A 519 0.908 10.457 21.437 1.00 12.16 H new ATOM 0 HE1 PHE A 519 -0.098 7.094 18.407 1.00 12.24 H new ATOM 0 HE2 PHE A 519 -0.523 10.890 19.646 1.00 15.33 H new ATOM 0 HZ PHE A 519 -1.018 9.208 18.124 1.00 9.57 H new ATOM 1077 N ILE A 520 4.678 7.470 19.788 1.00 16.47 N ATOM 1078 CA ILE A 520 5.595 8.115 18.861 1.00 16.64 C ATOM 1079 C ILE A 520 5.040 8.134 17.445 1.00 19.25 C ATOM 1080 O ILE A 520 4.018 7.504 17.149 1.00 16.65 O ATOM 1081 CB ILE A 520 6.976 7.402 18.814 1.00 18.25 C ATOM 1082 CG1 ILE A 520 6.945 6.281 17.766 1.00 17.28 C ATOM 1083 CG2 ILE A 520 7.388 6.943 20.211 1.00 17.32 C ATOM 1084 CD1 ILE A 520 6.988 4.884 18.310 1.00 18.37 C ATOM 0 H ILE A 520 4.394 6.696 19.544 1.00 16.47 H new ATOM 0 HA ILE A 520 5.704 9.021 19.191 1.00 16.64 H new ATOM 0 HB ILE A 520 7.667 8.021 18.530 1.00 18.25 H new ATOM 0 HG12 ILE A 520 6.140 6.379 17.234 1.00 17.28 H new ATOM 0 HG13 ILE A 520 7.697 6.400 17.166 1.00 17.28 H new ATOM 0 HG21 ILE A 520 8.250 6.501 20.165 1.00 17.32 H new ATOM 0 HG22 ILE A 520 7.450 7.712 20.799 1.00 17.32 H new ATOM 0 HG23 ILE A 520 6.726 6.324 20.557 1.00 17.32 H new ATOM 0 HD11 ILE A 520 6.964 4.250 17.576 1.00 18.37 H new ATOM 0 HD12 ILE A 520 7.805 4.759 18.818 1.00 18.37 H new ATOM 0 HD13 ILE A 520 6.223 4.738 18.888 1.00 18.37 H new ATOM 1085 N GLU A 521 5.728 8.863 16.575 1.00 18.71 N ATOM 1086 CA GLU A 521 5.343 8.933 15.179 1.00 20.94 C ATOM 1087 C GLU A 521 6.593 8.702 14.335 1.00 21.04 C ATOM 1088 O GLU A 521 7.711 9.005 14.760 1.00 20.83 O ATOM 1089 CB GLU A 521 4.734 10.296 14.858 1.00 20.27 C ATOM 1090 CG GLU A 521 5.735 11.306 14.350 1.00 21.87 C ATOM 1091 CD GLU A 521 5.074 12.516 13.742 1.00 23.07 C ATOM 1092 OE1 GLU A 521 3.823 12.577 13.744 1.00 24.35 O ATOM 1093 OE2 GLU A 521 5.807 13.406 13.268 1.00 22.21 O ATOM 0 H GLU A 521 6.424 9.326 16.777 1.00 18.71 H new ATOM 0 HA GLU A 521 4.674 8.258 14.985 1.00 20.94 H new ATOM 0 HB2 GLU A 521 4.037 10.181 14.193 1.00 20.27 H new ATOM 0 HB3 GLU A 521 4.309 10.647 15.656 1.00 20.27 H new ATOM 0 HG2 GLU A 521 6.307 11.587 15.082 1.00 21.87 H new ATOM 0 HG3 GLU A 521 6.306 10.886 13.688 1.00 21.87 H new ATOM 1094 N ILE A 522 6.398 8.119 13.160 1.00 19.38 N ATOM 1095 CA ILE A 522 7.493 7.885 12.235 1.00 17.13 C ATOM 1096 C ILE A 522 7.177 8.750 11.018 1.00 18.83 C ATOM 1097 O ILE A 522 6.205 8.504 10.293 1.00 17.97 O ATOM 1098 CB ILE A 522 7.597 6.397 11.828 1.00 14.41 C ATOM 1099 CG1 ILE A 522 8.098 5.577 13.021 1.00 11.24 C ATOM 1100 CG2 ILE A 522 8.546 6.239 10.626 1.00 14.27 C ATOM 1101 CD1 ILE A 522 8.060 4.078 12.812 1.00 9.65 C ATOM 0 H ILE A 522 5.631 7.850 12.879 1.00 19.38 H new ATOM 0 HA ILE A 522 8.346 8.109 12.639 1.00 17.13 H new ATOM 0 HB ILE A 522 6.721 6.073 11.567 1.00 14.41 H new ATOM 0 HG12 ILE A 522 9.010 5.841 13.221 1.00 11.24 H new ATOM 0 HG13 ILE A 522 7.562 5.798 13.799 1.00 11.24 H new ATOM 0 HG21 ILE A 522 8.603 5.303 10.380 1.00 14.27 H new ATOM 0 HG22 ILE A 522 8.205 6.750 9.875 1.00 14.27 H new ATOM 0 HG23 ILE A 522 9.428 6.565 10.865 1.00 14.27 H new ATOM 0 HD11 ILE A 522 8.391 3.632 13.607 1.00 9.65 H new ATOM 0 HD12 ILE A 522 7.147 3.798 12.641 1.00 9.65 H new ATOM 0 HD13 ILE A 522 8.618 3.843 12.054 1.00 9.65 H new ATOM 1102 N TYR A 523 7.982 9.789 10.832 1.00 15.75 N ATOM 1103 CA TYR A 523 7.817 10.721 9.728 1.00 15.86 C ATOM 1104 C TYR A 523 9.116 10.765 8.931 1.00 18.56 C ATOM 1105 O TYR A 523 10.175 11.137 9.459 1.00 16.45 O ATOM 1106 CB TYR A 523 7.476 12.107 10.272 1.00 16.25 C ATOM 1107 CG TYR A 523 7.390 13.187 9.220 1.00 20.59 C ATOM 1108 CD1 TYR A 523 6.533 13.062 8.123 1.00 20.49 C ATOM 1109 CD2 TYR A 523 8.154 14.344 9.327 1.00 21.08 C ATOM 1110 CE1 TYR A 523 6.442 14.067 7.159 1.00 20.77 C ATOM 1111 CE2 TYR A 523 8.073 15.354 8.376 1.00 23.84 C ATOM 1112 CZ TYR A 523 7.215 15.211 7.292 1.00 26.10 C ATOM 1113 OH TYR A 523 7.141 16.216 6.348 1.00 28.37 O ATOM 0 H TYR A 523 8.645 9.973 11.348 1.00 15.75 H new ATOM 0 HA TYR A 523 7.093 10.433 9.150 1.00 15.86 H new ATOM 0 HB2 TYR A 523 6.628 12.059 10.740 1.00 16.25 H new ATOM 0 HB3 TYR A 523 8.147 12.360 10.925 1.00 16.25 H new ATOM 0 HD1 TYR A 523 6.014 12.295 8.034 1.00 20.49 H new ATOM 0 HD2 TYR A 523 8.731 14.444 10.050 1.00 21.08 H new ATOM 0 HE1 TYR A 523 5.868 13.971 6.434 1.00 20.77 H new ATOM 0 HE2 TYR A 523 8.590 16.122 8.464 1.00 23.84 H new ATOM 0 HH TYR A 523 7.302 15.898 5.587 1.00 28.37 H new ATOM 1114 N ASN A 524 9.035 10.373 7.663 1.00 18.44 N ATOM 1115 CA ASN A 524 10.214 10.350 6.809 1.00 20.83 C ATOM 1116 C ASN A 524 11.263 9.409 7.389 1.00 22.29 C ATOM 1117 O ASN A 524 12.462 9.697 7.346 1.00 23.44 O ATOM 1118 CB ASN A 524 10.795 11.749 6.695 1.00 22.76 C ATOM 1119 CG ASN A 524 10.183 12.526 5.577 1.00 25.54 C ATOM 1120 OD1 ASN A 524 9.950 11.986 4.499 1.00 29.31 O ATOM 1121 ND2 ASN A 524 9.910 13.802 5.819 1.00 24.83 N ATOM 0 H ASN A 524 8.308 10.118 7.280 1.00 18.44 H new ATOM 0 HA ASN A 524 9.956 10.035 5.929 1.00 20.83 H new ATOM 0 HB2 ASN A 524 10.657 12.224 7.530 1.00 22.76 H new ATOM 0 HB3 ASN A 524 11.753 11.689 6.558 1.00 22.76 H new ATOM 0 HD21 ASN A 524 9.554 14.289 5.206 1.00 24.83 H new ATOM 0 HD22 ASN A 524 10.089 14.142 6.589 1.00 24.83 H new ATOM 1122 N GLU A 525 10.797 8.289 7.938 1.00 20.80 N ATOM 1123 CA GLU A 525 11.665 7.277 8.531 1.00 20.59 C ATOM 1124 C GLU A 525 12.389 7.729 9.805 1.00 20.86 C ATOM 1125 O GLU A 525 13.337 7.079 10.242 1.00 22.52 O ATOM 1126 CB GLU A 525 12.683 6.783 7.496 1.00 21.80 C ATOM 1127 CG GLU A 525 12.064 6.113 6.272 1.00 25.11 C ATOM 1128 CD GLU A 525 11.118 4.956 6.622 1.00 29.49 C ATOM 1129 OE1 GLU A 525 11.601 3.807 6.761 1.00 27.37 O ATOM 1130 OE2 GLU A 525 9.892 5.192 6.751 1.00 27.63 O ATOM 0 H GLU A 525 9.960 8.095 7.976 1.00 20.80 H new ATOM 0 HA GLU A 525 11.078 6.554 8.803 1.00 20.59 H new ATOM 0 HB2 GLU A 525 13.220 7.535 7.202 1.00 21.80 H new ATOM 0 HB3 GLU A 525 13.285 6.155 7.925 1.00 21.80 H new ATOM 0 HG2 GLU A 525 11.576 6.777 5.760 1.00 25.11 H new ATOM 0 HG3 GLU A 525 12.774 5.780 5.701 1.00 25.11 H new ATOM 1131 N ASN A 526 11.949 8.834 10.403 1.00 20.40 N ATOM 1132 CA ASN A 526 12.562 9.323 11.640 1.00 19.42 C ATOM 1133 C ASN A 526 11.558 9.171 12.767 1.00 19.75 C ATOM 1134 O ASN A 526 10.371 9.410 12.576 1.00 20.12 O ATOM 1135 CB ASN A 526 12.941 10.797 11.521 1.00 17.06 C ATOM 1136 CG ASN A 526 14.151 11.019 10.635 1.00 19.21 C ATOM 1137 OD1 ASN A 526 15.016 10.021 10.559 1.00 23.03 O flip ATOM 1138 ND2 ASN A 526 14.302 12.077 10.023 1.00 17.26 N flip ATOM 0 H ASN A 526 11.299 9.315 10.111 1.00 20.40 H new ATOM 0 HA ASN A 526 13.366 8.809 11.814 1.00 19.42 H new ATOM 0 HB2 ASN A 526 12.188 11.293 11.164 1.00 17.06 H new ATOM 0 HB3 ASN A 526 13.122 11.153 12.405 1.00 17.06 H new ATOM 0 HD21 ASN A 526 13.718 12.704 10.097 1.00 17.26 H new ATOM 0 HD22 ASN A 526 14.992 12.189 9.521 1.00 17.26 H new ATOM 1139 N ILE A 527 12.030 8.775 13.941 1.00 18.88 N ATOM 1140 CA ILE A 527 11.146 8.610 15.092 1.00 17.63 C ATOM 1141 C ILE A 527 11.059 9.899 15.908 1.00 19.08 C ATOM 1142 O ILE A 527 12.076 10.519 16.222 1.00 19.22 O ATOM 1143 CB ILE A 527 11.633 7.465 16.010 1.00 15.67 C ATOM 1144 CG1 ILE A 527 11.292 6.114 15.372 1.00 15.71 C ATOM 1145 CG2 ILE A 527 10.997 7.588 17.402 1.00 16.38 C ATOM 1146 CD1 ILE A 527 11.940 4.915 16.055 1.00 15.37 C ATOM 0 H ILE A 527 12.857 8.596 14.095 1.00 18.88 H new ATOM 0 HA ILE A 527 10.267 8.390 14.746 1.00 17.63 H new ATOM 0 HB ILE A 527 12.595 7.527 16.115 1.00 15.67 H new ATOM 0 HG12 ILE A 527 10.329 5.997 15.383 1.00 15.71 H new ATOM 0 HG13 ILE A 527 11.566 6.130 14.442 1.00 15.71 H new ATOM 0 HG21 ILE A 527 11.311 6.864 17.967 1.00 16.38 H new ATOM 0 HG22 ILE A 527 11.246 8.438 17.798 1.00 16.38 H new ATOM 0 HG23 ILE A 527 10.031 7.540 17.322 1.00 16.38 H new ATOM 0 HD11 ILE A 527 11.678 4.101 15.597 1.00 15.37 H new ATOM 0 HD12 ILE A 527 12.905 5.007 16.024 1.00 15.37 H new ATOM 0 HD13 ILE A 527 11.649 4.873 16.979 1.00 15.37 H new ATOM 1147 N VAL A 528 9.835 10.298 16.236 1.00 16.33 N ATOM 1148 CA VAL A 528 9.572 11.500 17.020 1.00 17.45 C ATOM 1149 C VAL A 528 8.728 11.098 18.239 1.00 18.20 C ATOM 1150 O VAL A 528 7.754 10.350 18.105 1.00 17.77 O ATOM 1151 CB VAL A 528 8.788 12.562 16.179 1.00 19.25 C ATOM 1152 CG1 VAL A 528 8.260 13.667 17.073 1.00 17.51 C ATOM 1153 CG2 VAL A 528 9.689 13.159 15.119 1.00 18.81 C ATOM 0 H VAL A 528 9.124 9.872 16.006 1.00 16.33 H new ATOM 0 HA VAL A 528 10.415 11.894 17.292 1.00 17.45 H new ATOM 0 HB VAL A 528 8.039 12.117 15.752 1.00 19.25 H new ATOM 0 HG11 VAL A 528 7.778 14.315 16.536 1.00 17.51 H new ATOM 0 HG12 VAL A 528 7.662 13.289 17.737 1.00 17.51 H new ATOM 0 HG13 VAL A 528 9.002 14.105 17.519 1.00 17.51 H new ATOM 0 HG21 VAL A 528 9.193 13.815 14.605 1.00 18.81 H new ATOM 0 HG22 VAL A 528 10.448 13.588 15.544 1.00 18.81 H new ATOM 0 HG23 VAL A 528 10.004 12.457 14.529 1.00 18.81 H new ATOM 1154 N ASP A 529 9.103 11.580 19.423 1.00 17.19 N ATOM 1155 CA ASP A 529 8.365 11.268 20.654 1.00 18.26 C ATOM 1156 C ASP A 529 7.168 12.212 20.753 1.00 16.92 C ATOM 1157 O ASP A 529 7.323 13.415 20.948 1.00 16.47 O ATOM 1158 CB ASP A 529 9.281 11.427 21.878 1.00 17.88 C ATOM 1159 CG ASP A 529 8.591 11.060 23.191 1.00 20.09 C ATOM 1160 OD1 ASP A 529 7.402 10.666 23.181 1.00 16.76 O ATOM 1161 OD2 ASP A 529 9.254 11.170 24.246 1.00 19.34 O ATOM 0 H ASP A 529 9.784 12.092 19.538 1.00 17.19 H new ATOM 0 HA ASP A 529 8.055 10.349 20.631 1.00 18.26 H new ATOM 0 HB2 ASP A 529 10.066 10.868 21.763 1.00 17.88 H new ATOM 0 HB3 ASP A 529 9.591 12.345 21.927 1.00 17.88 H new ATOM 1162 N LEU A 530 5.969 11.667 20.610 1.00 18.09 N ATOM 1163 CA LEU A 530 4.773 12.499 20.658 1.00 22.09 C ATOM 1164 C LEU A 530 4.332 12.852 22.073 1.00 23.80 C ATOM 1165 O LEU A 530 3.593 13.816 22.271 1.00 25.59 O ATOM 1166 CB LEU A 530 3.629 11.811 19.909 1.00 18.98 C ATOM 1167 CG LEU A 530 3.815 11.711 18.392 1.00 19.92 C ATOM 1168 CD1 LEU A 530 2.592 11.045 17.779 1.00 15.35 C ATOM 1169 CD2 LEU A 530 4.041 13.096 17.794 1.00 16.09 C ATOM 0 H LEU A 530 5.825 10.828 20.486 1.00 18.09 H new ATOM 0 HA LEU A 530 5.003 13.337 20.226 1.00 22.09 H new ATOM 0 HB2 LEU A 530 3.518 10.916 20.267 1.00 18.98 H new ATOM 0 HB3 LEU A 530 2.807 12.293 20.089 1.00 18.98 H new ATOM 0 HG LEU A 530 4.597 11.172 18.195 1.00 19.92 H new ATOM 0 HD11 LEU A 530 2.706 10.980 16.818 1.00 15.35 H new ATOM 0 HD12 LEU A 530 2.486 10.156 18.152 1.00 15.35 H new ATOM 0 HD13 LEU A 530 1.803 11.574 17.975 1.00 15.35 H new ATOM 0 HD21 LEU A 530 4.157 13.019 16.834 1.00 16.09 H new ATOM 0 HD22 LEU A 530 3.274 13.659 17.982 1.00 16.09 H new ATOM 0 HD23 LEU A 530 4.836 13.492 18.185 1.00 16.09 H new ATOM 1170 N LEU A 531 4.782 12.077 23.055 1.00 25.34 N ATOM 1171 CA LEU A 531 4.424 12.334 24.445 1.00 25.96 C ATOM 1172 C LEU A 531 5.345 13.379 25.076 1.00 29.79 C ATOM 1173 O LEU A 531 5.945 13.143 26.128 1.00 32.38 O ATOM 1174 CB LEU A 531 4.490 11.040 25.246 1.00 24.46 C ATOM 1175 CG LEU A 531 3.358 10.062 24.961 1.00 24.61 C ATOM 1176 CD1 LEU A 531 3.511 8.851 25.855 1.00 23.40 C ATOM 1177 CD2 LEU A 531 2.019 10.746 25.194 1.00 27.67 C ATOM 0 H LEU A 531 5.296 11.397 22.937 1.00 25.34 H new ATOM 0 HA LEU A 531 3.519 12.682 24.460 1.00 25.96 H new ATOM 0 HB2 LEU A 531 5.335 10.601 25.061 1.00 24.46 H new ATOM 0 HB3 LEU A 531 4.484 11.257 26.191 1.00 24.46 H new ATOM 0 HG LEU A 531 3.393 9.773 24.036 1.00 24.61 H new ATOM 0 HD11 LEU A 531 2.792 8.225 25.677 1.00 23.40 H new ATOM 0 HD12 LEU A 531 4.363 8.423 25.678 1.00 23.40 H new ATOM 0 HD13 LEU A 531 3.476 9.128 26.784 1.00 23.40 H new ATOM 0 HD21 LEU A 531 1.300 10.121 25.012 1.00 27.67 H new ATOM 0 HD22 LEU A 531 1.963 11.043 26.116 1.00 27.67 H new ATOM 0 HD23 LEU A 531 1.939 11.511 24.603 1.00 27.67 H new ATOM 1178 N LYS A 546 18.013 12.301 20.274 1.00 28.68 N ATOM 1179 CA LYS A 546 18.386 11.146 19.467 1.00 28.79 C ATOM 1180 C LYS A 546 17.563 9.939 19.877 1.00 24.61 C ATOM 1181 O LYS A 546 17.537 9.570 21.045 1.00 24.01 O ATOM 1182 CB LYS A 546 19.874 10.827 19.641 1.00 33.62 C ATOM 1183 CG LYS A 546 20.397 9.789 18.659 1.00 39.86 C ATOM 1184 CD LYS A 546 21.561 10.332 17.833 1.00 46.02 C ATOM 1185 CE LYS A 546 22.907 9.792 18.323 1.00 47.36 C ATOM 1186 NZ LYS A 546 24.067 10.496 17.692 1.00 49.19 N ATOM 0 HA LYS A 546 18.214 11.356 18.536 1.00 28.79 H new ATOM 0 HB2 LYS A 546 20.386 11.644 19.538 1.00 33.62 H new ATOM 0 HB3 LYS A 546 20.025 10.510 20.545 1.00 33.62 H new ATOM 0 HG2 LYS A 546 20.684 9.000 19.144 1.00 39.86 H new ATOM 0 HG3 LYS A 546 19.680 9.513 18.067 1.00 39.86 H new ATOM 0 HD2 LYS A 546 21.436 10.092 16.901 1.00 46.02 H new ATOM 0 HD3 LYS A 546 21.565 11.301 17.878 1.00 46.02 H new ATOM 0 HE2 LYS A 546 22.959 9.887 19.287 1.00 47.36 H new ATOM 0 HE3 LYS A 546 22.963 8.843 18.128 1.00 47.36 H new ATOM 0 HZ1 LYS A 546 24.827 10.153 18.003 1.00 49.19 H new ATOM 0 HZ2 LYS A 546 24.034 10.391 16.809 1.00 49.19 H new ATOM 0 HZ3 LYS A 546 24.031 11.363 17.889 1.00 49.19 H new ATOM 1187 N HIS A 547 16.895 9.324 18.908 1.00 21.89 N ATOM 1188 CA HIS A 547 16.071 8.159 19.177 1.00 19.80 C ATOM 1189 C HIS A 547 16.571 6.935 18.423 1.00 20.01 C ATOM 1190 O HIS A 547 16.431 6.845 17.210 1.00 23.32 O ATOM 1191 CB HIS A 547 14.618 8.466 18.805 1.00 17.00 C ATOM 1192 CG HIS A 547 14.022 9.568 19.620 1.00 14.80 C ATOM 1193 ND1 HIS A 547 13.950 9.517 20.995 1.00 14.93 N ATOM 1194 CD2 HIS A 547 13.511 10.769 19.261 1.00 14.37 C ATOM 1195 CE1 HIS A 547 13.421 10.638 21.449 1.00 12.38 C ATOM 1196 NE2 HIS A 547 13.145 11.415 20.418 1.00 14.77 N ATOM 0 H HIS A 547 16.908 9.569 18.084 1.00 21.89 H new ATOM 0 HA HIS A 547 16.125 7.955 20.124 1.00 19.80 H new ATOM 0 HB2 HIS A 547 14.574 8.706 17.866 1.00 17.00 H new ATOM 0 HB3 HIS A 547 14.085 7.664 18.918 1.00 17.00 H new ATOM 0 HD1 HIS A 547 14.209 8.857 21.482 1.00 14.93 H new ATOM 0 HD2 HIS A 547 13.424 11.096 18.395 1.00 14.37 H new ATOM 0 HE1 HIS A 547 13.269 10.845 22.343 1.00 12.38 H new ATOM 1197 N GLU A 548 17.163 5.992 19.146 1.00 16.53 N ATOM 1198 CA GLU A 548 17.686 4.790 18.520 1.00 15.42 C ATOM 1199 C GLU A 548 16.909 3.574 18.954 1.00 13.71 C ATOM 1200 O GLU A 548 16.518 3.444 20.114 1.00 15.79 O ATOM 1201 CB GLU A 548 19.175 4.598 18.864 1.00 16.98 C ATOM 1202 CG GLU A 548 20.116 5.534 18.103 1.00 18.50 C ATOM 1203 CD GLU A 548 21.579 5.386 18.515 1.00 21.11 C ATOM 1204 OE1 GLU A 548 22.328 6.382 18.416 1.00 22.77 O ATOM 1205 OE2 GLU A 548 21.977 4.280 18.935 1.00 19.61 O ATOM 0 H GLU A 548 17.271 6.030 19.998 1.00 16.53 H new ATOM 0 HA GLU A 548 17.593 4.896 17.560 1.00 15.42 H new ATOM 0 HB2 GLU A 548 19.298 4.736 19.816 1.00 16.98 H new ATOM 0 HB3 GLU A 548 19.425 3.680 18.676 1.00 16.98 H new ATOM 0 HG2 GLU A 548 20.035 5.360 17.152 1.00 18.50 H new ATOM 0 HG3 GLU A 548 19.837 6.451 18.249 1.00 18.50 H new ATOM 1206 N ILE A 549 16.689 2.680 18.008 1.00 11.95 N ATOM 1207 CA ILE A 549 15.970 1.453 18.271 1.00 12.99 C ATOM 1208 C ILE A 549 16.936 0.417 18.841 1.00 16.12 C ATOM 1209 O ILE A 549 17.945 0.094 18.218 1.00 16.22 O ATOM 1210 CB ILE A 549 15.340 0.907 16.967 1.00 13.27 C ATOM 1211 CG1 ILE A 549 14.270 1.882 16.471 1.00 11.83 C ATOM 1212 CG2 ILE A 549 14.762 -0.476 17.191 1.00 11.24 C ATOM 1213 CD1 ILE A 549 13.699 1.511 15.104 1.00 16.97 C ATOM 0 H ILE A 549 16.953 2.768 17.194 1.00 11.95 H new ATOM 0 HA ILE A 549 15.262 1.632 18.909 1.00 12.99 H new ATOM 0 HB ILE A 549 16.027 0.828 16.287 1.00 13.27 H new ATOM 0 HG12 ILE A 549 13.548 1.916 17.118 1.00 11.83 H new ATOM 0 HG13 ILE A 549 14.650 2.773 16.424 1.00 11.83 H new ATOM 0 HG21 ILE A 549 14.372 -0.802 16.365 1.00 11.24 H new ATOM 0 HG22 ILE A 549 15.466 -1.079 17.476 1.00 11.24 H new ATOM 0 HG23 ILE A 549 14.077 -0.434 17.876 1.00 11.24 H new ATOM 0 HD11 ILE A 549 13.029 2.163 14.845 1.00 16.97 H new ATOM 0 HD12 ILE A 549 14.412 1.502 14.447 1.00 16.97 H new ATOM 0 HD13 ILE A 549 13.292 0.632 15.151 1.00 16.97 H new ATOM 1214 N ARG A 550 16.619 -0.090 20.030 1.00 15.15 N ATOM 1215 CA ARG A 550 17.429 -1.097 20.702 1.00 14.03 C ATOM 1216 C ARG A 550 16.696 -2.430 20.765 1.00 12.84 C ATOM 1217 O ARG A 550 15.744 -2.576 21.532 1.00 13.19 O ATOM 1218 CB ARG A 550 17.739 -0.664 22.139 1.00 15.32 C ATOM 1219 CG ARG A 550 18.549 0.599 22.279 1.00 16.66 C ATOM 1220 CD ARG A 550 19.941 0.284 22.830 1.00 19.57 C ATOM 1221 NE ARG A 550 20.675 1.511 23.120 1.00 16.95 N ATOM 1222 CZ ARG A 550 21.213 2.294 22.193 1.00 16.19 C ATOM 1223 NH1 ARG A 550 21.108 1.984 20.903 1.00 17.48 N ATOM 1224 NH2 ARG A 550 21.826 3.408 22.554 1.00 16.77 N ATOM 0 H ARG A 550 15.920 0.145 20.472 1.00 15.15 H new ATOM 0 HA ARG A 550 18.249 -1.194 20.193 1.00 14.03 H new ATOM 0 HB2 ARG A 550 16.900 -0.545 22.612 1.00 15.32 H new ATOM 0 HB3 ARG A 550 18.214 -1.385 22.581 1.00 15.32 H new ATOM 0 HG2 ARG A 550 18.628 1.036 21.417 1.00 16.66 H new ATOM 0 HG3 ARG A 550 18.093 1.218 22.871 1.00 16.66 H new ATOM 0 HD2 ARG A 550 19.861 -0.248 23.637 1.00 19.57 H new ATOM 0 HD3 ARG A 550 20.435 -0.249 22.187 1.00 19.57 H new ATOM 0 HE ARG A 550 20.765 1.742 23.944 1.00 16.95 H new ATOM 0 HH11 ARG A 550 20.689 1.272 20.665 1.00 17.48 H new ATOM 0 HH12 ARG A 550 21.459 2.496 20.308 1.00 17.48 H new ATOM 0 HH21 ARG A 550 21.875 3.622 23.386 1.00 16.77 H new ATOM 0 HH22 ARG A 550 22.176 3.919 21.957 1.00 16.77 H new ATOM 1225 N HIS A 551 17.129 -3.395 19.964 1.00 10.89 N ATOM 1226 CA HIS A 551 16.538 -4.725 19.964 1.00 12.34 C ATOM 1227 C HIS A 551 17.323 -5.610 20.923 1.00 18.92 C ATOM 1228 O HIS A 551 18.556 -5.691 20.843 1.00 16.63 O ATOM 1229 CB HIS A 551 16.592 -5.347 18.571 1.00 12.52 C ATOM 1230 CG HIS A 551 15.622 -4.749 17.609 1.00 16.82 C ATOM 1231 ND1 HIS A 551 14.323 -4.443 17.957 1.00 14.24 N ATOM 1232 CD2 HIS A 551 15.759 -4.396 16.311 1.00 14.01 C ATOM 1233 CE1 HIS A 551 13.702 -3.927 16.912 1.00 14.97 C ATOM 1234 NE2 HIS A 551 14.551 -3.888 15.901 1.00 15.78 N ATOM 0 H HIS A 551 17.775 -3.297 19.405 1.00 10.89 H new ATOM 0 HA HIS A 551 15.610 -4.653 20.238 1.00 12.34 H new ATOM 0 HB2 HIS A 551 17.489 -5.249 18.216 1.00 12.52 H new ATOM 0 HB3 HIS A 551 16.418 -6.299 18.644 1.00 12.52 H new ATOM 0 HD2 HIS A 551 16.527 -4.481 15.793 1.00 14.01 H new ATOM 0 HE1 HIS A 551 12.818 -3.640 16.891 1.00 14.97 H new ATOM 0 HE2 HIS A 551 14.375 -3.592 15.113 1.00 15.78 H new ATOM 1235 N ASP A 552 16.610 -6.269 21.829 1.00 21.12 N ATOM 1236 CA ASP A 552 17.242 -7.157 22.801 1.00 26.47 C ATOM 1237 C ASP A 552 17.021 -8.605 22.386 1.00 27.39 C ATOM 1238 O ASP A 552 15.981 -9.196 22.676 1.00 26.57 O ATOM 1239 CB ASP A 552 16.660 -6.923 24.199 1.00 27.46 C ATOM 1240 CG ASP A 552 17.379 -7.719 25.276 1.00 29.78 C ATOM 1241 OD1 ASP A 552 17.485 -7.207 26.406 1.00 31.59 O ATOM 1242 OD2 ASP A 552 17.835 -8.848 25.000 1.00 29.86 O ATOM 0 H ASP A 552 15.754 -6.216 21.899 1.00 21.12 H new ATOM 0 HA ASP A 552 18.193 -6.968 22.827 1.00 26.47 H new ATOM 0 HB2 ASP A 552 16.711 -5.978 24.412 1.00 27.46 H new ATOM 0 HB3 ASP A 552 15.720 -7.163 24.198 1.00 27.46 H new ATOM 1243 N GLN A 553 18.012 -9.167 21.707 1.00 28.72 N ATOM 1244 CA GLN A 553 17.941 -10.539 21.237 1.00 32.96 C ATOM 1245 C GLN A 553 17.663 -11.521 22.366 1.00 33.93 C ATOM 1246 O GLN A 553 17.112 -12.596 22.135 1.00 35.67 O ATOM 1247 CB GLN A 553 19.248 -10.913 20.535 1.00 36.98 C ATOM 1248 CG GLN A 553 19.195 -10.786 19.021 1.00 41.11 C ATOM 1249 CD GLN A 553 19.742 -9.458 18.527 1.00 43.79 C ATOM 1250 OE1 GLN A 553 20.882 -9.375 18.063 1.00 45.58 O ATOM 1251 NE2 GLN A 553 18.929 -8.411 18.623 1.00 43.81 N ATOM 0 H GLN A 553 18.744 -8.762 21.507 1.00 28.72 H new ATOM 0 HA GLN A 553 17.200 -10.596 20.613 1.00 32.96 H new ATOM 0 HB2 GLN A 553 19.959 -10.347 20.873 1.00 36.98 H new ATOM 0 HB3 GLN A 553 19.478 -11.827 20.766 1.00 36.98 H new ATOM 0 HG2 GLN A 553 19.702 -11.510 18.621 1.00 41.11 H new ATOM 0 HG3 GLN A 553 18.277 -10.885 18.723 1.00 41.11 H new ATOM 0 HE21 GLN A 553 18.140 -8.508 18.952 1.00 43.81 H new ATOM 0 HE22 GLN A 553 19.191 -7.637 18.356 1.00 43.81 H new ATOM 1252 N GLU A 554 18.038 -11.149 23.585 1.00 34.23 N ATOM 1253 CA GLU A 554 17.827 -12.013 24.739 1.00 35.40 C ATOM 1254 C GLU A 554 16.348 -12.124 25.094 1.00 34.03 C ATOM 1255 O GLU A 554 15.776 -13.210 25.064 1.00 35.12 O ATOM 1256 CB GLU A 554 18.608 -11.484 25.945 1.00 38.94 C ATOM 1257 CG GLU A 554 18.359 -12.241 27.244 1.00 45.10 C ATOM 1258 CD GLU A 554 19.462 -13.239 27.559 1.00 49.64 C ATOM 1259 OE1 GLU A 554 19.317 -14.431 27.204 1.00 53.16 O ATOM 1260 OE2 GLU A 554 20.477 -12.831 28.163 1.00 52.38 O ATOM 0 H GLU A 554 18.417 -10.398 23.765 1.00 34.23 H new ATOM 0 HA GLU A 554 18.149 -12.898 24.506 1.00 35.40 H new ATOM 0 HB2 GLU A 554 19.556 -11.518 25.742 1.00 38.94 H new ATOM 0 HB3 GLU A 554 18.380 -10.551 26.079 1.00 38.94 H new ATOM 0 HG2 GLU A 554 18.283 -11.607 27.974 1.00 45.10 H new ATOM 0 HG3 GLU A 554 17.511 -12.709 27.185 1.00 45.10 H new ATOM 1261 N THR A 555 15.730 -10.996 25.422 1.00 32.17 N ATOM 1262 CA THR A 555 14.322 -10.977 25.795 1.00 28.74 C ATOM 1263 C THR A 555 13.415 -10.869 24.578 1.00 28.31 C ATOM 1264 O THR A 555 12.195 -10.992 24.686 1.00 28.04 O ATOM 1265 CB THR A 555 14.016 -9.783 26.697 1.00 27.41 C ATOM 1266 OG1 THR A 555 14.384 -8.579 26.018 1.00 24.41 O ATOM 1267 CG2 THR A 555 14.785 -9.882 28.005 1.00 27.51 C ATOM 0 H THR A 555 16.112 -10.225 25.435 1.00 32.17 H new ATOM 0 HA THR A 555 14.153 -11.812 26.258 1.00 28.74 H new ATOM 0 HB THR A 555 13.067 -9.778 26.899 1.00 27.41 H new ATOM 0 HG1 THR A 555 13.705 -8.095 25.918 1.00 24.41 H new ATOM 0 HG21 THR A 555 14.577 -9.116 28.562 1.00 27.51 H new ATOM 0 HG22 THR A 555 14.532 -10.696 28.468 1.00 27.51 H new ATOM 0 HG23 THR A 555 15.737 -9.898 27.820 1.00 27.51 H new ATOM 1268 N LYS A 556 14.021 -10.647 23.421 1.00 25.73 N ATOM 1269 CA LYS A 556 13.273 -10.487 22.187 1.00 22.83 C ATOM 1270 C LYS A 556 12.296 -9.336 22.359 1.00 22.84 C ATOM 1271 O LYS A 556 11.123 -9.426 21.977 1.00 22.09 O ATOM 1272 CB LYS A 556 12.538 -11.774 21.832 1.00 23.01 C ATOM 1273 CG LYS A 556 13.343 -12.684 20.922 1.00 25.35 C ATOM 1274 CD LYS A 556 12.443 -13.620 20.156 1.00 29.14 C ATOM 1275 CE LYS A 556 13.241 -14.518 19.244 1.00 31.66 C ATOM 1276 NZ LYS A 556 13.048 -15.955 19.594 1.00 35.94 N ATOM 0 H LYS A 556 14.874 -10.585 23.330 1.00 25.73 H new ATOM 0 HA LYS A 556 13.882 -10.290 21.458 1.00 22.83 H new ATOM 0 HB2 LYS A 556 12.320 -12.251 22.648 1.00 23.01 H new ATOM 0 HB3 LYS A 556 11.699 -11.553 21.399 1.00 23.01 H new ATOM 0 HG2 LYS A 556 13.861 -12.149 20.301 1.00 25.35 H new ATOM 0 HG3 LYS A 556 13.974 -13.197 21.450 1.00 25.35 H new ATOM 0 HD2 LYS A 556 11.929 -14.160 20.777 1.00 29.14 H new ATOM 0 HD3 LYS A 556 11.807 -13.106 19.633 1.00 29.14 H new ATOM 0 HE2 LYS A 556 12.973 -14.368 18.324 1.00 31.66 H new ATOM 0 HE3 LYS A 556 14.182 -14.291 19.306 1.00 31.66 H new ATOM 0 HZ1 LYS A 556 13.528 -16.462 19.042 1.00 35.94 H new ATOM 0 HZ2 LYS A 556 13.313 -16.095 20.432 1.00 35.94 H new ATOM 0 HZ3 LYS A 556 12.187 -16.167 19.517 1.00 35.94 H new ATOM 1277 N THR A 557 12.785 -8.260 22.972 1.00 19.76 N ATOM 1278 CA THR A 557 11.995 -7.061 23.172 1.00 17.44 C ATOM 1279 C THR A 557 12.735 -5.903 22.534 1.00 16.19 C ATOM 1280 O THR A 557 13.926 -5.995 22.244 1.00 15.51 O ATOM 1281 CB THR A 557 11.747 -6.757 24.652 1.00 18.85 C ATOM 1282 OG1 THR A 557 12.995 -6.523 25.322 1.00 18.26 O ATOM 1283 CG2 THR A 557 11.012 -7.913 25.297 1.00 16.81 C ATOM 0 H THR A 557 13.586 -8.210 23.282 1.00 19.76 H new ATOM 0 HA THR A 557 11.125 -7.197 22.765 1.00 17.44 H new ATOM 0 HB THR A 557 11.201 -5.958 24.726 1.00 18.85 H new ATOM 0 HG1 THR A 557 12.851 -6.356 26.133 1.00 18.26 H new ATOM 0 HG21 THR A 557 10.857 -7.716 26.234 1.00 16.81 H new ATOM 0 HG22 THR A 557 10.161 -8.046 24.850 1.00 16.81 H new ATOM 0 HG23 THR A 557 11.546 -8.719 25.221 1.00 16.81 H new ATOM 1284 N THR A 558 12.017 -4.810 22.322 1.00 14.95 N ATOM 1285 CA THR A 558 12.559 -3.633 21.671 1.00 13.97 C ATOM 1286 C THR A 558 12.285 -2.356 22.455 1.00 16.71 C ATOM 1287 O THR A 558 11.197 -2.162 23.001 1.00 20.56 O ATOM 1288 CB THR A 558 11.945 -3.491 20.265 1.00 9.59 C ATOM 1289 OG1 THR A 558 12.133 -4.710 19.543 1.00 10.37 O ATOM 1290 CG2 THR A 558 12.564 -2.324 19.526 1.00 12.80 C ATOM 0 H THR A 558 11.193 -4.732 22.555 1.00 14.95 H new ATOM 0 HA THR A 558 13.520 -3.753 21.619 1.00 13.97 H new ATOM 0 HB THR A 558 10.995 -3.315 20.347 1.00 9.59 H new ATOM 0 HG1 THR A 558 12.871 -4.688 19.143 1.00 10.37 H new ATOM 0 HG21 THR A 558 12.166 -2.251 18.645 1.00 12.80 H new ATOM 0 HG22 THR A 558 12.404 -1.506 20.022 1.00 12.80 H new ATOM 0 HG23 THR A 558 13.519 -2.467 19.438 1.00 12.80 H new ATOM 1291 N THR A 559 13.275 -1.473 22.472 1.00 15.85 N ATOM 1292 CA THR A 559 13.198 -0.208 23.184 1.00 16.86 C ATOM 1293 C THR A 559 13.647 0.894 22.226 1.00 15.17 C ATOM 1294 O THR A 559 14.289 0.604 21.218 1.00 15.47 O ATOM 1295 CB THR A 559 14.153 -0.249 24.420 1.00 18.55 C ATOM 1296 OG1 THR A 559 13.465 -0.830 25.535 1.00 23.58 O ATOM 1297 CG2 THR A 559 14.646 1.139 24.785 1.00 23.42 C ATOM 0 H THR A 559 14.022 -1.595 22.063 1.00 15.85 H new ATOM 0 HA THR A 559 12.293 -0.043 23.492 1.00 16.86 H new ATOM 0 HB THR A 559 14.926 -0.789 24.191 1.00 18.55 H new ATOM 0 HG1 THR A 559 13.988 -1.337 25.954 1.00 23.58 H new ATOM 0 HG21 THR A 559 15.235 1.082 25.554 1.00 23.42 H new ATOM 0 HG22 THR A 559 15.130 1.518 24.035 1.00 23.42 H new ATOM 0 HG23 THR A 559 13.889 1.705 25.000 1.00 23.42 H new ATOM 1298 N ILE A 560 13.297 2.143 22.522 1.00 13.33 N ATOM 1299 CA ILE A 560 13.718 3.275 21.702 1.00 15.12 C ATOM 1300 C ILE A 560 14.326 4.267 22.680 1.00 17.62 C ATOM 1301 O ILE A 560 13.653 4.719 23.606 1.00 18.79 O ATOM 1302 CB ILE A 560 12.546 3.978 20.991 1.00 14.73 C ATOM 1303 CG1 ILE A 560 11.866 3.033 20.005 1.00 17.96 C ATOM 1304 CG2 ILE A 560 13.060 5.177 20.235 1.00 13.84 C ATOM 1305 CD1 ILE A 560 10.575 3.599 19.442 1.00 16.79 C ATOM 0 H ILE A 560 12.812 2.357 23.199 1.00 13.33 H new ATOM 0 HA ILE A 560 14.322 2.964 21.010 1.00 15.12 H new ATOM 0 HB ILE A 560 11.903 4.253 21.663 1.00 14.73 H new ATOM 0 HG12 ILE A 560 12.475 2.841 19.275 1.00 17.96 H new ATOM 0 HG13 ILE A 560 11.679 2.190 20.448 1.00 17.96 H new ATOM 0 HG21 ILE A 560 12.321 5.619 19.788 1.00 13.84 H new ATOM 0 HG22 ILE A 560 13.479 5.795 20.854 1.00 13.84 H new ATOM 0 HG23 ILE A 560 13.711 4.890 19.576 1.00 13.84 H new ATOM 0 HD11 ILE A 560 10.185 2.962 18.823 1.00 16.79 H new ATOM 0 HD12 ILE A 560 9.953 3.769 20.166 1.00 16.79 H new ATOM 0 HD13 ILE A 560 10.761 4.429 18.976 1.00 16.79 H new ATOM 1306 N THR A 561 15.595 4.609 22.484 1.00 18.53 N ATOM 1307 CA THR A 561 16.271 5.534 23.384 1.00 16.78 C ATOM 1308 C THR A 561 15.677 6.941 23.396 1.00 17.83 C ATOM 1309 O THR A 561 15.231 7.458 22.366 1.00 19.07 O ATOM 1310 CB THR A 561 17.767 5.644 23.037 1.00 15.68 C ATOM 1311 OG1 THR A 561 17.923 6.520 21.920 1.00 16.23 O ATOM 1312 CG2 THR A 561 18.336 4.284 22.674 1.00 16.72 C ATOM 0 H THR A 561 16.081 4.317 21.837 1.00 18.53 H new ATOM 0 HA THR A 561 16.145 5.155 24.268 1.00 16.78 H new ATOM 0 HB THR A 561 18.241 5.988 23.810 1.00 15.68 H new ATOM 0 HG1 THR A 561 18.738 6.585 21.727 1.00 16.23 H new ATOM 0 HG21 THR A 561 19.278 4.374 22.459 1.00 16.72 H new ATOM 0 HG22 THR A 561 18.233 3.679 23.425 1.00 16.72 H new ATOM 0 HG23 THR A 561 17.862 3.929 21.906 1.00 16.72 H new ATOM 1313 N ASN A 562 15.675 7.538 24.587 1.00 17.13 N ATOM 1314 CA ASN A 562 15.181 8.891 24.834 1.00 18.03 C ATOM 1315 C ASN A 562 13.702 9.172 24.555 1.00 15.24 C ATOM 1316 O ASN A 562 13.307 10.323 24.372 1.00 16.44 O ATOM 1317 CB ASN A 562 16.051 9.885 24.078 1.00 18.07 C ATOM 1318 CG ASN A 562 17.505 9.813 24.506 1.00 21.45 C ATOM 1319 OD1 ASN A 562 17.810 9.512 25.662 1.00 20.39 O ATOM 1320 ND2 ASN A 562 18.408 10.082 23.576 1.00 24.00 N ATOM 0 H ASN A 562 15.971 7.153 25.297 1.00 17.13 H new ATOM 0 HA ASN A 562 15.245 8.992 25.797 1.00 18.03 H new ATOM 0 HB2 ASN A 562 15.986 9.711 23.126 1.00 18.07 H new ATOM 0 HB3 ASN A 562 15.716 10.783 24.225 1.00 18.07 H new ATOM 0 HD21 ASN A 562 19.246 10.050 23.768 1.00 24.00 H new ATOM 0 HD22 ASN A 562 18.157 10.288 22.780 1.00 24.00 H new ATOM 1321 N VAL A 563 12.892 8.123 24.555 1.00 15.64 N ATOM 1322 CA VAL A 563 11.462 8.260 24.306 1.00 14.36 C ATOM 1323 C VAL A 563 10.725 8.197 25.631 1.00 16.04 C ATOM 1324 O VAL A 563 10.964 7.297 26.434 1.00 16.56 O ATOM 1325 CB VAL A 563 10.944 7.125 23.396 1.00 14.63 C ATOM 1326 CG1 VAL A 563 9.414 7.104 23.394 1.00 14.50 C ATOM 1327 CG2 VAL A 563 11.466 7.318 21.983 1.00 15.09 C ATOM 0 H VAL A 563 13.152 7.316 24.698 1.00 15.64 H new ATOM 0 HA VAL A 563 11.306 9.109 23.863 1.00 14.36 H new ATOM 0 HB VAL A 563 11.265 6.276 23.739 1.00 14.63 H new ATOM 0 HG11 VAL A 563 9.101 6.388 22.820 1.00 14.50 H new ATOM 0 HG12 VAL A 563 9.091 6.958 24.297 1.00 14.50 H new ATOM 0 HG13 VAL A 563 9.079 7.952 23.064 1.00 14.50 H new ATOM 0 HG21 VAL A 563 11.138 6.603 21.416 1.00 15.09 H new ATOM 0 HG22 VAL A 563 11.158 8.171 21.638 1.00 15.09 H new ATOM 0 HG23 VAL A 563 12.436 7.304 21.991 1.00 15.09 H new ATOM 1328 N THR A 564 9.829 9.155 25.847 1.00 16.02 N ATOM 1329 CA THR A 564 9.036 9.219 27.070 1.00 15.64 C ATOM 1330 C THR A 564 8.176 7.977 27.239 1.00 17.65 C ATOM 1331 O THR A 564 7.526 7.521 26.292 1.00 17.21 O ATOM 1332 CB THR A 564 8.077 10.423 27.070 1.00 13.84 C ATOM 1333 OG1 THR A 564 8.802 11.623 26.801 1.00 16.81 O ATOM 1334 CG2 THR A 564 7.378 10.547 28.418 1.00 14.29 C ATOM 0 H THR A 564 9.664 9.787 25.288 1.00 16.02 H new ATOM 0 HA THR A 564 9.678 9.297 27.793 1.00 15.64 H new ATOM 0 HB THR A 564 7.410 10.284 26.379 1.00 13.84 H new ATOM 0 HG1 THR A 564 9.020 11.643 25.990 1.00 16.81 H new ATOM 0 HG21 THR A 564 6.778 11.309 28.403 1.00 14.29 H new ATOM 0 HG22 THR A 564 6.870 9.740 28.595 1.00 14.29 H new ATOM 0 HG23 THR A 564 8.040 10.671 29.116 1.00 14.29 H new ATOM 1335 N SER A 565 8.187 7.425 28.446 1.00 16.73 N ATOM 1336 CA SER A 565 7.362 6.271 28.762 1.00 18.51 C ATOM 1337 C SER A 565 6.557 6.656 29.990 1.00 19.52 C ATOM 1338 O SER A 565 7.097 7.230 30.933 1.00 20.80 O ATOM 1339 CB SER A 565 8.206 5.033 29.053 1.00 18.06 C ATOM 1340 OG SER A 565 7.373 3.883 29.089 1.00 19.01 O ATOM 0 H SER A 565 8.670 7.707 29.099 1.00 16.73 H new ATOM 0 HA SER A 565 6.794 6.043 28.009 1.00 18.51 H new ATOM 0 HB2 SER A 565 8.888 4.928 28.371 1.00 18.06 H new ATOM 0 HB3 SER A 565 8.666 5.136 29.901 1.00 18.06 H new ATOM 0 HG SER A 565 7.290 3.572 28.313 1.00 19.01 H new ATOM 1341 N CYS A 566 5.262 6.361 29.972 1.00 20.93 N ATOM 1342 CA CYS A 566 4.388 6.706 31.086 1.00 19.79 C ATOM 1343 C CYS A 566 3.693 5.500 31.668 1.00 17.74 C ATOM 1344 O CYS A 566 3.237 4.627 30.940 1.00 16.61 O ATOM 1345 CB CYS A 566 3.327 7.709 30.634 1.00 21.68 C ATOM 1346 SG CYS A 566 3.989 9.155 29.794 1.00 27.89 S ATOM 0 H CYS A 566 4.869 5.960 29.321 1.00 20.93 H new ATOM 0 HA CYS A 566 4.953 7.093 31.773 1.00 19.79 H new ATOM 0 HB2 CYS A 566 2.704 7.260 30.041 1.00 21.68 H new ATOM 0 HB3 CYS A 566 2.821 8.001 31.409 1.00 21.68 H new ATOM 0 HG CYS A 566 3.088 9.881 29.476 1.00 27.89 H new ATOM 1347 N LYS A 567 3.623 5.455 32.993 1.00 16.34 N ATOM 1348 CA LYS A 567 2.952 4.368 33.676 1.00 15.70 C ATOM 1349 C LYS A 567 1.460 4.607 33.481 1.00 14.66 C ATOM 1350 O LYS A 567 1.014 5.752 33.385 1.00 13.40 O ATOM 1351 CB LYS A 567 3.253 4.391 35.181 1.00 15.99 C ATOM 1352 CG LYS A 567 4.513 3.644 35.600 1.00 16.95 C ATOM 1353 CD LYS A 567 4.750 3.771 37.090 1.00 18.08 C ATOM 1354 CE LYS A 567 6.134 3.273 37.462 1.00 18.32 C ATOM 1355 NZ LYS A 567 6.205 2.866 38.892 1.00 14.88 N ATOM 0 H LYS A 567 3.961 6.050 33.514 1.00 16.34 H new ATOM 0 HA LYS A 567 3.248 3.514 33.323 1.00 15.70 H new ATOM 0 HB2 LYS A 567 3.331 5.315 35.467 1.00 15.99 H new ATOM 0 HB3 LYS A 567 2.496 4.011 35.654 1.00 15.99 H new ATOM 0 HG2 LYS A 567 4.432 2.707 35.361 1.00 16.95 H new ATOM 0 HG3 LYS A 567 5.277 3.995 35.117 1.00 16.95 H new ATOM 0 HD2 LYS A 567 4.652 4.698 37.359 1.00 18.08 H new ATOM 0 HD3 LYS A 567 4.079 3.263 37.573 1.00 18.08 H new ATOM 0 HE2 LYS A 567 6.370 2.519 36.898 1.00 18.32 H new ATOM 0 HE3 LYS A 567 6.786 3.970 37.291 1.00 18.32 H new ATOM 0 HZ1 LYS A 567 7.056 2.845 39.153 1.00 14.88 H new ATOM 0 HZ2 LYS A 567 5.757 3.452 39.390 1.00 14.88 H new ATOM 0 HZ3 LYS A 567 5.845 2.058 38.989 1.00 14.88 H new ATOM 1356 N LEU A 568 0.704 3.522 33.410 1.00 16.41 N ATOM 1357 CA LEU A 568 -0.737 3.609 33.271 1.00 18.64 C ATOM 1358 C LEU A 568 -1.277 2.828 34.460 1.00 20.87 C ATOM 1359 O LEU A 568 -1.487 1.618 34.379 1.00 21.70 O ATOM 1360 CB LEU A 568 -1.197 2.979 31.948 1.00 17.75 C ATOM 1361 CG LEU A 568 -0.816 3.733 30.663 1.00 16.11 C ATOM 1362 CD1 LEU A 568 -1.539 3.131 29.465 1.00 15.26 C ATOM 1363 CD2 LEU A 568 -1.152 5.205 30.813 1.00 12.72 C ATOM 0 H LEU A 568 1.011 2.719 33.441 1.00 16.41 H new ATOM 0 HA LEU A 568 -1.053 4.526 33.256 1.00 18.64 H new ATOM 0 HB2 LEU A 568 -0.831 2.082 31.895 1.00 17.75 H new ATOM 0 HB3 LEU A 568 -2.163 2.890 31.973 1.00 17.75 H new ATOM 0 HG LEU A 568 0.139 3.647 30.513 1.00 16.11 H new ATOM 0 HD11 LEU A 568 -1.291 3.614 28.661 1.00 15.26 H new ATOM 0 HD12 LEU A 568 -1.289 2.198 29.371 1.00 15.26 H new ATOM 0 HD13 LEU A 568 -2.497 3.197 29.599 1.00 15.26 H new ATOM 0 HD21 LEU A 568 -0.910 5.677 30.001 1.00 12.72 H new ATOM 0 HD22 LEU A 568 -2.103 5.305 30.974 1.00 12.72 H new ATOM 0 HD23 LEU A 568 -0.658 5.575 31.561 1.00 12.72 H new ATOM 1364 N GLU A 569 -1.461 3.525 35.577 1.00 23.66 N ATOM 1365 CA GLU A 569 -1.965 2.902 36.796 1.00 27.68 C ATOM 1366 C GLU A 569 -3.179 3.662 37.307 1.00 30.44 C ATOM 1367 O GLU A 569 -3.634 3.453 38.433 1.00 31.64 O ATOM 1368 CB GLU A 569 -0.873 2.888 37.871 1.00 27.40 C ATOM 1369 CG GLU A 569 0.254 3.865 37.609 1.00 29.16 C ATOM 1370 CD GLU A 569 1.262 3.926 38.735 1.00 27.71 C ATOM 1371 OE1 GLU A 569 1.660 2.858 39.242 1.00 24.22 O ATOM 1372 OE2 GLU A 569 1.653 5.051 39.102 1.00 30.92 O ATOM 0 H GLU A 569 -1.299 4.366 35.650 1.00 23.66 H new ATOM 0 HA GLU A 569 -2.223 1.989 36.595 1.00 27.68 H new ATOM 0 HB2 GLU A 569 -1.274 3.092 38.730 1.00 27.40 H new ATOM 0 HB3 GLU A 569 -0.505 1.993 37.935 1.00 27.40 H new ATOM 0 HG2 GLU A 569 0.708 3.614 36.789 1.00 29.16 H new ATOM 0 HG3 GLU A 569 -0.119 4.749 37.468 1.00 29.16 H new ATOM 1373 N SER A 570 -3.698 4.547 36.465 1.00 32.52 N ATOM 1374 CA SER A 570 -4.855 5.359 36.804 1.00 35.54 C ATOM 1375 C SER A 570 -5.590 5.739 35.531 1.00 38.38 C ATOM 1376 O SER A 570 -4.965 5.955 34.492 1.00 38.51 O ATOM 1377 CB SER A 570 -4.413 6.630 37.530 1.00 33.90 C ATOM 1378 OG SER A 570 -4.192 7.693 36.618 1.00 33.11 O ATOM 0 H SER A 570 -3.386 4.693 35.677 1.00 32.52 H new ATOM 0 HA SER A 570 -5.441 4.849 37.386 1.00 35.54 H new ATOM 0 HB2 SER A 570 -5.090 6.889 38.174 1.00 33.90 H new ATOM 0 HB3 SER A 570 -3.600 6.454 38.028 1.00 33.90 H new ATOM 0 HG SER A 570 -3.952 8.379 37.040 1.00 33.11 H new ATOM 1379 N GLU A 571 -6.915 5.814 35.610 1.00 41.26 N ATOM 1380 CA GLU A 571 -7.719 6.186 34.452 1.00 43.53 C ATOM 1381 C GLU A 571 -7.534 7.679 34.188 1.00 41.66 C ATOM 1382 O GLU A 571 -7.778 8.166 33.080 1.00 41.46 O ATOM 1383 CB GLU A 571 -9.200 5.853 34.692 1.00 47.92 C ATOM 1384 CG GLU A 571 -9.883 6.665 35.791 1.00 56.79 C ATOM 1385 CD GLU A 571 -11.328 6.223 36.045 1.00 62.31 C ATOM 1386 OE1 GLU A 571 -11.532 5.111 36.586 1.00 63.74 O ATOM 1387 OE2 GLU A 571 -12.261 6.988 35.705 1.00 65.33 O ATOM 0 H GLU A 571 -7.367 5.654 36.324 1.00 41.26 H new ATOM 0 HA GLU A 571 -7.429 5.681 33.676 1.00 43.53 H new ATOM 0 HB2 GLU A 571 -9.685 5.987 33.863 1.00 47.92 H new ATOM 0 HB3 GLU A 571 -9.273 4.911 34.914 1.00 47.92 H new ATOM 0 HG2 GLU A 571 -9.374 6.581 36.613 1.00 56.79 H new ATOM 0 HG3 GLU A 571 -9.875 7.604 35.547 1.00 56.79 H new ATOM 1388 N GLU A 572 -7.086 8.395 35.215 1.00 39.75 N ATOM 1389 CA GLU A 572 -6.846 9.826 35.099 1.00 38.98 C ATOM 1390 C GLU A 572 -5.643 10.054 34.199 1.00 36.96 C ATOM 1391 O GLU A 572 -5.629 10.977 33.393 1.00 35.71 O ATOM 1392 CB GLU A 572 -6.580 10.435 36.476 1.00 41.42 C ATOM 1393 CG GLU A 572 -7.830 10.678 37.300 1.00 45.38 C ATOM 1394 CD GLU A 572 -8.019 9.642 38.398 1.00 49.65 C ATOM 1395 OE1 GLU A 572 -7.503 8.510 38.257 1.00 49.69 O ATOM 1396 OE2 GLU A 572 -8.686 9.958 39.406 1.00 52.21 O ATOM 0 H GLU A 572 -6.914 8.067 35.991 1.00 39.75 H new ATOM 0 HA GLU A 572 -7.630 10.252 34.719 1.00 38.98 H new ATOM 0 HB2 GLU A 572 -5.988 9.846 36.970 1.00 41.42 H new ATOM 0 HB3 GLU A 572 -6.112 11.277 36.361 1.00 41.42 H new ATOM 0 HG2 GLU A 572 -7.784 11.561 37.698 1.00 45.38 H new ATOM 0 HG3 GLU A 572 -8.605 10.670 36.716 1.00 45.38 H new ATOM 1397 N MET A 573 -4.630 9.207 34.348 1.00 35.25 N ATOM 1398 CA MET A 573 -3.421 9.305 33.540 1.00 34.41 C ATOM 1399 C MET A 573 -3.764 8.985 32.085 1.00 31.96 C ATOM 1400 O MET A 573 -3.425 9.739 31.174 1.00 29.56 O ATOM 1401 CB MET A 573 -2.365 8.327 34.063 1.00 35.31 C ATOM 1402 CG MET A 573 -0.953 8.623 33.597 1.00 40.18 C ATOM 1403 SD MET A 573 -0.675 10.375 33.244 1.00 46.41 S ATOM 1404 CE MET A 573 -0.149 10.988 34.847 1.00 44.73 C ATOM 0 H MET A 573 -4.624 8.563 34.917 1.00 35.25 H new ATOM 0 HA MET A 573 -3.063 10.205 33.595 1.00 34.41 H new ATOM 0 HB2 MET A 573 -2.383 8.337 35.033 1.00 35.31 H new ATOM 0 HB3 MET A 573 -2.605 7.429 33.784 1.00 35.31 H new ATOM 0 HG2 MET A 573 -0.326 8.332 34.278 1.00 40.18 H new ATOM 0 HG3 MET A 573 -0.766 8.104 32.799 1.00 40.18 H new ATOM 0 HE1 MET A 573 0.034 11.939 34.786 1.00 44.73 H new ATOM 0 HE2 MET A 573 -0.851 10.836 35.498 1.00 44.73 H new ATOM 0 HE3 MET A 573 0.655 10.521 35.124 1.00 44.73 H new ATOM 1405 N VAL A 574 -4.442 7.857 31.882 1.00 31.49 N ATOM 1406 CA VAL A 574 -4.862 7.416 30.553 1.00 30.42 C ATOM 1407 C VAL A 574 -5.610 8.562 29.884 1.00 30.76 C ATOM 1408 O VAL A 574 -5.501 8.788 28.680 1.00 28.76 O ATOM 1409 CB VAL A 574 -5.820 6.200 30.649 1.00 29.66 C ATOM 1410 CG1 VAL A 574 -6.340 5.827 29.267 1.00 28.98 C ATOM 1411 CG2 VAL A 574 -5.107 5.020 31.295 1.00 24.30 C ATOM 0 H VAL A 574 -4.673 7.323 32.515 1.00 31.49 H new ATOM 0 HA VAL A 574 -4.077 7.158 30.045 1.00 30.42 H new ATOM 0 HB VAL A 574 -6.578 6.440 31.204 1.00 29.66 H new ATOM 0 HG11 VAL A 574 -6.937 5.066 29.340 1.00 28.98 H new ATOM 0 HG12 VAL A 574 -6.821 6.579 28.888 1.00 28.98 H new ATOM 0 HG13 VAL A 574 -5.594 5.597 28.691 1.00 28.98 H new ATOM 0 HG21 VAL A 574 -5.714 4.266 31.350 1.00 24.30 H new ATOM 0 HG22 VAL A 574 -4.336 4.775 30.760 1.00 24.30 H new ATOM 0 HG23 VAL A 574 -4.816 5.266 32.187 1.00 24.30 H new ATOM 1412 N GLU A 575 -6.370 9.280 30.700 1.00 32.40 N ATOM 1413 CA GLU A 575 -7.168 10.408 30.254 1.00 34.12 C ATOM 1414 C GLU A 575 -6.320 11.515 29.615 1.00 33.47 C ATOM 1415 O GLU A 575 -6.572 11.935 28.480 1.00 31.81 O ATOM 1416 CB GLU A 575 -7.953 10.962 31.449 1.00 37.19 C ATOM 1417 CG GLU A 575 -9.203 11.734 31.089 1.00 44.72 C ATOM 1418 CD GLU A 575 -9.717 12.583 32.244 1.00 50.59 C ATOM 1419 OE1 GLU A 575 -10.938 12.544 32.523 1.00 52.90 O ATOM 1420 OE2 GLU A 575 -8.897 13.290 32.874 1.00 52.83 O ATOM 0 H GLU A 575 -6.436 9.121 31.543 1.00 32.40 H new ATOM 0 HA GLU A 575 -7.775 10.093 29.566 1.00 34.12 H new ATOM 0 HB2 GLU A 575 -8.200 10.223 32.027 1.00 37.19 H new ATOM 0 HB3 GLU A 575 -7.368 11.541 31.963 1.00 37.19 H new ATOM 0 HG2 GLU A 575 -9.018 12.306 30.328 1.00 44.72 H new ATOM 0 HG3 GLU A 575 -9.896 11.113 30.815 1.00 44.72 H new ATOM 1421 N ILE A 576 -5.315 11.987 30.346 1.00 32.46 N ATOM 1422 CA ILE A 576 -4.449 13.051 29.847 1.00 31.87 C ATOM 1423 C ILE A 576 -3.700 12.621 28.596 1.00 30.03 C ATOM 1424 O ILE A 576 -3.612 13.378 27.631 1.00 32.06 O ATOM 1425 CB ILE A 576 -3.401 13.495 30.899 1.00 32.10 C ATOM 1426 CG1 ILE A 576 -3.513 12.629 32.161 1.00 33.99 C ATOM 1427 CG2 ILE A 576 -3.554 14.988 31.172 1.00 34.67 C ATOM 1428 CD1 ILE A 576 -3.796 13.388 33.454 1.00 32.48 C ATOM 0 H ILE A 576 -5.117 11.705 31.134 1.00 32.46 H new ATOM 0 HA ILE A 576 -5.039 13.794 29.645 1.00 31.87 H new ATOM 0 HB ILE A 576 -2.503 13.360 30.558 1.00 32.10 H new ATOM 0 HG12 ILE A 576 -4.218 11.977 32.026 1.00 33.99 H new ATOM 0 HG13 ILE A 576 -2.686 12.134 32.269 1.00 33.99 H new ATOM 0 HG21 ILE A 576 -2.898 15.266 31.830 1.00 34.67 H new ATOM 0 HG22 ILE A 576 -3.416 15.483 30.350 1.00 34.67 H new ATOM 0 HG23 ILE A 576 -4.446 15.166 31.510 1.00 34.67 H new ATOM 0 HD11 ILE A 576 -3.849 12.761 34.192 1.00 32.48 H new ATOM 0 HD12 ILE A 576 -3.081 14.023 33.620 1.00 32.48 H new ATOM 0 HD13 ILE A 576 -4.638 13.863 33.373 1.00 32.48 H new ATOM 1429 N ILE A 577 -3.154 11.409 28.617 1.00 27.24 N ATOM 1430 CA ILE A 577 -2.411 10.907 27.472 1.00 24.28 C ATOM 1431 C ILE A 577 -3.324 10.814 26.251 1.00 25.69 C ATOM 1432 O ILE A 577 -3.076 11.466 25.240 1.00 25.23 O ATOM 1433 CB ILE A 577 -1.782 9.524 27.779 1.00 23.68 C ATOM 1434 CG1 ILE A 577 -0.747 9.668 28.901 1.00 21.67 C ATOM 1435 CG2 ILE A 577 -1.106 8.954 26.532 1.00 21.30 C ATOM 1436 CD1 ILE A 577 -0.388 8.360 29.574 1.00 21.92 C ATOM 0 H ILE A 577 -3.203 10.866 29.282 1.00 27.24 H new ATOM 0 HA ILE A 577 -1.692 11.529 27.282 1.00 24.28 H new ATOM 0 HB ILE A 577 -2.486 8.917 28.058 1.00 23.68 H new ATOM 0 HG12 ILE A 577 0.059 10.066 28.537 1.00 21.67 H new ATOM 0 HG13 ILE A 577 -1.090 10.282 29.569 1.00 21.67 H new ATOM 0 HG21 ILE A 577 -0.718 8.090 26.740 1.00 21.30 H new ATOM 0 HG22 ILE A 577 -1.763 8.851 25.826 1.00 21.30 H new ATOM 0 HG23 ILE A 577 -0.407 9.559 26.237 1.00 21.30 H new ATOM 0 HD11 ILE A 577 0.268 8.523 30.270 1.00 21.92 H new ATOM 0 HD12 ILE A 577 -1.184 7.968 29.966 1.00 21.92 H new ATOM 0 HD13 ILE A 577 -0.017 7.749 28.918 1.00 21.92 H new ATOM 1437 N LEU A 578 -4.395 10.034 26.354 1.00 26.98 N ATOM 1438 CA LEU A 578 -5.320 9.868 25.234 1.00 30.37 C ATOM 1439 C LEU A 578 -5.910 11.187 24.757 1.00 30.93 C ATOM 1440 O LEU A 578 -6.080 11.383 23.557 1.00 31.15 O ATOM 1441 CB LEU A 578 -6.447 8.900 25.604 1.00 29.20 C ATOM 1442 CG LEU A 578 -6.029 7.435 25.767 1.00 29.87 C ATOM 1443 CD1 LEU A 578 -7.252 6.556 25.636 1.00 30.07 C ATOM 1444 CD2 LEU A 578 -4.984 7.057 24.725 1.00 28.09 C ATOM 0 H LEU A 578 -4.605 9.592 27.061 1.00 26.98 H new ATOM 0 HA LEU A 578 -4.802 9.501 24.501 1.00 30.37 H new ATOM 0 HB2 LEU A 578 -6.850 9.199 26.434 1.00 29.20 H new ATOM 0 HB3 LEU A 578 -7.133 8.950 24.920 1.00 29.20 H new ATOM 0 HG LEU A 578 -5.633 7.308 26.644 1.00 29.87 H new ATOM 0 HD11 LEU A 578 -6.995 5.626 25.738 1.00 30.07 H new ATOM 0 HD12 LEU A 578 -7.895 6.791 26.324 1.00 30.07 H new ATOM 0 HD13 LEU A 578 -7.652 6.686 24.762 1.00 30.07 H new ATOM 0 HD21 LEU A 578 -4.731 6.128 24.842 1.00 28.09 H new ATOM 0 HD22 LEU A 578 -5.353 7.181 23.837 1.00 28.09 H new ATOM 0 HD23 LEU A 578 -4.202 7.621 24.832 1.00 28.09 H new ATOM 1445 N LYS A 579 -6.222 12.084 25.691 1.00 33.70 N ATOM 1446 CA LYS A 579 -6.777 13.391 25.341 1.00 34.51 C ATOM 1447 C LYS A 579 -5.725 14.169 24.562 1.00 33.38 C ATOM 1448 O LYS A 579 -6.044 14.994 23.703 1.00 32.41 O ATOM 1449 CB LYS A 579 -7.160 14.168 26.602 1.00 37.86 C ATOM 1450 CG LYS A 579 -8.037 15.380 26.331 1.00 42.80 C ATOM 1451 CD LYS A 579 -7.286 16.690 26.557 1.00 45.99 C ATOM 1452 CE LYS A 579 -8.237 17.886 26.558 1.00 47.31 C ATOM 1453 NZ LYS A 579 -7.518 19.189 26.489 1.00 48.65 N ATOM 0 H LYS A 579 -6.120 11.955 26.535 1.00 33.70 H new ATOM 0 HA LYS A 579 -7.575 13.269 24.804 1.00 34.51 H new ATOM 0 HB2 LYS A 579 -7.624 13.572 27.211 1.00 37.86 H new ATOM 0 HB3 LYS A 579 -6.351 14.458 27.052 1.00 37.86 H new ATOM 0 HG2 LYS A 579 -8.360 15.347 25.417 1.00 42.80 H new ATOM 0 HG3 LYS A 579 -8.816 15.351 26.909 1.00 42.80 H new ATOM 0 HD2 LYS A 579 -6.812 16.651 27.402 1.00 45.99 H new ATOM 0 HD3 LYS A 579 -6.619 16.806 25.863 1.00 45.99 H new ATOM 0 HE2 LYS A 579 -8.843 17.814 25.804 1.00 47.31 H new ATOM 0 HE3 LYS A 579 -8.780 17.862 27.361 1.00 47.31 H new ATOM 0 HZ1 LYS A 579 -8.109 19.855 26.492 1.00 48.65 H new ATOM 0 HZ2 LYS A 579 -6.979 19.268 27.192 1.00 48.65 H new ATOM 0 HZ3 LYS A 579 -7.037 19.223 25.741 1.00 48.65 H new ATOM 1454 N LYS A 580 -4.463 13.886 24.872 1.00 31.04 N ATOM 1455 CA LYS A 580 -3.336 14.527 24.212 1.00 29.03 C ATOM 1456 C LYS A 580 -3.116 13.920 22.825 1.00 24.81 C ATOM 1457 O LYS A 580 -2.956 14.640 21.848 1.00 25.37 O ATOM 1458 CB LYS A 580 -2.075 14.363 25.069 1.00 30.53 C ATOM 1459 CG LYS A 580 -0.767 14.509 24.309 1.00 32.46 C ATOM 1460 CD LYS A 580 0.061 15.635 24.878 1.00 34.04 C ATOM 1461 CE LYS A 580 0.896 16.280 23.797 1.00 38.05 C ATOM 1462 NZ LYS A 580 0.189 17.411 23.132 1.00 40.08 N ATOM 0 H LYS A 580 -4.238 13.314 25.474 1.00 31.04 H new ATOM 0 HA LYS A 580 -3.528 15.472 24.106 1.00 29.03 H new ATOM 0 HB2 LYS A 580 -2.096 15.020 25.782 1.00 30.53 H new ATOM 0 HB3 LYS A 580 -2.095 13.489 25.488 1.00 30.53 H new ATOM 0 HG2 LYS A 580 -0.267 13.679 24.355 1.00 32.46 H new ATOM 0 HG3 LYS A 580 -0.950 14.678 23.372 1.00 32.46 H new ATOM 0 HD2 LYS A 580 -0.520 16.298 25.283 1.00 34.04 H new ATOM 0 HD3 LYS A 580 0.638 15.296 25.580 1.00 34.04 H new ATOM 0 HE2 LYS A 580 1.726 16.602 24.182 1.00 38.05 H new ATOM 0 HE3 LYS A 580 1.131 15.614 23.133 1.00 38.05 H new ATOM 0 HZ1 LYS A 580 0.714 17.761 22.504 1.00 40.08 H new ATOM 0 HZ2 LYS A 580 -0.562 17.113 22.758 1.00 40.08 H new ATOM 0 HZ3 LYS A 580 -0.008 18.035 23.736 1.00 40.08 H new ATOM 1463 N ALA A 581 -3.116 12.594 22.749 1.00 22.17 N ATOM 1464 CA ALA A 581 -2.916 11.887 21.488 1.00 22.81 C ATOM 1465 C ALA A 581 -3.961 12.297 20.450 1.00 24.40 C ATOM 1466 O ALA A 581 -3.643 12.525 19.275 1.00 23.46 O ATOM 1467 CB ALA A 581 -2.985 10.380 21.728 1.00 18.62 C ATOM 0 H ALA A 581 -3.232 12.078 23.427 1.00 22.17 H new ATOM 0 HA ALA A 581 -2.041 12.123 21.142 1.00 22.81 H new ATOM 0 HB1 ALA A 581 -2.852 9.912 20.889 1.00 18.62 H new ATOM 0 HB2 ALA A 581 -2.293 10.120 22.356 1.00 18.62 H new ATOM 0 HB3 ALA A 581 -3.854 10.150 22.092 1.00 18.62 H new ATOM 1468 N ASN A 582 -5.209 12.389 20.900 1.00 25.44 N ATOM 1469 CA ASN A 582 -6.322 12.752 20.035 1.00 28.09 C ATOM 1470 C ASN A 582 -6.160 14.131 19.423 1.00 27.76 C ATOM 1471 O ASN A 582 -6.284 14.292 18.215 1.00 29.10 O ATOM 1472 CB ASN A 582 -7.639 12.691 20.813 1.00 31.40 C ATOM 1473 CG ASN A 582 -8.823 12.333 19.930 1.00 34.40 C ATOM 1474 OD1 ASN A 582 -8.708 11.541 18.990 1.00 34.12 O ATOM 1475 ND2 ASN A 582 -9.973 12.921 20.232 1.00 36.84 N ATOM 0 H ASN A 582 -5.433 12.242 21.717 1.00 25.44 H new ATOM 0 HA ASN A 582 -6.334 12.109 19.309 1.00 28.09 H new ATOM 0 HB2 ASN A 582 -7.561 12.036 21.524 1.00 31.40 H new ATOM 0 HB3 ASN A 582 -7.802 13.549 21.234 1.00 31.40 H new ATOM 0 HD21 ASN A 582 -10.676 12.756 19.765 1.00 36.84 H new ATOM 0 HD22 ASN A 582 -10.015 13.468 20.895 1.00 36.84 H new ATOM 1476 N LYS A 583 -5.883 15.130 20.250 1.00 27.05 N ATOM 1477 CA LYS A 583 -5.723 16.482 19.742 1.00 28.12 C ATOM 1478 C LYS A 583 -4.527 16.609 18.803 1.00 27.36 C ATOM 1479 O LYS A 583 -4.469 17.516 17.978 1.00 28.23 O ATOM 1480 CB LYS A 583 -5.586 17.463 20.902 1.00 29.51 C ATOM 1481 CG LYS A 583 -6.911 18.095 21.299 1.00 36.15 C ATOM 1482 CD LYS A 583 -7.185 17.930 22.792 1.00 40.69 C ATOM 1483 CE LYS A 583 -8.347 16.984 23.050 1.00 41.72 C ATOM 1484 NZ LYS A 583 -8.159 15.674 22.369 1.00 43.58 N ATOM 0 H LYS A 583 -5.785 15.047 21.100 1.00 27.05 H new ATOM 0 HA LYS A 583 -6.517 16.694 19.227 1.00 28.12 H new ATOM 0 HB2 LYS A 583 -5.210 17.001 21.668 1.00 29.51 H new ATOM 0 HB3 LYS A 583 -4.960 18.162 20.657 1.00 29.51 H new ATOM 0 HG2 LYS A 583 -6.901 19.038 21.073 1.00 36.15 H new ATOM 0 HG3 LYS A 583 -7.630 17.689 20.790 1.00 36.15 H new ATOM 0 HD2 LYS A 583 -6.389 17.593 23.232 1.00 40.69 H new ATOM 0 HD3 LYS A 583 -7.380 18.796 23.183 1.00 40.69 H new ATOM 0 HE2 LYS A 583 -8.441 16.841 24.005 1.00 41.72 H new ATOM 0 HE3 LYS A 583 -9.171 17.393 22.742 1.00 41.72 H new ATOM 0 HZ1 LYS A 583 -8.739 15.083 22.696 1.00 43.58 H new ATOM 0 HZ2 LYS A 583 -8.296 15.771 21.495 1.00 43.58 H new ATOM 0 HZ3 LYS A 583 -7.329 15.383 22.508 1.00 43.58 H new ATOM 1485 N LEU A 584 -3.574 15.694 18.929 1.00 26.18 N ATOM 1486 CA LEU A 584 -2.392 15.716 18.084 1.00 26.17 C ATOM 1487 C LEU A 584 -2.689 15.153 16.702 1.00 26.56 C ATOM 1488 O LEU A 584 -2.248 15.707 15.699 1.00 26.45 O ATOM 1489 CB LEU A 584 -1.271 14.883 18.711 1.00 24.94 C ATOM 1490 CG LEU A 584 -0.319 15.584 19.672 1.00 26.31 C ATOM 1491 CD1 LEU A 584 0.546 14.542 20.356 1.00 26.89 C ATOM 1492 CD2 LEU A 584 0.539 16.579 18.920 1.00 26.88 C ATOM 0 H LEU A 584 -3.594 15.051 19.500 1.00 26.18 H new ATOM 0 HA LEU A 584 -2.117 16.642 18.001 1.00 26.17 H new ATOM 0 HB2 LEU A 584 -1.679 14.141 19.184 1.00 24.94 H new ATOM 0 HB3 LEU A 584 -0.743 14.504 17.991 1.00 24.94 H new ATOM 0 HG LEU A 584 -0.826 16.069 20.342 1.00 26.31 H new ATOM 0 HD11 LEU A 584 1.156 14.980 20.970 1.00 26.89 H new ATOM 0 HD12 LEU A 584 -0.018 13.924 20.847 1.00 26.89 H new ATOM 0 HD13 LEU A 584 1.054 14.055 19.689 1.00 26.89 H new ATOM 0 HD21 LEU A 584 1.141 17.020 19.539 1.00 26.88 H new ATOM 0 HD22 LEU A 584 1.055 16.115 18.243 1.00 26.88 H new ATOM 0 HD23 LEU A 584 -0.029 17.241 18.496 1.00 26.88 H new ATOM 1493 N ARG A 585 -3.442 14.055 16.657 1.00 27.55 N ATOM 1494 CA ARG A 585 -3.753 13.383 15.393 1.00 29.53 C ATOM 1495 C ARG A 585 -5.149 13.575 14.792 1.00 31.16 C ATOM 1496 O ARG A 585 -5.331 13.388 13.587 1.00 30.08 O ATOM 1497 CB ARG A 585 -3.486 11.883 15.547 1.00 28.67 C ATOM 1498 CG ARG A 585 -2.288 11.558 16.429 1.00 25.86 C ATOM 1499 CD ARG A 585 -1.005 12.095 15.812 1.00 24.85 C ATOM 1500 NE ARG A 585 -0.613 11.321 14.637 1.00 24.51 N ATOM 1501 CZ ARG A 585 0.462 11.571 13.892 1.00 26.99 C ATOM 1502 NH1 ARG A 585 1.268 12.585 14.194 1.00 25.68 N ATOM 1503 NH2 ARG A 585 0.740 10.797 12.845 1.00 25.03 N ATOM 0 H ARG A 585 -3.785 13.680 17.351 1.00 27.55 H new ATOM 0 HA ARG A 585 -3.168 13.824 14.757 1.00 29.53 H new ATOM 0 HB2 ARG A 585 -4.275 11.459 15.919 1.00 28.67 H new ATOM 0 HB3 ARG A 585 -3.344 11.497 14.669 1.00 28.67 H new ATOM 0 HG2 ARG A 585 -2.415 11.944 17.310 1.00 25.86 H new ATOM 0 HG3 ARG A 585 -2.218 10.598 16.547 1.00 25.86 H new ATOM 0 HD2 ARG A 585 -1.128 13.024 15.563 1.00 24.85 H new ATOM 0 HD3 ARG A 585 -0.293 12.070 16.470 1.00 24.85 H new ATOM 0 HE ARG A 585 -1.111 10.658 14.411 1.00 24.51 H new ATOM 0 HH11 ARG A 585 1.096 13.083 14.874 1.00 25.68 H new ATOM 0 HH12 ARG A 585 1.961 12.742 13.710 1.00 25.68 H new ATOM 0 HH21 ARG A 585 0.225 10.136 12.650 1.00 25.03 H new ATOM 0 HH22 ARG A 585 1.434 10.958 12.363 1.00 25.03 H new ATOM 1504 N SER A 586 -6.126 13.943 15.618 1.00 34.89 N ATOM 1505 CA SER A 586 -7.502 14.134 15.144 1.00 38.20 C ATOM 1506 C SER A 586 -7.696 15.402 14.325 1.00 40.16 C ATOM 1507 O SER A 586 -6.964 16.379 14.488 1.00 41.76 O ATOM 1508 CB SER A 586 -8.476 14.148 16.324 1.00 36.28 C ATOM 1509 OG SER A 586 -8.780 12.826 16.734 1.00 40.81 O ATOM 0 H SER A 586 -6.016 14.088 16.458 1.00 34.89 H new ATOM 0 HA SER A 586 -7.685 13.383 14.558 1.00 38.20 H new ATOM 0 HB2 SER A 586 -8.088 14.641 17.064 1.00 36.28 H new ATOM 0 HB3 SER A 586 -9.291 14.610 16.072 1.00 36.28 H new ATOM 0 HG SER A 586 -8.373 12.653 17.448 1.00 40.81 H new ATOM 1510 N THR A 587 -8.695 15.376 13.446 1.00 42.16 N ATOM 1511 CA THR A 587 -9.004 16.514 12.586 1.00 44.03 C ATOM 1512 C THR A 587 -9.614 17.677 13.363 1.00 45.95 C ATOM 1513 O THR A 587 -10.782 17.644 13.752 1.00 45.80 O ATOM 1514 CB THR A 587 -9.979 16.118 11.459 1.00 43.82 C ATOM 1515 OG1 THR A 587 -9.596 14.850 10.912 1.00 43.92 O ATOM 1516 CG2 THR A 587 -9.963 17.163 10.360 1.00 43.24 C ATOM 0 H THR A 587 -9.212 14.698 13.332 1.00 42.16 H new ATOM 0 HA THR A 587 -8.157 16.797 12.207 1.00 44.03 H new ATOM 0 HB THR A 587 -10.874 16.058 11.828 1.00 43.82 H new ATOM 0 HG1 THR A 587 -9.601 14.894 10.073 1.00 43.92 H new ATOM 0 HG21 THR A 587 -10.579 16.903 9.657 1.00 43.24 H new ATOM 0 HG22 THR A 587 -10.232 18.021 10.725 1.00 43.24 H new ATOM 0 HG23 THR A 587 -9.068 17.234 9.994 1.00 43.24 H new ATOM 1517 N ALA A 588 -8.799 18.697 13.594 1.00 47.66 N ATOM 1518 CA ALA A 588 -9.215 19.899 14.302 1.00 49.33 C ATOM 1519 C ALA A 588 -8.603 21.042 13.506 1.00 51.10 C ATOM 1520 O ALA A 588 -7.487 20.913 13.004 1.00 51.00 O ATOM 1521 CB ALA A 588 -8.670 19.893 15.732 1.00 49.26 C ATOM 0 H ALA A 588 -7.977 18.711 13.341 1.00 47.66 H new ATOM 0 HA ALA A 588 -10.180 19.971 14.371 1.00 49.33 H new ATOM 0 HB1 ALA A 588 -8.955 20.699 16.191 1.00 49.26 H new ATOM 0 HB2 ALA A 588 -9.008 19.116 16.204 1.00 49.26 H new ATOM 0 HB3 ALA A 588 -7.701 19.860 15.709 1.00 49.26 H new ATOM 1522 N SER A 589 -9.326 22.150 13.373 1.00 52.16 N ATOM 1523 CA SER A 589 -8.806 23.279 12.612 1.00 53.24 C ATOM 1524 C SER A 589 -7.344 23.541 12.968 1.00 53.69 C ATOM 1525 O SER A 589 -6.478 23.492 12.095 1.00 53.68 O ATOM 1526 CB SER A 589 -9.647 24.536 12.858 1.00 54.09 C ATOM 1527 OG SER A 589 -9.848 24.760 14.241 1.00 58.45 O ATOM 0 H SER A 589 -10.108 22.267 13.710 1.00 52.16 H new ATOM 0 HA SER A 589 -8.859 23.055 11.670 1.00 53.24 H new ATOM 0 HB2 SER A 589 -9.205 25.305 12.465 1.00 54.09 H new ATOM 0 HB3 SER A 589 -10.505 24.445 12.415 1.00 54.09 H new ATOM 0 HG SER A 589 -10.309 25.454 14.349 1.00 58.45 H new ATOM 1528 N THR A 590 -7.064 23.788 14.248 1.00 53.68 N ATOM 1529 CA THR A 590 -5.692 24.054 14.690 1.00 53.45 C ATOM 1530 C THR A 590 -4.872 22.786 14.910 1.00 54.05 C ATOM 1531 O THR A 590 -3.973 22.762 15.755 1.00 54.94 O ATOM 1532 CB THR A 590 -5.650 24.882 16.007 1.00 52.10 C ATOM 1533 OG1 THR A 590 -6.045 24.058 17.111 1.00 49.81 O ATOM 1534 CG2 THR A 590 -6.567 26.089 15.913 1.00 51.89 C ATOM 0 H THR A 590 -7.652 23.806 14.876 1.00 53.68 H new ATOM 0 HA THR A 590 -5.299 24.561 13.962 1.00 53.45 H new ATOM 0 HB THR A 590 -4.742 25.195 16.145 1.00 52.10 H new ATOM 0 HG1 THR A 590 -6.020 24.508 17.820 1.00 49.81 H new ATOM 0 HG21 THR A 590 -6.527 26.591 16.742 1.00 51.89 H new ATOM 0 HG22 THR A 590 -6.283 26.655 15.178 1.00 51.89 H new ATOM 0 HG23 THR A 590 -7.478 25.793 15.759 1.00 51.89 H new ATOM 1535 N ALA A 591 -5.180 21.739 14.148 1.00 54.96 N ATOM 1536 CA ALA A 591 -4.461 20.467 14.252 1.00 54.91 C ATOM 1537 C ALA A 591 -3.629 20.210 12.994 1.00 55.13 C ATOM 1538 O ALA A 591 -4.040 20.552 11.881 1.00 55.27 O ATOM 1539 CB ALA A 591 -5.443 19.323 14.473 1.00 54.09 C ATOM 0 H ALA A 591 -5.807 21.744 13.559 1.00 54.96 H new ATOM 0 HA ALA A 591 -3.860 20.518 15.012 1.00 54.91 H new ATOM 0 HB1 ALA A 591 -4.956 18.487 14.540 1.00 54.09 H new ATOM 0 HB2 ALA A 591 -5.938 19.475 15.293 1.00 54.09 H new ATOM 0 HB3 ALA A 591 -6.061 19.278 13.727 1.00 54.09 H new ATOM 1540 N SER A 592 -2.458 19.606 13.179 1.00 54.07 N ATOM 1541 CA SER A 592 -1.556 19.309 12.070 1.00 53.71 C ATOM 1542 C SER A 592 -1.912 18.001 11.372 1.00 53.25 C ATOM 1543 O SER A 592 -1.061 17.118 11.233 1.00 51.18 O ATOM 1544 CB SER A 592 -0.111 19.228 12.575 1.00 54.65 C ATOM 1545 OG SER A 592 0.333 20.479 13.072 1.00 55.64 O ATOM 0 H SER A 592 -2.165 19.358 13.948 1.00 54.07 H new ATOM 0 HA SER A 592 -1.649 20.029 11.427 1.00 53.71 H new ATOM 0 HB2 SER A 592 -0.048 18.559 13.275 1.00 54.65 H new ATOM 0 HB3 SER A 592 0.470 18.940 11.854 1.00 54.65 H new ATOM 0 HG SER A 592 1.125 20.408 13.343 1.00 55.64 H new ATOM 1546 N ASN A 593 -3.161 17.870 10.927 1.00 52.09 N ATOM 1547 CA ASN A 593 -3.562 16.641 10.257 1.00 50.79 C ATOM 1548 C ASN A 593 -2.868 16.501 8.913 1.00 47.87 C ATOM 1549 O ASN A 593 -2.773 15.399 8.371 1.00 47.69 O ATOM 1550 CB ASN A 593 -5.083 16.568 10.076 1.00 53.79 C ATOM 1551 CG ASN A 593 -5.613 15.141 10.218 1.00 55.11 C ATOM 1552 OD1 ASN A 593 -5.516 14.333 9.287 1.00 54.74 O ATOM 1553 ND2 ASN A 593 -6.164 14.824 11.387 1.00 52.66 N ATOM 0 H ASN A 593 -3.776 18.467 11.001 1.00 52.09 H new ATOM 0 HA ASN A 593 -3.290 15.903 10.825 1.00 50.79 H new ATOM 0 HB2 ASN A 593 -5.513 17.138 10.733 1.00 53.79 H new ATOM 0 HB3 ASN A 593 -5.320 16.914 9.201 1.00 53.79 H new ATOM 0 HD21 ASN A 593 -6.470 14.031 11.517 1.00 52.66 H new ATOM 0 HD22 ASN A 593 -6.214 15.412 12.012 1.00 52.66 H new ATOM 1554 N GLU A 594 -2.383 17.614 8.370 1.00 44.67 N ATOM 1555 CA GLU A 594 -1.670 17.556 7.100 1.00 41.27 C ATOM 1556 C GLU A 594 -0.480 16.650 7.387 1.00 36.88 C ATOM 1557 O GLU A 594 -0.273 15.638 6.718 1.00 36.20 O ATOM 1558 CB GLU A 594 -1.180 18.947 6.683 1.00 43.86 C ATOM 1559 CG GLU A 594 -2.291 19.940 6.357 1.00 46.99 C ATOM 1560 CD GLU A 594 -2.245 21.188 7.231 1.00 49.07 C ATOM 1561 OE1 GLU A 594 -1.569 22.167 6.843 1.00 49.28 O ATOM 1562 OE2 GLU A 594 -2.888 21.191 8.305 1.00 49.90 O ATOM 0 H GLU A 594 -2.454 18.399 8.714 1.00 44.67 H new ATOM 0 HA GLU A 594 -2.231 17.233 6.378 1.00 41.27 H new ATOM 0 HB2 GLU A 594 -0.635 19.313 7.397 1.00 43.86 H new ATOM 0 HB3 GLU A 594 -0.606 18.855 5.906 1.00 43.86 H new ATOM 0 HG2 GLU A 594 -2.223 20.200 5.425 1.00 46.99 H new ATOM 0 HG3 GLU A 594 -3.151 19.505 6.468 1.00 46.99 H new ATOM 1563 N HIS A 595 0.277 17.014 8.417 1.00 32.07 N ATOM 1564 CA HIS A 595 1.447 16.253 8.842 1.00 26.71 C ATOM 1565 C HIS A 595 1.072 14.843 9.316 1.00 23.23 C ATOM 1566 O HIS A 595 1.781 13.868 9.040 1.00 21.50 O ATOM 1567 CB HIS A 595 2.162 16.994 9.970 1.00 28.60 C ATOM 1568 CG HIS A 595 3.345 16.262 10.517 1.00 28.94 C ATOM 1569 ND1 HIS A 595 4.588 16.317 9.928 1.00 29.68 N ATOM 1570 CD2 HIS A 595 3.466 15.429 11.578 1.00 27.88 C ATOM 1571 CE1 HIS A 595 5.427 15.555 10.606 1.00 29.42 C ATOM 1572 NE2 HIS A 595 4.771 15.004 11.611 1.00 28.29 N ATOM 0 H HIS A 595 0.125 17.714 8.892 1.00 32.07 H new ATOM 0 HA HIS A 595 2.034 16.164 8.075 1.00 26.71 H new ATOM 0 HB2 HIS A 595 2.451 17.861 9.644 1.00 28.60 H new ATOM 0 HB3 HIS A 595 1.532 17.157 10.689 1.00 28.60 H new ATOM 0 HD2 HIS A 595 2.792 15.190 12.172 1.00 27.88 H new ATOM 0 HE1 HIS A 595 6.327 15.428 10.409 1.00 29.42 H new ATOM 0 HE2 HIS A 595 5.107 14.466 12.192 1.00 28.29 H new ATOM 1573 N SER A 596 -0.037 14.742 10.042 1.00 19.23 N ATOM 1574 CA SER A 596 -0.500 13.457 10.542 1.00 17.94 C ATOM 1575 C SER A 596 -0.847 12.502 9.407 1.00 17.44 C ATOM 1576 O SER A 596 -0.684 11.290 9.536 1.00 18.80 O ATOM 1577 CB SER A 596 -1.727 13.651 11.427 1.00 20.99 C ATOM 1578 OG SER A 596 -1.496 14.656 12.396 1.00 27.87 O ATOM 0 H SER A 596 -0.536 15.409 10.256 1.00 19.23 H new ATOM 0 HA SER A 596 0.224 13.068 11.058 1.00 17.94 H new ATOM 0 HB2 SER A 596 -2.490 13.893 10.880 1.00 20.99 H new ATOM 0 HB3 SER A 596 -1.948 12.816 11.868 1.00 20.99 H new ATOM 0 HG SER A 596 -1.489 15.409 12.023 1.00 27.87 H new ATOM 1579 N SER A 597 -1.323 13.048 8.292 1.00 17.12 N ATOM 1580 CA SER A 597 -1.709 12.226 7.148 1.00 16.09 C ATOM 1581 C SER A 597 -0.496 11.662 6.445 1.00 16.59 C ATOM 1582 O SER A 597 -0.576 10.629 5.780 1.00 14.93 O ATOM 1583 CB SER A 597 -2.519 13.053 6.149 1.00 16.81 C ATOM 1584 OG SER A 597 -1.680 13.932 5.428 1.00 14.68 O ATOM 0 H SER A 597 -1.431 13.893 8.177 1.00 17.12 H new ATOM 0 HA SER A 597 -2.248 11.493 7.484 1.00 16.09 H new ATOM 0 HB2 SER A 597 -2.981 12.463 5.533 1.00 16.81 H new ATOM 0 HB3 SER A 597 -3.199 13.561 6.619 1.00 16.81 H new ATOM 0 HG SER A 597 -1.277 14.438 5.964 1.00 14.68 H new ATOM 1585 N ARG A 598 0.635 12.339 6.610 1.00 17.30 N ATOM 1586 CA ARG A 598 1.870 11.914 5.964 1.00 17.56 C ATOM 1587 C ARG A 598 2.827 11.190 6.903 1.00 17.99 C ATOM 1588 O ARG A 598 3.990 10.992 6.564 1.00 20.40 O ATOM 1589 CB ARG A 598 2.565 13.127 5.344 1.00 19.93 C ATOM 1590 CG ARG A 598 1.735 13.827 4.269 1.00 25.02 C ATOM 1591 CD ARG A 598 1.506 12.902 3.082 1.00 33.23 C ATOM 1592 NE ARG A 598 0.148 12.356 3.056 1.00 39.75 N ATOM 1593 CZ ARG A 598 -0.154 11.057 3.026 1.00 39.83 C ATOM 1594 NH1 ARG A 598 0.799 10.134 3.016 1.00 38.74 N ATOM 1595 NH2 ARG A 598 -1.424 10.677 3.011 1.00 41.92 N ATOM 0 H ARG A 598 0.708 13.047 7.092 1.00 17.30 H new ATOM 0 HA ARG A 598 1.624 11.274 5.278 1.00 17.56 H new ATOM 0 HB2 ARG A 598 2.774 13.763 6.045 1.00 19.93 H new ATOM 0 HB3 ARG A 598 3.408 12.844 4.957 1.00 19.93 H new ATOM 0 HG2 ARG A 598 0.882 14.102 4.640 1.00 25.02 H new ATOM 0 HG3 ARG A 598 2.190 14.632 3.975 1.00 25.02 H new ATOM 0 HD2 ARG A 598 1.673 13.388 2.259 1.00 33.23 H new ATOM 0 HD3 ARG A 598 2.145 12.173 3.115 1.00 33.23 H new ATOM 0 HE ARG A 598 -0.505 12.916 3.060 1.00 39.75 H new ATOM 0 HH11 ARG A 598 1.626 10.370 3.029 1.00 38.74 H new ATOM 0 HH12 ARG A 598 0.590 9.300 2.997 1.00 38.74 H new ATOM 0 HH21 ARG A 598 -2.050 11.267 3.021 1.00 41.92 H new ATOM 0 HH22 ARG A 598 -1.622 9.840 2.992 1.00 41.92 H new ATOM 1596 N SER A 599 2.345 10.790 8.075 1.00 15.78 N ATOM 1597 CA SER A 599 3.190 10.088 9.036 1.00 15.69 C ATOM 1598 C SER A 599 2.504 8.904 9.697 1.00 15.34 C ATOM 1599 O SER A 599 1.277 8.801 9.693 1.00 14.06 O ATOM 1600 CB SER A 599 3.681 11.055 10.120 1.00 14.57 C ATOM 1601 OG SER A 599 2.659 11.419 11.029 1.00 13.83 O ATOM 0 H SER A 599 1.534 10.914 8.333 1.00 15.78 H new ATOM 0 HA SER A 599 3.938 9.738 8.527 1.00 15.69 H new ATOM 0 HB2 SER A 599 4.412 10.644 10.608 1.00 14.57 H new ATOM 0 HB3 SER A 599 4.035 11.854 9.699 1.00 14.57 H new ATOM 0 HG SER A 599 3.004 11.731 11.728 1.00 13.83 H new ATOM 1602 N HIS A 600 3.311 8.000 10.247 1.00 13.48 N ATOM 1603 CA HIS A 600 2.806 6.831 10.952 1.00 15.52 C ATOM 1604 C HIS A 600 2.828 7.181 12.428 1.00 16.67 C ATOM 1605 O HIS A 600 3.758 7.828 12.897 1.00 17.98 O ATOM 1606 CB HIS A 600 3.712 5.619 10.742 1.00 16.98 C ATOM 1607 CG HIS A 600 3.853 5.201 9.314 1.00 18.70 C ATOM 1608 ND1 HIS A 600 2.831 5.315 8.398 1.00 19.25 N ATOM 1609 CD2 HIS A 600 4.892 4.642 8.650 1.00 19.29 C ATOM 1610 CE1 HIS A 600 3.232 4.841 7.232 1.00 20.34 C ATOM 1611 NE2 HIS A 600 4.480 4.426 7.359 1.00 22.99 N ATOM 0 H HIS A 600 4.169 8.050 10.220 1.00 13.48 H new ATOM 0 HA HIS A 600 1.920 6.608 10.626 1.00 15.52 H new ATOM 0 HB2 HIS A 600 4.592 5.820 11.098 1.00 16.98 H new ATOM 0 HB3 HIS A 600 3.362 4.873 11.254 1.00 16.98 H new ATOM 0 HD2 HIS A 600 5.729 4.442 9.003 1.00 19.29 H new ATOM 0 HE1 HIS A 600 2.723 4.805 6.455 1.00 20.34 H new ATOM 0 HE2 HIS A 600 4.957 4.077 6.734 1.00 22.99 H new ATOM 1612 N SER A 601 1.803 6.770 13.164 1.00 16.01 N ATOM 1613 CA SER A 601 1.766 7.044 14.590 1.00 13.70 C ATOM 1614 C SER A 601 1.615 5.691 15.272 1.00 14.60 C ATOM 1615 O SER A 601 0.849 4.837 14.812 1.00 14.98 O ATOM 1616 CB SER A 601 0.609 7.998 14.920 1.00 14.57 C ATOM 1617 OG SER A 601 -0.556 7.296 15.304 1.00 17.20 O ATOM 0 H SER A 601 1.126 6.335 12.859 1.00 16.01 H new ATOM 0 HA SER A 601 2.571 7.488 14.900 1.00 13.70 H new ATOM 0 HB2 SER A 601 0.877 8.596 15.635 1.00 14.57 H new ATOM 0 HB3 SER A 601 0.414 8.550 14.147 1.00 14.57 H new ATOM 0 HG SER A 601 -0.561 7.196 16.138 1.00 17.20 H new ATOM 1618 N ILE A 602 2.376 5.471 16.342 1.00 12.13 N ATOM 1619 CA ILE A 602 2.333 4.193 17.042 1.00 12.08 C ATOM 1620 C ILE A 602 2.146 4.360 18.543 1.00 13.55 C ATOM 1621 O ILE A 602 2.922 5.061 19.202 1.00 13.10 O ATOM 1622 CB ILE A 602 3.642 3.359 16.809 1.00 10.43 C ATOM 1623 CG1 ILE A 602 3.980 3.286 15.319 1.00 11.29 C ATOM 1624 CG2 ILE A 602 3.477 1.946 17.335 1.00 8.99 C ATOM 1625 CD1 ILE A 602 4.908 4.387 14.851 1.00 13.17 C ATOM 0 H ILE A 602 2.921 6.046 16.676 1.00 12.13 H new ATOM 0 HA ILE A 602 1.569 3.723 16.673 1.00 12.08 H new ATOM 0 HB ILE A 602 4.360 3.805 17.285 1.00 10.43 H new ATOM 0 HG12 ILE A 602 4.389 2.427 15.130 1.00 11.29 H new ATOM 0 HG13 ILE A 602 3.158 3.327 14.806 1.00 11.29 H new ATOM 0 HG21 ILE A 602 4.294 1.446 17.183 1.00 8.99 H new ATOM 0 HG22 ILE A 602 3.288 1.975 18.286 1.00 8.99 H new ATOM 0 HG23 ILE A 602 2.743 1.512 16.873 1.00 8.99 H new ATOM 0 HD11 ILE A 602 5.081 4.283 13.902 1.00 13.17 H new ATOM 0 HD12 ILE A 602 4.494 5.249 15.011 1.00 13.17 H new ATOM 0 HD13 ILE A 602 5.744 4.335 15.339 1.00 13.17 H new ATOM 1626 N PHE A 603 1.101 3.726 19.069 1.00 11.25 N ATOM 1627 CA PHE A 603 0.831 3.751 20.500 1.00 12.10 C ATOM 1628 C PHE A 603 1.287 2.390 20.997 1.00 11.94 C ATOM 1629 O PHE A 603 0.706 1.359 20.661 1.00 12.60 O ATOM 1630 CB PHE A 603 -0.668 3.957 20.781 1.00 12.63 C ATOM 1631 CG PHE A 603 -0.964 4.493 22.163 1.00 7.37 C ATOM 1632 CD1 PHE A 603 -1.145 3.629 23.236 1.00 9.93 C ATOM 1633 CD2 PHE A 603 -1.055 5.862 22.388 1.00 8.26 C ATOM 1634 CE1 PHE A 603 -1.406 4.123 24.516 1.00 8.42 C ATOM 1635 CE2 PHE A 603 -1.317 6.361 23.667 1.00 9.45 C ATOM 1636 CZ PHE A 603 -1.491 5.490 24.725 1.00 7.59 C ATOM 0 H PHE A 603 0.533 3.273 18.609 1.00 11.25 H new ATOM 0 HA PHE A 603 1.289 4.482 20.943 1.00 12.10 H new ATOM 0 HB2 PHE A 603 -1.030 4.569 20.122 1.00 12.63 H new ATOM 0 HB3 PHE A 603 -1.129 3.111 20.666 1.00 12.63 H new ATOM 0 HD1 PHE A 603 -1.092 2.711 23.100 1.00 9.93 H new ATOM 0 HD2 PHE A 603 -0.940 6.453 21.679 1.00 8.26 H new ATOM 0 HE1 PHE A 603 -1.523 3.535 25.227 1.00 8.42 H new ATOM 0 HE2 PHE A 603 -1.374 7.279 23.806 1.00 9.45 H new ATOM 0 HZ PHE A 603 -1.665 5.821 25.577 1.00 7.59 H new ATOM 1637 N ILE A 604 2.359 2.383 21.781 1.00 12.69 N ATOM 1638 CA ILE A 604 2.899 1.133 22.295 1.00 10.51 C ATOM 1639 C ILE A 604 2.530 0.953 23.754 1.00 9.54 C ATOM 1640 O ILE A 604 2.656 1.882 24.547 1.00 11.30 O ATOM 1641 CB ILE A 604 4.440 1.095 22.151 1.00 13.48 C ATOM 1642 CG1 ILE A 604 4.842 1.563 20.745 1.00 13.08 C ATOM 1643 CG2 ILE A 604 4.949 -0.311 22.419 1.00 11.42 C ATOM 1644 CD1 ILE A 604 6.288 2.055 20.637 1.00 12.73 C ATOM 0 H ILE A 604 2.786 3.088 22.026 1.00 12.69 H new ATOM 0 HA ILE A 604 2.515 0.411 21.774 1.00 10.51 H new ATOM 0 HB ILE A 604 4.840 1.694 22.800 1.00 13.48 H new ATOM 0 HG12 ILE A 604 4.713 0.831 20.122 1.00 13.08 H new ATOM 0 HG13 ILE A 604 4.246 2.278 20.470 1.00 13.08 H new ATOM 0 HG21 ILE A 604 5.915 -0.329 22.327 1.00 11.42 H new ATOM 0 HG22 ILE A 604 4.705 -0.578 23.319 1.00 11.42 H new ATOM 0 HG23 ILE A 604 4.553 -0.926 21.782 1.00 11.42 H new ATOM 0 HD11 ILE A 604 6.468 2.333 19.725 1.00 12.73 H new ATOM 0 HD12 ILE A 604 6.420 2.807 21.236 1.00 12.73 H new ATOM 0 HD13 ILE A 604 6.893 1.338 20.882 1.00 12.73 H new ATOM 1645 N ILE A 605 2.075 -0.249 24.090 1.00 9.31 N ATOM 1646 CA ILE A 605 1.663 -0.588 25.453 1.00 11.94 C ATOM 1647 C ILE A 605 2.360 -1.860 25.899 1.00 10.78 C ATOM 1648 O ILE A 605 2.308 -2.886 25.213 1.00 13.83 O ATOM 1649 CB ILE A 605 0.124 -0.849 25.555 1.00 11.45 C ATOM 1650 CG1 ILE A 605 -0.655 0.441 25.306 1.00 10.92 C ATOM 1651 CG2 ILE A 605 -0.220 -1.431 26.929 1.00 13.57 C ATOM 1652 CD1 ILE A 605 -2.155 0.213 25.128 1.00 13.00 C ATOM 0 H ILE A 605 1.995 -0.898 23.531 1.00 9.31 H new ATOM 0 HA ILE A 605 1.901 0.168 26.012 1.00 11.94 H new ATOM 0 HB ILE A 605 -0.130 -1.492 24.874 1.00 11.45 H new ATOM 0 HG12 ILE A 605 -0.512 1.047 26.050 1.00 10.92 H new ATOM 0 HG13 ILE A 605 -0.304 0.876 24.514 1.00 10.92 H new ATOM 0 HG21 ILE A 605 -1.175 -1.590 26.983 1.00 13.57 H new ATOM 0 HG22 ILE A 605 0.254 -2.268 27.054 1.00 13.57 H new ATOM 0 HG23 ILE A 605 0.043 -0.804 27.621 1.00 13.57 H new ATOM 0 HD11 ILE A 605 -2.596 1.063 24.974 1.00 13.00 H new ATOM 0 HD12 ILE A 605 -2.306 -0.371 24.369 1.00 13.00 H new ATOM 0 HD13 ILE A 605 -2.517 -0.198 25.929 1.00 13.00 H new ATOM 1653 N HIS A 606 3.002 -1.797 27.058 1.00 9.45 N ATOM 1654 CA HIS A 606 3.692 -2.961 27.591 1.00 10.48 C ATOM 1655 C HIS A 606 3.019 -3.468 28.855 1.00 10.19 C ATOM 1656 O HIS A 606 2.818 -2.714 29.807 1.00 12.58 O ATOM 1657 CB HIS A 606 5.154 -2.622 27.897 1.00 8.34 C ATOM 1658 CG HIS A 606 5.826 -1.862 26.797 1.00 4.26 C ATOM 1659 ND1 HIS A 606 6.388 -2.485 25.704 1.00 7.71 N ATOM 1660 CD2 HIS A 606 6.056 -0.537 26.637 1.00 4.86 C ATOM 1661 CE1 HIS A 606 6.926 -1.574 24.911 1.00 6.02 C ATOM 1662 NE2 HIS A 606 6.739 -0.386 25.455 1.00 7.53 N ATOM 0 H HIS A 606 3.050 -1.093 27.549 1.00 9.45 H new ATOM 0 HA HIS A 606 3.654 -3.658 26.917 1.00 10.48 H new ATOM 0 HB2 HIS A 606 5.195 -2.101 28.714 1.00 8.34 H new ATOM 0 HB3 HIS A 606 5.643 -3.444 28.060 1.00 8.34 H new ATOM 0 HD2 HIS A 606 5.800 0.143 27.218 1.00 4.86 H new ATOM 0 HE1 HIS A 606 7.362 -1.742 24.107 1.00 6.02 H new ATOM 0 HE2 HIS A 606 7.002 0.362 25.123 1.00 7.53 H new ATOM 1663 N LEU A 607 2.678 -4.750 28.846 1.00 12.25 N ATOM 1664 CA LEU A 607 2.040 -5.391 29.983 1.00 14.69 C ATOM 1665 C LEU A 607 2.995 -6.371 30.636 1.00 12.95 C ATOM 1666 O LEU A 607 3.314 -7.407 30.054 1.00 12.26 O ATOM 1667 CB LEU A 607 0.794 -6.156 29.545 1.00 17.16 C ATOM 1668 CG LEU A 607 -0.108 -5.531 28.485 1.00 16.13 C ATOM 1669 CD1 LEU A 607 -1.255 -6.495 28.217 1.00 18.28 C ATOM 1670 CD2 LEU A 607 -0.622 -4.178 28.962 1.00 18.22 C ATOM 0 H LEU A 607 2.811 -5.273 28.177 1.00 12.25 H new ATOM 0 HA LEU A 607 1.791 -4.696 30.612 1.00 14.69 H new ATOM 0 HB2 LEU A 607 1.080 -7.022 29.215 1.00 17.16 H new ATOM 0 HB3 LEU A 607 0.254 -6.317 30.334 1.00 17.16 H new ATOM 0 HG LEU A 607 0.385 -5.378 27.664 1.00 16.13 H new ATOM 0 HD11 LEU A 607 -1.844 -6.119 27.544 1.00 18.28 H new ATOM 0 HD12 LEU A 607 -0.900 -7.340 27.899 1.00 18.28 H new ATOM 0 HD13 LEU A 607 -1.753 -6.642 29.036 1.00 18.28 H new ATOM 0 HD21 LEU A 607 -1.194 -3.790 28.281 1.00 18.22 H new ATOM 0 HD22 LEU A 607 -1.129 -4.294 29.781 1.00 18.22 H new ATOM 0 HD23 LEU A 607 0.129 -3.587 29.128 1.00 18.22 H new ATOM 1671 N SER A 608 3.434 -6.045 31.848 1.00 16.18 N ATOM 1672 CA SER A 608 4.341 -6.913 32.591 1.00 18.28 C ATOM 1673 C SER A 608 3.628 -7.442 33.821 1.00 18.47 C ATOM 1674 O SER A 608 3.217 -6.671 34.686 1.00 21.77 O ATOM 1675 CB SER A 608 5.594 -6.147 33.017 1.00 19.02 C ATOM 1676 OG SER A 608 5.573 -4.824 32.517 1.00 25.40 O ATOM 0 H SER A 608 3.217 -5.322 32.259 1.00 16.18 H new ATOM 0 HA SER A 608 4.609 -7.649 32.019 1.00 18.28 H new ATOM 0 HB2 SER A 608 5.653 -6.130 33.985 1.00 19.02 H new ATOM 0 HB3 SER A 608 6.384 -6.607 32.693 1.00 19.02 H new ATOM 0 HG SER A 608 5.988 -4.793 31.787 1.00 25.40 H new ATOM 1677 N GLY A 609 3.474 -8.756 33.893 1.00 21.42 N ATOM 1678 CA GLY A 609 2.804 -9.348 35.034 1.00 24.93 C ATOM 1679 C GLY A 609 3.657 -10.366 35.768 1.00 29.56 C ATOM 1680 O GLY A 609 4.393 -11.131 35.153 1.00 30.50 O ATOM 0 H GLY A 609 3.747 -9.315 33.299 1.00 21.42 H new ATOM 0 HA2 GLY A 609 2.547 -8.645 35.651 1.00 24.93 H new ATOM 0 HA3 GLY A 609 1.986 -9.776 34.735 1.00 24.93 H new ATOM 1681 N SER A 610 3.565 -10.365 37.092 1.00 31.00 N ATOM 1682 CA SER A 610 4.310 -11.309 37.909 1.00 33.24 C ATOM 1683 C SER A 610 3.344 -11.935 38.891 1.00 36.57 C ATOM 1684 O SER A 610 2.396 -11.292 39.350 1.00 35.81 O ATOM 1685 CB SER A 610 5.435 -10.600 38.664 1.00 31.92 C ATOM 1686 OG SER A 610 4.981 -9.375 39.207 1.00 32.52 O ATOM 0 H SER A 610 3.072 -9.820 37.539 1.00 31.00 H new ATOM 0 HA SER A 610 4.713 -11.988 37.345 1.00 33.24 H new ATOM 0 HB2 SER A 610 5.764 -11.172 39.375 1.00 31.92 H new ATOM 0 HB3 SER A 610 6.180 -10.437 38.064 1.00 31.92 H new ATOM 0 HG SER A 610 5.610 -9.000 39.619 1.00 32.52 H new ATOM 1687 N ASN A 611 3.568 -13.206 39.194 1.00 41.06 N ATOM 1688 CA ASN A 611 2.716 -13.915 40.131 1.00 44.40 C ATOM 1689 C ASN A 611 3.483 -14.219 41.403 1.00 47.59 C ATOM 1690 O ASN A 611 4.336 -15.096 41.432 1.00 47.61 O ATOM 1691 CB ASN A 611 2.216 -15.214 39.510 1.00 43.80 C ATOM 1692 CG ASN A 611 0.963 -15.726 40.172 1.00 44.51 C ATOM 1693 OD1 ASN A 611 0.929 -15.899 41.389 1.00 45.25 O ATOM 1694 ND2 ASN A 611 -0.081 -15.934 39.383 1.00 44.78 N ATOM 0 H ASN A 611 4.210 -13.675 38.866 1.00 41.06 H new ATOM 0 HA ASN A 611 1.955 -13.353 40.344 1.00 44.40 H new ATOM 0 HB2 ASN A 611 2.045 -15.072 38.566 1.00 43.80 H new ATOM 0 HB3 ASN A 611 2.911 -15.888 39.574 1.00 43.80 H new ATOM 0 HD21 ASN A 611 -0.826 -16.203 39.718 1.00 44.78 H new ATOM 0 HD22 ASN A 611 -0.013 -15.800 38.536 1.00 44.78 H new ATOM 1695 N ALA A 612 3.167 -13.463 42.461 1.00 52.66 N ATOM 1696 CA ALA A 612 3.809 -13.622 43.751 1.00 57.37 C ATOM 1697 C ALA A 612 3.935 -15.083 44.193 1.00 59.75 C ATOM 1698 O ALA A 612 5.021 -15.516 44.594 1.00 61.09 O ATOM 1699 CB ALA A 612 3.039 -12.829 44.807 1.00 58.02 C ATOM 0 H ALA A 612 2.571 -12.844 42.441 1.00 52.66 H new ATOM 0 HA ALA A 612 4.713 -13.282 43.657 1.00 57.37 H new ATOM 0 HB1 ALA A 612 3.469 -12.936 45.670 1.00 58.02 H new ATOM 0 HB2 ALA A 612 3.031 -11.890 44.564 1.00 58.02 H new ATOM 0 HB3 ALA A 612 2.128 -13.157 44.858 1.00 58.02 H new ATOM 1700 N LYS A 613 2.837 -15.837 44.117 1.00 62.30 N ATOM 1701 CA LYS A 613 2.836 -17.243 44.535 1.00 64.25 C ATOM 1702 C LYS A 613 3.284 -18.221 43.439 1.00 63.61 C ATOM 1703 O LYS A 613 4.216 -19.005 43.646 1.00 64.69 O ATOM 1704 CB LYS A 613 1.443 -17.630 45.070 1.00 66.02 C ATOM 1705 CG LYS A 613 0.447 -18.176 44.046 1.00 69.03 C ATOM 1706 CD LYS A 613 -0.940 -18.400 44.664 1.00 71.47 C ATOM 1707 CE LYS A 613 -0.918 -19.472 45.764 1.00 72.34 C ATOM 1708 NZ LYS A 613 -2.210 -19.577 46.514 1.00 72.37 N ATOM 0 H LYS A 613 2.079 -15.553 43.825 1.00 62.30 H new ATOM 0 HA LYS A 613 3.498 -17.319 45.240 1.00 64.25 H new ATOM 0 HB2 LYS A 613 1.559 -18.296 45.766 1.00 66.02 H new ATOM 0 HB3 LYS A 613 1.050 -16.848 45.489 1.00 66.02 H new ATOM 0 HG2 LYS A 613 0.374 -17.556 43.303 1.00 69.03 H new ATOM 0 HG3 LYS A 613 0.780 -19.013 43.686 1.00 69.03 H new ATOM 0 HD2 LYS A 613 -1.266 -17.565 45.035 1.00 71.47 H new ATOM 0 HD3 LYS A 613 -1.563 -18.664 43.969 1.00 71.47 H new ATOM 0 HE2 LYS A 613 -0.712 -20.332 45.365 1.00 72.34 H new ATOM 0 HE3 LYS A 613 -0.204 -19.271 46.389 1.00 72.34 H new ATOM 0 HZ1 LYS A 613 -2.142 -20.210 47.136 1.00 72.37 H new ATOM 0 HZ2 LYS A 613 -2.392 -18.797 46.903 1.00 72.37 H new ATOM 0 HZ3 LYS A 613 -2.865 -19.786 45.949 1.00 72.37 H new ATOM 1709 N THR A 614 2.625 -18.171 42.281 1.00 62.79 N ATOM 1710 CA THR A 614 2.969 -19.050 41.163 1.00 61.22 C ATOM 1711 C THR A 614 4.413 -18.802 40.695 1.00 59.02 C ATOM 1712 O THR A 614 5.041 -19.689 40.112 1.00 58.99 O ATOM 1713 CB THR A 614 1.981 -18.858 39.973 1.00 62.14 C ATOM 1714 OG1 THR A 614 0.810 -19.659 40.196 1.00 62.83 O ATOM 1715 CG2 THR A 614 2.632 -19.281 38.659 1.00 63.24 C ATOM 0 H THR A 614 1.973 -17.633 42.122 1.00 62.79 H new ATOM 0 HA THR A 614 2.897 -19.965 41.477 1.00 61.22 H new ATOM 0 HB THR A 614 1.741 -17.920 39.916 1.00 62.14 H new ATOM 0 HG1 THR A 614 0.274 -19.557 39.557 1.00 62.83 H new ATOM 0 HG21 THR A 614 2.004 -19.155 37.931 1.00 63.24 H new ATOM 0 HG22 THR A 614 3.422 -18.741 38.501 1.00 63.24 H new ATOM 0 HG23 THR A 614 2.885 -20.216 38.709 1.00 63.24 H new ATOM 1716 N GLY A 615 4.927 -17.599 40.958 1.00 56.78 N ATOM 1717 CA GLY A 615 6.280 -17.254 40.572 1.00 52.99 C ATOM 1718 C GLY A 615 6.389 -16.970 39.090 1.00 50.68 C ATOM 1719 O GLY A 615 7.448 -16.542 38.614 1.00 52.60 O ATOM 0 H GLY A 615 4.500 -16.971 41.361 1.00 56.78 H new ATOM 0 HA2 GLY A 615 6.570 -16.475 41.072 1.00 52.99 H new ATOM 0 HA3 GLY A 615 6.878 -17.981 40.807 1.00 52.99 H new ATOM 1720 N ALA A 616 5.311 -17.225 38.356 1.00 46.13 N ATOM 1721 CA ALA A 616 5.305 -16.999 36.916 1.00 41.86 C ATOM 1722 C ALA A 616 5.497 -15.521 36.602 1.00 38.74 C ATOM 1723 O ALA A 616 5.283 -14.645 37.447 1.00 36.13 O ATOM 1724 CB ALA A 616 4.008 -17.483 36.328 1.00 41.85 C ATOM 0 H ALA A 616 4.572 -17.530 38.673 1.00 46.13 H new ATOM 0 HA ALA A 616 6.041 -17.495 36.523 1.00 41.86 H new ATOM 0 HB1 ALA A 616 4.010 -17.330 35.370 1.00 41.85 H new ATOM 0 HB2 ALA A 616 3.907 -18.432 36.503 1.00 41.85 H new ATOM 0 HB3 ALA A 616 3.270 -17.000 36.731 1.00 41.85 H new ATOM 1725 N HIS A 617 5.935 -15.258 35.381 1.00 36.19 N ATOM 1726 CA HIS A 617 6.146 -13.897 34.923 1.00 34.13 C ATOM 1727 C HIS A 617 5.555 -13.805 33.523 1.00 31.17 C ATOM 1728 O HIS A 617 5.367 -14.824 32.859 1.00 31.17 O ATOM 1729 CB HIS A 617 7.643 -13.552 34.912 1.00 34.41 C ATOM 1730 CG HIS A 617 8.186 -13.158 36.252 1.00 37.72 C ATOM 1731 ND1 HIS A 617 8.559 -11.865 36.561 1.00 39.26 N ATOM 1732 CD2 HIS A 617 8.434 -13.895 37.362 1.00 36.40 C ATOM 1733 CE1 HIS A 617 9.016 -11.825 37.801 1.00 36.75 C ATOM 1734 NE2 HIS A 617 8.950 -13.044 38.308 1.00 36.99 N ATOM 0 H HIS A 617 6.118 -15.862 34.796 1.00 36.19 H new ATOM 0 HA HIS A 617 5.717 -13.262 35.518 1.00 34.13 H new ATOM 0 HB2 HIS A 617 8.140 -14.318 34.584 1.00 34.41 H new ATOM 0 HB3 HIS A 617 7.794 -12.827 34.286 1.00 34.41 H new ATOM 0 HD2 HIS A 617 8.283 -14.807 37.464 1.00 36.40 H new ATOM 0 HE1 HIS A 617 9.330 -11.068 38.241 1.00 36.75 H new ATOM 0 HE2 HIS A 617 9.191 -13.268 39.102 1.00 36.99 H new ATOM 1735 N SER A 618 5.248 -12.592 33.080 1.00 27.79 N ATOM 1736 CA SER A 618 4.648 -12.408 31.763 1.00 23.74 C ATOM 1737 C SER A 618 4.977 -11.050 31.154 1.00 19.95 C ATOM 1738 O SER A 618 4.959 -10.032 31.846 1.00 18.16 O ATOM 1739 CB SER A 618 3.126 -12.561 31.875 1.00 22.42 C ATOM 1740 OG SER A 618 2.515 -12.517 30.604 1.00 24.73 O ATOM 0 H SER A 618 5.378 -11.866 33.522 1.00 27.79 H new ATOM 0 HA SER A 618 5.020 -13.085 31.176 1.00 23.74 H new ATOM 0 HB2 SER A 618 2.914 -13.402 32.310 1.00 22.42 H new ATOM 0 HB3 SER A 618 2.767 -11.854 32.434 1.00 22.42 H new ATOM 0 HG SER A 618 2.192 -11.753 30.475 1.00 24.73 H new ATOM 1741 N TYR A 619 5.293 -11.034 29.860 1.00 16.07 N ATOM 1742 CA TYR A 619 5.577 -9.777 29.186 1.00 13.29 C ATOM 1743 C TYR A 619 5.031 -9.782 27.762 1.00 12.61 C ATOM 1744 O TYR A 619 5.401 -10.625 26.947 1.00 12.09 O ATOM 1745 CB TYR A 619 7.081 -9.481 29.160 1.00 13.30 C ATOM 1746 CG TYR A 619 7.366 -8.017 28.924 1.00 13.18 C ATOM 1747 CD1 TYR A 619 7.361 -7.106 29.980 1.00 14.32 C ATOM 1748 CD2 TYR A 619 7.610 -7.534 27.641 1.00 12.07 C ATOM 1749 CE1 TYR A 619 7.592 -5.745 29.763 1.00 14.41 C ATOM 1750 CE2 TYR A 619 7.843 -6.177 27.415 1.00 12.88 C ATOM 1751 CZ TYR A 619 7.834 -5.290 28.476 1.00 13.38 C ATOM 1752 OH TYR A 619 8.076 -3.952 28.254 1.00 13.55 O ATOM 0 H TYR A 619 5.347 -11.733 29.362 1.00 16.07 H new ATOM 0 HA TYR A 619 5.134 -9.078 29.691 1.00 13.29 H new ATOM 0 HB2 TYR A 619 7.478 -9.755 30.001 1.00 13.30 H new ATOM 0 HB3 TYR A 619 7.501 -10.008 28.463 1.00 13.30 H new ATOM 0 HD1 TYR A 619 7.201 -7.410 30.844 1.00 14.32 H new ATOM 0 HD2 TYR A 619 7.618 -8.125 26.923 1.00 12.07 H new ATOM 0 HE1 TYR A 619 7.583 -5.149 30.477 1.00 14.41 H new ATOM 0 HE2 TYR A 619 8.004 -5.869 26.552 1.00 12.88 H new ATOM 0 HH TYR A 619 8.205 -3.823 27.434 1.00 13.55 H new ATOM 1753 N GLY A 620 4.136 -8.838 27.483 1.00 14.19 N ATOM 1754 CA GLY A 620 3.530 -8.735 26.169 1.00 8.51 C ATOM 1755 C GLY A 620 3.438 -7.284 25.782 1.00 8.18 C ATOM 1756 O GLY A 620 3.185 -6.417 26.622 1.00 8.34 O ATOM 0 H GLY A 620 3.868 -8.247 28.047 1.00 14.19 H new ATOM 0 HA2 GLY A 620 4.058 -9.222 25.518 1.00 8.51 H new ATOM 0 HA3 GLY A 620 2.647 -9.136 26.175 1.00 8.51 H new ATOM 1757 N THR A 621 3.643 -7.004 24.501 1.00 7.68 N ATOM 1758 CA THR A 621 3.590 -5.637 24.031 1.00 9.19 C ATOM 1759 C THR A 621 2.517 -5.462 22.962 1.00 10.78 C ATOM 1760 O THR A 621 2.351 -6.316 22.095 1.00 12.94 O ATOM 1761 CB THR A 621 4.967 -5.209 23.465 1.00 11.44 C ATOM 1762 OG1 THR A 621 5.934 -5.207 24.531 1.00 15.01 O ATOM 1763 CG2 THR A 621 4.891 -3.818 22.847 1.00 10.77 C ATOM 0 H THR A 621 3.813 -7.590 23.895 1.00 7.68 H new ATOM 0 HA THR A 621 3.364 -5.072 24.787 1.00 9.19 H new ATOM 0 HB THR A 621 5.230 -5.838 22.775 1.00 11.44 H new ATOM 0 HG1 THR A 621 6.026 -4.425 24.824 1.00 15.01 H new ATOM 0 HG21 THR A 621 5.762 -3.570 22.499 1.00 10.77 H new ATOM 0 HG22 THR A 621 4.244 -3.820 22.125 1.00 10.77 H new ATOM 0 HG23 THR A 621 4.619 -3.178 23.523 1.00 10.77 H new ATOM 1764 N LEU A 622 1.781 -4.362 23.048 1.00 13.51 N ATOM 1765 CA LEU A 622 0.739 -4.063 22.074 1.00 13.77 C ATOM 1766 C LEU A 622 1.109 -2.798 21.320 1.00 11.12 C ATOM 1767 O LEU A 622 1.405 -1.769 21.926 1.00 12.25 O ATOM 1768 CB LEU A 622 -0.618 -3.859 22.758 1.00 16.61 C ATOM 1769 CG LEU A 622 -1.264 -5.046 23.480 1.00 18.64 C ATOM 1770 CD1 LEU A 622 -1.458 -4.698 24.951 1.00 22.91 C ATOM 1771 CD2 LEU A 622 -2.600 -5.386 22.844 1.00 16.74 C ATOM 0 H LEU A 622 1.870 -3.772 23.667 1.00 13.51 H new ATOM 0 HA LEU A 622 0.666 -4.814 21.464 1.00 13.77 H new ATOM 0 HB2 LEU A 622 -0.517 -3.142 23.403 1.00 16.61 H new ATOM 0 HB3 LEU A 622 -1.243 -3.549 22.084 1.00 16.61 H new ATOM 0 HG LEU A 622 -0.683 -5.819 23.405 1.00 18.64 H new ATOM 0 HD11 LEU A 622 -1.867 -5.448 25.410 1.00 22.91 H new ATOM 0 HD12 LEU A 622 -0.597 -4.503 25.354 1.00 22.91 H new ATOM 0 HD13 LEU A 622 -2.033 -3.921 25.027 1.00 22.91 H new ATOM 0 HD21 LEU A 622 -2.998 -6.138 23.310 1.00 16.74 H new ATOM 0 HD22 LEU A 622 -3.191 -4.619 22.904 1.00 16.74 H new ATOM 0 HD23 LEU A 622 -2.465 -5.618 21.912 1.00 16.74 H new ATOM 1772 N ASN A 623 1.096 -2.883 19.994 1.00 11.32 N ATOM 1773 CA ASN A 623 1.406 -1.743 19.143 1.00 8.81 C ATOM 1774 C ASN A 623 0.157 -1.428 18.316 1.00 9.91 C ATOM 1775 O ASN A 623 -0.308 -2.268 17.540 1.00 9.84 O ATOM 1776 CB ASN A 623 2.586 -2.080 18.227 1.00 12.44 C ATOM 1777 CG ASN A 623 3.745 -2.704 18.981 1.00 7.53 C ATOM 1778 OD1 ASN A 623 3.821 -3.927 19.142 1.00 10.18 O ATOM 1779 ND2 ASN A 623 4.650 -1.866 19.449 1.00 8.90 N ATOM 0 H ASN A 623 0.907 -3.603 19.564 1.00 11.32 H new ATOM 0 HA ASN A 623 1.655 -0.973 19.678 1.00 8.81 H new ATOM 0 HB2 ASN A 623 2.289 -2.690 17.533 1.00 12.44 H new ATOM 0 HB3 ASN A 623 2.889 -1.272 17.784 1.00 12.44 H new ATOM 0 HD21 ASN A 623 5.327 -2.165 19.886 1.00 8.90 H new ATOM 0 HD22 ASN A 623 4.563 -1.021 19.317 1.00 8.90 H new ATOM 1780 N LEU A 624 -0.372 -0.223 18.497 1.00 8.56 N ATOM 1781 CA LEU A 624 -1.584 0.212 17.813 1.00 10.63 C ATOM 1782 C LEU A 624 -1.191 1.318 16.873 1.00 9.46 C ATOM 1783 O LEU A 624 -0.968 2.459 17.280 1.00 9.31 O ATOM 1784 CB LEU A 624 -2.596 0.676 18.853 1.00 11.35 C ATOM 1785 CG LEU A 624 -2.632 -0.329 20.012 1.00 14.00 C ATOM 1786 CD1 LEU A 624 -3.533 0.166 21.123 1.00 16.22 C ATOM 1787 CD2 LEU A 624 -3.098 -1.694 19.499 1.00 13.77 C ATOM 0 H LEU A 624 -0.036 0.369 19.023 1.00 8.56 H new ATOM 0 HA LEU A 624 -1.997 -0.504 17.305 1.00 10.63 H new ATOM 0 HB2 LEU A 624 -2.356 1.556 19.182 1.00 11.35 H new ATOM 0 HB3 LEU A 624 -3.475 0.753 18.451 1.00 11.35 H new ATOM 0 HG LEU A 624 -1.738 -0.421 20.376 1.00 14.00 H new ATOM 0 HD11 LEU A 624 -3.543 -0.482 21.845 1.00 16.22 H new ATOM 0 HD12 LEU A 624 -3.201 1.015 21.455 1.00 16.22 H new ATOM 0 HD13 LEU A 624 -4.434 0.283 20.782 1.00 16.22 H new ATOM 0 HD21 LEU A 624 -3.119 -2.326 20.234 1.00 13.77 H new ATOM 0 HD22 LEU A 624 -3.986 -1.611 19.119 1.00 13.77 H new ATOM 0 HD23 LEU A 624 -2.484 -2.011 18.818 1.00 13.77 H new ATOM 1788 N VAL A 625 -1.118 0.956 15.597 1.00 11.46 N ATOM 1789 CA VAL A 625 -0.667 1.858 14.550 1.00 11.08 C ATOM 1790 C VAL A 625 -1.729 2.515 13.687 1.00 9.97 C ATOM 1791 O VAL A 625 -2.622 1.847 13.170 1.00 11.63 O ATOM 1792 CB VAL A 625 0.313 1.128 13.578 1.00 10.87 C ATOM 1793 CG1 VAL A 625 1.090 2.150 12.764 1.00 11.33 C ATOM 1794 CG2 VAL A 625 1.260 0.216 14.355 1.00 11.17 C ATOM 0 H VAL A 625 -1.331 0.172 15.314 1.00 11.46 H new ATOM 0 HA VAL A 625 -0.252 2.570 15.062 1.00 11.08 H new ATOM 0 HB VAL A 625 -0.201 0.574 12.970 1.00 10.87 H new ATOM 0 HG11 VAL A 625 1.697 1.691 12.162 1.00 11.33 H new ATOM 0 HG12 VAL A 625 0.472 2.691 12.248 1.00 11.33 H new ATOM 0 HG13 VAL A 625 1.598 2.721 13.361 1.00 11.33 H new ATOM 0 HG21 VAL A 625 1.861 -0.229 13.737 1.00 11.17 H new ATOM 0 HG22 VAL A 625 1.776 0.745 14.983 1.00 11.17 H new ATOM 0 HG23 VAL A 625 0.745 -0.448 14.839 1.00 11.17 H new ATOM 1795 N ASP A 626 -1.581 3.827 13.538 1.00 10.54 N ATOM 1796 CA ASP A 626 -2.440 4.671 12.713 1.00 11.63 C ATOM 1797 C ASP A 626 -1.485 5.082 11.586 1.00 12.48 C ATOM 1798 O ASP A 626 -0.689 6.021 11.734 1.00 13.91 O ATOM 1799 CB ASP A 626 -2.889 5.894 13.515 1.00 9.63 C ATOM 1800 CG ASP A 626 -3.733 6.862 12.698 1.00 10.95 C ATOM 1801 OD1 ASP A 626 -3.969 6.592 11.499 1.00 12.48 O ATOM 1802 OD2 ASP A 626 -4.157 7.901 13.254 1.00 10.93 O ATOM 0 H ASP A 626 -0.954 4.267 13.929 1.00 10.54 H new ATOM 0 HA ASP A 626 -3.250 4.239 12.400 1.00 11.63 H new ATOM 0 HB2 ASP A 626 -3.398 5.600 14.286 1.00 9.63 H new ATOM 0 HB3 ASP A 626 -2.107 6.359 13.852 1.00 9.63 H new ATOM 1803 N LEU A 627 -1.557 4.369 10.467 1.00 11.08 N ATOM 1804 CA LEU A 627 -0.661 4.616 9.335 1.00 10.76 C ATOM 1805 C LEU A 627 -0.832 5.915 8.549 1.00 11.80 C ATOM 1806 O LEU A 627 -1.805 6.650 8.717 1.00 13.38 O ATOM 1807 CB LEU A 627 -0.714 3.424 8.372 1.00 10.95 C ATOM 1808 CG LEU A 627 -0.358 2.055 8.963 1.00 11.48 C ATOM 1809 CD1 LEU A 627 -0.853 0.939 8.070 1.00 12.18 C ATOM 1810 CD2 LEU A 627 1.162 1.961 9.130 1.00 11.04 C ATOM 0 H LEU A 627 -2.121 3.732 10.340 1.00 11.08 H new ATOM 0 HA LEU A 627 0.205 4.726 9.757 1.00 10.76 H new ATOM 0 HB2 LEU A 627 -1.609 3.372 8.001 1.00 10.95 H new ATOM 0 HB3 LEU A 627 -0.111 3.603 7.633 1.00 10.95 H new ATOM 0 HG LEU A 627 -0.789 1.961 9.827 1.00 11.48 H new ATOM 0 HD11 LEU A 627 -0.618 0.083 8.461 1.00 12.18 H new ATOM 0 HD12 LEU A 627 -1.817 0.999 7.980 1.00 12.18 H new ATOM 0 HD13 LEU A 627 -0.442 1.018 7.195 1.00 12.18 H new ATOM 0 HD21 LEU A 627 1.394 1.096 9.504 1.00 11.04 H new ATOM 0 HD22 LEU A 627 1.590 2.064 8.266 1.00 11.04 H new ATOM 0 HD23 LEU A 627 1.466 2.663 9.727 1.00 11.04 H new ATOM 1811 N ALA A 628 0.153 6.207 7.707 1.00 10.70 N ATOM 1812 CA ALA A 628 0.118 7.394 6.861 1.00 11.24 C ATOM 1813 C ALA A 628 -0.865 7.055 5.748 1.00 10.64 C ATOM 1814 O ALA A 628 -1.021 5.882 5.405 1.00 9.59 O ATOM 1815 CB ALA A 628 1.491 7.661 6.271 1.00 11.56 C ATOM 0 H ALA A 628 0.858 5.724 7.610 1.00 10.70 H new ATOM 0 HA ALA A 628 -0.142 8.186 7.357 1.00 11.24 H new ATOM 0 HB1 ALA A 628 1.454 8.452 5.711 1.00 11.56 H new ATOM 0 HB2 ALA A 628 2.130 7.802 6.988 1.00 11.56 H new ATOM 0 HB3 ALA A 628 1.768 6.900 5.737 1.00 11.56 H new ATOM 1816 N GLY A 629 -1.520 8.072 5.195 1.00 14.00 N ATOM 1817 CA GLY A 629 -2.484 7.840 4.128 1.00 16.25 C ATOM 1818 C GLY A 629 -1.890 7.081 2.954 1.00 17.35 C ATOM 1819 O GLY A 629 -0.793 7.397 2.488 1.00 18.07 O ATOM 0 H GLY A 629 -1.421 8.896 5.421 1.00 14.00 H new ATOM 0 HA2 GLY A 629 -3.238 7.343 4.481 1.00 16.25 H new ATOM 0 HA3 GLY A 629 -2.827 8.692 3.817 1.00 16.25 H new ATOM 1820 N SER A 630 -2.619 6.079 2.472 1.00 15.92 N ATOM 1821 CA SER A 630 -2.175 5.252 1.352 1.00 15.89 C ATOM 1822 C SER A 630 -2.536 5.799 -0.037 1.00 15.49 C ATOM 1823 O SER A 630 -2.198 5.185 -1.042 1.00 15.58 O ATOM 1824 CB SER A 630 -2.767 3.845 1.485 1.00 15.89 C ATOM 1825 OG SER A 630 -4.194 3.894 1.491 1.00 13.95 O ATOM 0 H SER A 630 -3.388 5.858 2.786 1.00 15.92 H new ATOM 0 HA SER A 630 -1.206 5.248 1.406 1.00 15.89 H new ATOM 0 HB2 SER A 630 -2.461 3.290 0.750 1.00 15.89 H new ATOM 0 HB3 SER A 630 -2.450 3.432 2.303 1.00 15.89 H new ATOM 0 HG SER A 630 -4.500 3.131 1.666 1.00 13.95 H new ATOM 1826 N GLU A 631 -3.208 6.943 -0.092 1.00 18.24 N ATOM 1827 CA GLU A 631 -3.632 7.509 -1.367 1.00 20.18 C ATOM 1828 C GLU A 631 -2.509 7.768 -2.371 1.00 23.78 C ATOM 1829 O GLU A 631 -1.403 8.168 -2.006 1.00 22.50 O ATOM 1830 CB GLU A 631 -4.420 8.804 -1.128 1.00 15.86 C ATOM 1831 CG GLU A 631 -3.613 9.908 -0.471 1.00 14.88 C ATOM 1832 CD GLU A 631 -3.822 9.956 1.033 1.00 11.30 C ATOM 1833 OE1 GLU A 631 -4.087 8.896 1.629 1.00 12.16 O ATOM 1834 OE2 GLU A 631 -3.725 11.049 1.618 1.00 14.10 O ATOM 0 H GLU A 631 -3.429 7.407 0.597 1.00 18.24 H new ATOM 0 HA GLU A 631 -4.190 6.828 -1.774 1.00 20.18 H new ATOM 0 HB2 GLU A 631 -4.759 9.126 -1.978 1.00 15.86 H new ATOM 0 HB3 GLU A 631 -5.190 8.605 -0.572 1.00 15.86 H new ATOM 0 HG2 GLU A 631 -2.671 9.774 -0.661 1.00 14.88 H new ATOM 0 HG3 GLU A 631 -3.862 10.762 -0.858 1.00 14.88 H new ATOM 1835 N ARG A 632 -2.816 7.524 -3.643 1.00 25.11 N ATOM 1836 CA ARG A 632 -1.879 7.752 -4.740 1.00 27.91 C ATOM 1837 C ARG A 632 -1.771 9.254 -4.993 1.00 27.39 C ATOM 1838 O ARG A 632 -0.784 9.895 -4.637 1.00 28.54 O ATOM 1839 CB ARG A 632 -2.372 7.073 -6.023 1.00 32.54 C ATOM 1840 CG ARG A 632 -2.000 5.609 -6.158 1.00 42.10 C ATOM 1841 CD ARG A 632 -2.161 5.127 -7.605 1.00 50.25 C ATOM 1842 NE ARG A 632 -3.473 4.528 -7.852 1.00 57.06 N ATOM 1843 CZ ARG A 632 -4.324 4.945 -8.786 1.00 59.39 C ATOM 1844 NH1 ARG A 632 -4.002 5.968 -9.568 1.00 60.67 N ATOM 1845 NH2 ARG A 632 -5.499 4.340 -8.935 1.00 59.76 N ATOM 0 H ARG A 632 -3.580 7.219 -3.895 1.00 25.11 H new ATOM 0 HA ARG A 632 -1.017 7.380 -4.497 1.00 27.91 H new ATOM 0 HB2 ARG A 632 -3.338 7.152 -6.064 1.00 32.54 H new ATOM 0 HB3 ARG A 632 -2.015 7.555 -6.785 1.00 32.54 H new ATOM 0 HG2 ARG A 632 -1.083 5.478 -5.871 1.00 42.10 H new ATOM 0 HG3 ARG A 632 -2.560 5.075 -5.572 1.00 42.10 H new ATOM 0 HD2 ARG A 632 -2.031 5.875 -8.209 1.00 50.25 H new ATOM 0 HD3 ARG A 632 -1.469 4.478 -7.806 1.00 50.25 H new ATOM 0 HE ARG A 632 -3.710 3.863 -7.361 1.00 57.06 H new ATOM 0 HH11 ARG A 632 -3.243 6.361 -9.471 1.00 60.67 H new ATOM 0 HH12 ARG A 632 -4.552 6.238 -10.172 1.00 60.67 H new ATOM 0 HH21 ARG A 632 -5.709 3.678 -8.427 1.00 59.76 H new ATOM 0 HH22 ARG A 632 -6.048 4.610 -9.539 1.00 59.76 H new ATOM 1846 N ARG A 642 8.177 17.367 -2.156 1.00 64.76 N ATOM 1847 CA ARG A 642 8.007 16.249 -1.242 1.00 63.17 C ATOM 1848 C ARG A 642 7.894 14.961 -2.012 1.00 60.97 C ATOM 1849 O ARG A 642 7.107 14.075 -1.659 1.00 61.65 O ATOM 1850 CB ARG A 642 6.759 16.469 -0.377 1.00 66.46 C ATOM 1851 CG ARG A 642 5.456 16.590 -1.160 1.00 69.37 C ATOM 1852 CD ARG A 642 4.403 15.607 -0.625 1.00 72.64 C ATOM 1853 NE ARG A 642 3.312 16.280 0.076 1.00 75.22 N ATOM 1854 CZ ARG A 642 2.623 17.308 -0.411 1.00 76.47 C ATOM 1855 NH1 ARG A 642 2.913 17.794 -1.617 1.00 77.18 N ATOM 1856 NH2 ARG A 642 1.658 17.862 0.305 1.00 77.03 N ATOM 0 HA ARG A 642 8.783 16.192 -0.662 1.00 63.17 H new ATOM 0 HB2 ARG A 642 6.679 15.732 0.248 1.00 66.46 H new ATOM 0 HB3 ARG A 642 6.882 17.275 0.149 1.00 66.46 H new ATOM 0 HG2 ARG A 642 5.119 17.497 -1.097 1.00 69.37 H new ATOM 0 HG3 ARG A 642 5.621 16.414 -2.099 1.00 69.37 H new ATOM 0 HD2 ARG A 642 4.040 15.093 -1.363 1.00 72.64 H new ATOM 0 HD3 ARG A 642 4.830 14.977 -0.023 1.00 72.64 H new ATOM 0 HE ARG A 642 3.101 15.991 0.858 1.00 75.22 H new ATOM 0 HH11 ARG A 642 3.546 17.443 -2.081 1.00 77.18 H new ATOM 0 HH12 ARG A 642 2.467 18.459 -1.931 1.00 77.18 H new ATOM 0 HH21 ARG A 642 1.475 17.557 1.088 1.00 77.03 H new ATOM 0 HH22 ARG A 642 1.214 18.527 -0.013 1.00 77.03 H new ATOM 1857 N LEU A 643 8.661 14.834 -3.087 1.00 57.78 N ATOM 1858 CA LEU A 643 8.618 13.604 -3.883 1.00 54.30 C ATOM 1859 C LEU A 643 9.346 12.446 -3.154 1.00 50.65 C ATOM 1860 O LEU A 643 8.856 11.337 -3.141 1.00 50.23 O ATOM 1861 CB LEU A 643 9.267 13.818 -5.240 1.00 55.59 C ATOM 1862 CG LEU A 643 8.767 12.795 -6.264 1.00 57.48 C ATOM 1863 CD1 LEU A 643 7.902 13.476 -7.334 1.00 59.17 C ATOM 1864 CD2 LEU A 643 9.957 12.097 -6.909 1.00 58.44 C ATOM 0 H LEU A 643 9.206 15.435 -3.373 1.00 57.78 H new ATOM 0 HA LEU A 643 7.685 13.369 -4.004 1.00 54.30 H new ATOM 0 HB2 LEU A 643 9.074 14.715 -5.555 1.00 55.59 H new ATOM 0 HB3 LEU A 643 10.231 13.749 -5.154 1.00 55.59 H new ATOM 0 HG LEU A 643 8.219 12.137 -5.809 1.00 57.48 H new ATOM 0 HD11 LEU A 643 7.595 12.813 -7.972 1.00 59.17 H new ATOM 0 HD12 LEU A 643 7.136 13.897 -6.912 1.00 59.17 H new ATOM 0 HD13 LEU A 643 8.427 14.149 -7.795 1.00 59.17 H new ATOM 0 HD21 LEU A 643 9.640 11.449 -7.558 1.00 58.44 H new ATOM 0 HD22 LEU A 643 10.515 12.754 -7.355 1.00 58.44 H new ATOM 0 HD23 LEU A 643 10.475 11.643 -6.226 1.00 58.44 H new ATOM 1865 N ARG A 644 10.526 12.719 -2.608 1.00 46.48 N ATOM 1866 CA ARG A 644 11.212 11.682 -1.883 1.00 41.04 C ATOM 1867 C ARG A 644 10.404 11.341 -0.641 1.00 38.12 C ATOM 1868 O ARG A 644 10.479 10.212 -0.107 1.00 38.02 O ATOM 1869 CB ARG A 644 12.631 12.135 -1.502 1.00 39.50 C ATOM 1870 CG ARG A 644 13.055 13.522 -2.050 1.00 39.90 C ATOM 1871 CD ARG A 644 14.055 13.479 -3.240 1.00 37.91 C ATOM 1872 NE ARG A 644 14.917 12.299 -3.245 1.00 36.46 N ATOM 1873 CZ ARG A 644 16.025 12.187 -3.975 1.00 28.99 C ATOM 1874 NH1 ARG A 644 16.396 13.181 -4.764 1.00 26.09 N ATOM 1875 NH2 ARG A 644 16.734 11.066 -3.956 1.00 28.87 N ATOM 0 H ARG A 644 10.930 13.477 -2.648 1.00 46.48 H new ATOM 0 HA ARG A 644 11.297 10.894 -2.442 1.00 41.04 H new ATOM 0 HB2 ARG A 644 12.700 12.151 -0.535 1.00 39.50 H new ATOM 0 HB3 ARG A 644 13.263 11.471 -1.820 1.00 39.50 H new ATOM 0 HG2 ARG A 644 12.260 14.001 -2.330 1.00 39.90 H new ATOM 0 HG3 ARG A 644 13.454 14.032 -1.328 1.00 39.90 H new ATOM 0 HD2 ARG A 644 13.556 13.508 -4.072 1.00 37.91 H new ATOM 0 HD3 ARG A 644 14.610 14.274 -3.214 1.00 37.91 H new ATOM 0 HE ARG A 644 14.695 11.635 -2.745 1.00 36.46 H new ATOM 0 HH11 ARG A 644 15.922 13.898 -4.805 1.00 26.09 H new ATOM 0 HH12 ARG A 644 17.111 13.111 -5.236 1.00 26.09 H new ATOM 0 HH21 ARG A 644 16.479 10.404 -3.470 1.00 28.87 H new ATOM 0 HH22 ARG A 644 17.449 11.001 -4.430 1.00 28.87 H new ATOM 1876 N GLU A 645 9.679 12.318 -0.105 1.00 34.86 N ATOM 1877 CA GLU A 645 8.836 12.106 1.088 1.00 33.38 C ATOM 1878 C GLU A 645 7.640 11.198 0.717 1.00 30.87 C ATOM 1879 O GLU A 645 7.309 10.257 1.441 1.00 30.30 O ATOM 1880 CB GLU A 645 8.297 13.444 1.614 1.00 34.81 C ATOM 1881 CG GLU A 645 6.994 13.326 2.404 1.00 39.29 C ATOM 1882 CD GLU A 645 6.725 14.535 3.271 1.00 40.80 C ATOM 1883 OE1 GLU A 645 7.683 15.083 3.858 1.00 44.35 O ATOM 1884 OE2 GLU A 645 5.554 14.948 3.358 1.00 42.61 O ATOM 0 H GLU A 645 9.656 13.120 -0.414 1.00 34.86 H new ATOM 0 HA GLU A 645 9.376 11.688 1.777 1.00 33.38 H new ATOM 0 HB2 GLU A 645 8.971 13.853 2.180 1.00 34.81 H new ATOM 0 HB3 GLU A 645 8.156 14.042 0.863 1.00 34.81 H new ATOM 0 HG2 GLU A 645 6.256 13.205 1.787 1.00 39.29 H new ATOM 0 HG3 GLU A 645 7.030 12.534 2.963 1.00 39.29 H new ATOM 1885 N THR A 646 6.988 11.488 -0.408 1.00 27.08 N ATOM 1886 CA THR A 646 5.859 10.680 -0.851 1.00 22.67 C ATOM 1887 C THR A 646 6.344 9.281 -1.169 1.00 22.91 C ATOM 1888 O THR A 646 5.604 8.307 -1.040 1.00 21.69 O ATOM 1889 CB THR A 646 5.216 11.271 -2.102 1.00 22.32 C ATOM 1890 OG1 THR A 646 4.621 12.533 -1.777 1.00 19.98 O ATOM 1891 CG2 THR A 646 4.155 10.341 -2.645 1.00 21.15 C ATOM 0 H THR A 646 7.184 12.146 -0.926 1.00 27.08 H new ATOM 0 HA THR A 646 5.199 10.662 -0.140 1.00 22.67 H new ATOM 0 HB THR A 646 5.901 11.391 -2.779 1.00 22.32 H new ATOM 0 HG1 THR A 646 5.219 13.121 -1.729 1.00 19.98 H new ATOM 0 HG21 THR A 646 3.757 10.732 -3.439 1.00 21.15 H new ATOM 0 HG22 THR A 646 4.557 9.488 -2.872 1.00 21.15 H new ATOM 0 HG23 THR A 646 3.468 10.206 -1.973 1.00 21.15 H new ATOM 1892 N GLN A 647 7.593 9.191 -1.611 1.00 21.11 N ATOM 1893 CA GLN A 647 8.179 7.900 -1.942 1.00 23.76 C ATOM 1894 C GLN A 647 8.433 7.152 -0.643 1.00 23.47 C ATOM 1895 O GLN A 647 8.356 5.922 -0.584 1.00 22.69 O ATOM 1896 CB GLN A 647 9.501 8.078 -2.699 1.00 27.73 C ATOM 1897 CG GLN A 647 9.425 7.775 -4.201 1.00 32.55 C ATOM 1898 CD GLN A 647 8.284 6.834 -4.566 1.00 35.40 C ATOM 1899 OE1 GLN A 647 8.471 5.618 -4.642 1.00 34.76 O ATOM 1900 NE2 GLN A 647 7.093 7.399 -4.798 1.00 38.63 N ATOM 0 H GLN A 647 8.116 9.864 -1.726 1.00 21.11 H new ATOM 0 HA GLN A 647 7.571 7.404 -2.513 1.00 23.76 H new ATOM 0 HB2 GLN A 647 9.807 8.991 -2.581 1.00 27.73 H new ATOM 0 HB3 GLN A 647 10.169 7.500 -2.298 1.00 27.73 H new ATOM 0 HG2 GLN A 647 9.319 8.607 -4.688 1.00 32.55 H new ATOM 0 HG3 GLN A 647 10.264 7.383 -4.489 1.00 32.55 H new ATOM 0 HE21 GLN A 647 7.002 8.252 -4.735 1.00 38.63 H new ATOM 0 HE22 GLN A 647 6.419 6.909 -5.010 1.00 38.63 H new ATOM 1901 N ASN A 648 8.745 7.915 0.397 1.00 24.48 N ATOM 1902 CA ASN A 648 9.004 7.355 1.718 1.00 24.21 C ATOM 1903 C ASN A 648 7.728 6.682 2.207 1.00 20.91 C ATOM 1904 O ASN A 648 7.725 5.502 2.535 1.00 19.64 O ATOM 1905 CB ASN A 648 9.397 8.469 2.690 1.00 27.49 C ATOM 1906 CG ASN A 648 10.901 8.666 2.784 1.00 31.26 C ATOM 1907 OD1 ASN A 648 11.681 7.745 2.528 1.00 33.72 O ATOM 1908 ND2 ASN A 648 11.315 9.875 3.157 1.00 31.64 N ATOM 0 H ASN A 648 8.813 8.771 0.358 1.00 24.48 H new ATOM 0 HA ASN A 648 9.730 6.713 1.670 1.00 24.21 H new ATOM 0 HB2 ASN A 648 8.983 9.300 2.408 1.00 27.49 H new ATOM 0 HB3 ASN A 648 9.046 8.263 3.571 1.00 27.49 H new ATOM 0 HD21 ASN A 648 12.156 10.039 3.228 1.00 31.64 H new ATOM 0 HD22 ASN A 648 10.741 10.492 3.327 1.00 31.64 H new ATOM 1909 N ILE A 649 6.645 7.451 2.250 1.00 20.48 N ATOM 1910 CA ILE A 649 5.359 6.929 2.692 1.00 18.54 C ATOM 1911 C ILE A 649 4.994 5.727 1.845 1.00 19.46 C ATOM 1912 O ILE A 649 4.640 4.672 2.367 1.00 21.27 O ATOM 1913 CB ILE A 649 4.240 7.973 2.550 1.00 19.25 C ATOM 1914 CG1 ILE A 649 4.482 9.128 3.519 1.00 18.46 C ATOM 1915 CG2 ILE A 649 2.887 7.326 2.837 1.00 18.96 C ATOM 1916 CD1 ILE A 649 3.964 10.454 3.038 1.00 17.53 C ATOM 0 H ILE A 649 6.635 8.281 2.026 1.00 20.48 H new ATOM 0 HA ILE A 649 5.443 6.690 3.628 1.00 18.54 H new ATOM 0 HB ILE A 649 4.240 8.317 1.643 1.00 19.25 H new ATOM 0 HG12 ILE A 649 4.064 8.917 4.368 1.00 18.46 H new ATOM 0 HG13 ILE A 649 5.435 9.205 3.684 1.00 18.46 H new ATOM 0 HG21 ILE A 649 2.185 7.989 2.746 1.00 18.96 H new ATOM 0 HG22 ILE A 649 2.733 6.604 2.207 1.00 18.96 H new ATOM 0 HG23 ILE A 649 2.882 6.973 3.740 1.00 18.96 H new ATOM 0 HD11 ILE A 649 4.153 11.136 3.702 1.00 17.53 H new ATOM 0 HD12 ILE A 649 4.398 10.688 2.203 1.00 17.53 H new ATOM 0 HD13 ILE A 649 3.006 10.396 2.898 1.00 17.53 H new ATOM 1917 N LYS A 650 5.094 5.894 0.531 1.00 19.23 N ATOM 1918 CA LYS A 650 4.761 4.837 -0.416 1.00 19.25 C ATOM 1919 C LYS A 650 5.545 3.545 -0.206 1.00 18.94 C ATOM 1920 O LYS A 650 4.962 2.463 -0.149 1.00 19.12 O ATOM 1921 CB LYS A 650 4.972 5.346 -1.846 1.00 22.57 C ATOM 1922 CG LYS A 650 3.682 5.530 -2.627 1.00 27.86 C ATOM 1923 CD LYS A 650 3.132 6.950 -2.530 1.00 31.01 C ATOM 1924 CE LYS A 650 1.955 7.136 -3.492 1.00 31.52 C ATOM 1925 NZ LYS A 650 1.830 8.524 -4.013 1.00 31.53 N ATOM 0 H LYS A 650 5.357 6.625 0.163 1.00 19.23 H new ATOM 0 HA LYS A 650 3.830 4.614 -0.262 1.00 19.25 H new ATOM 0 HB2 LYS A 650 5.444 6.193 -1.813 1.00 22.57 H new ATOM 0 HB3 LYS A 650 5.542 4.722 -2.322 1.00 22.57 H new ATOM 0 HG2 LYS A 650 3.838 5.311 -3.559 1.00 27.86 H new ATOM 0 HG3 LYS A 650 3.017 4.906 -2.297 1.00 27.86 H new ATOM 0 HD2 LYS A 650 2.845 7.130 -1.621 1.00 31.01 H new ATOM 0 HD3 LYS A 650 3.832 7.589 -2.739 1.00 31.01 H new ATOM 0 HE2 LYS A 650 2.057 6.526 -4.239 1.00 31.52 H new ATOM 0 HE3 LYS A 650 1.133 6.893 -3.037 1.00 31.52 H new ATOM 0 HZ1 LYS A 650 1.070 8.603 -4.470 1.00 31.53 H new ATOM 0 HZ2 LYS A 650 1.827 9.098 -3.333 1.00 31.53 H new ATOM 0 HZ3 LYS A 650 2.518 8.703 -4.549 1.00 31.53 H new ATOM 1926 N LYS A 651 6.865 3.651 -0.098 1.00 20.20 N ATOM 1927 CA LYS A 651 7.695 2.469 0.100 1.00 21.26 C ATOM 1928 C LYS A 651 7.511 1.856 1.489 1.00 19.33 C ATOM 1929 O LYS A 651 7.593 0.639 1.653 1.00 21.38 O ATOM 1930 CB LYS A 651 9.166 2.818 -0.111 1.00 25.18 C ATOM 1931 CG LYS A 651 9.489 3.264 -1.522 1.00 33.33 C ATOM 1932 CD LYS A 651 9.739 2.063 -2.423 1.00 39.18 C ATOM 1933 CE LYS A 651 8.435 1.437 -2.915 1.00 40.75 C ATOM 1934 NZ LYS A 651 8.352 1.436 -4.410 1.00 43.78 N ATOM 0 H LYS A 651 7.297 4.393 -0.136 1.00 20.20 H new ATOM 0 HA LYS A 651 7.412 1.811 -0.554 1.00 21.26 H new ATOM 0 HB2 LYS A 651 9.415 3.523 0.507 1.00 25.18 H new ATOM 0 HB3 LYS A 651 9.708 2.044 0.107 1.00 25.18 H new ATOM 0 HG2 LYS A 651 8.756 3.792 -1.875 1.00 33.33 H new ATOM 0 HG3 LYS A 651 10.272 3.836 -1.514 1.00 33.33 H new ATOM 0 HD2 LYS A 651 10.273 2.337 -3.185 1.00 39.18 H new ATOM 0 HD3 LYS A 651 10.254 1.398 -1.939 1.00 39.18 H new ATOM 0 HE2 LYS A 651 8.368 0.527 -2.586 1.00 40.75 H new ATOM 0 HE3 LYS A 651 7.682 1.927 -2.549 1.00 40.75 H new ATOM 0 HZ1 LYS A 651 7.503 1.346 -4.660 1.00 43.78 H new ATOM 0 HZ2 LYS A 651 8.674 2.203 -4.726 1.00 43.78 H new ATOM 0 HZ3 LYS A 651 8.830 0.758 -4.734 1.00 43.78 H new ATOM 1935 N SER A 652 7.276 2.694 2.493 1.00 17.57 N ATOM 1936 CA SER A 652 7.078 2.197 3.855 1.00 16.01 C ATOM 1937 C SER A 652 5.809 1.344 3.899 1.00 14.41 C ATOM 1938 O SER A 652 5.804 0.242 4.450 1.00 12.42 O ATOM 1939 CB SER A 652 6.954 3.367 4.830 1.00 14.97 C ATOM 1940 OG SER A 652 6.526 2.913 6.101 1.00 19.44 O ATOM 0 H SER A 652 7.227 3.549 2.410 1.00 17.57 H new ATOM 0 HA SER A 652 7.841 1.658 4.115 1.00 16.01 H new ATOM 0 HB2 SER A 652 7.809 3.817 4.913 1.00 14.97 H new ATOM 0 HB3 SER A 652 6.323 4.017 4.484 1.00 14.97 H new ATOM 0 HG SER A 652 6.872 2.165 6.263 1.00 19.44 H new ATOM 1941 N LEU A 653 4.735 1.857 3.305 1.00 14.28 N ATOM 1942 CA LEU A 653 3.464 1.127 3.266 1.00 12.95 C ATOM 1943 C LEU A 653 3.590 -0.141 2.436 1.00 11.30 C ATOM 1944 O LEU A 653 3.053 -1.186 2.798 1.00 13.06 O ATOM 1945 CB LEU A 653 2.357 2.021 2.697 1.00 14.36 C ATOM 1946 CG LEU A 653 1.913 3.146 3.636 1.00 14.50 C ATOM 1947 CD1 LEU A 653 0.870 4.001 2.935 1.00 14.07 C ATOM 1948 CD2 LEU A 653 1.357 2.548 4.933 1.00 10.47 C ATOM 0 H LEU A 653 4.718 2.625 2.918 1.00 14.28 H new ATOM 0 HA LEU A 653 3.232 0.875 4.174 1.00 12.95 H new ATOM 0 HB2 LEU A 653 2.666 2.411 1.865 1.00 14.36 H new ATOM 0 HB3 LEU A 653 1.588 1.470 2.483 1.00 14.36 H new ATOM 0 HG LEU A 653 2.671 3.707 3.864 1.00 14.50 H new ATOM 0 HD11 LEU A 653 0.586 4.715 3.527 1.00 14.07 H new ATOM 0 HD12 LEU A 653 1.252 4.382 2.129 1.00 14.07 H new ATOM 0 HD13 LEU A 653 0.105 3.452 2.701 1.00 14.07 H new ATOM 0 HD21 LEU A 653 1.077 3.263 5.525 1.00 10.47 H new ATOM 0 HD22 LEU A 653 0.597 1.982 4.728 1.00 10.47 H new ATOM 0 HD23 LEU A 653 2.045 2.020 5.367 1.00 10.47 H new ATOM 1949 N SER A 654 4.304 -0.052 1.318 1.00 14.13 N ATOM 1950 CA SER A 654 4.505 -1.222 0.481 1.00 13.86 C ATOM 1951 C SER A 654 5.347 -2.259 1.230 1.00 12.46 C ATOM 1952 O SER A 654 5.100 -3.463 1.141 1.00 10.69 O ATOM 1953 CB SER A 654 5.209 -0.831 -0.812 1.00 13.97 C ATOM 1954 OG SER A 654 5.687 -1.992 -1.460 1.00 20.53 O ATOM 0 H SER A 654 4.675 0.669 1.031 1.00 14.13 H new ATOM 0 HA SER A 654 3.639 -1.604 0.266 1.00 13.86 H new ATOM 0 HB2 SER A 654 4.596 -0.354 -1.393 1.00 13.97 H new ATOM 0 HB3 SER A 654 5.946 -0.229 -0.621 1.00 13.97 H new ATOM 0 HG SER A 654 6.074 -1.776 -2.174 1.00 20.53 H new ATOM 1955 N CYS A 655 6.340 -1.789 1.979 1.00 13.39 N ATOM 1956 CA CYS A 655 7.196 -2.696 2.731 1.00 12.10 C ATOM 1957 C CYS A 655 6.362 -3.450 3.755 1.00 10.86 C ATOM 1958 O CYS A 655 6.452 -4.671 3.863 1.00 12.17 O ATOM 1959 CB CYS A 655 8.308 -1.913 3.439 1.00 14.91 C ATOM 1960 SG CYS A 655 9.399 -2.948 4.440 1.00 20.02 S ATOM 0 H CYS A 655 6.533 -0.955 2.064 1.00 13.39 H new ATOM 0 HA CYS A 655 7.603 -3.328 2.118 1.00 12.10 H new ATOM 0 HB2 CYS A 655 8.838 -1.446 2.774 1.00 14.91 H new ATOM 0 HB3 CYS A 655 7.906 -1.237 4.007 1.00 14.91 H new ATOM 0 HG CYS A 655 9.614 -2.406 5.489 1.00 20.02 H new ATOM 1961 N LEU A 656 5.544 -2.714 4.504 1.00 12.92 N ATOM 1962 CA LEU A 656 4.690 -3.315 5.526 1.00 11.99 C ATOM 1963 C LEU A 656 3.856 -4.450 4.921 1.00 11.13 C ATOM 1964 O LEU A 656 3.726 -5.523 5.512 1.00 11.18 O ATOM 1965 CB LEU A 656 3.779 -2.240 6.143 1.00 14.01 C ATOM 1966 CG LEU A 656 2.771 -2.693 7.207 1.00 15.06 C ATOM 1967 CD1 LEU A 656 3.509 -3.311 8.384 1.00 17.70 C ATOM 1968 CD2 LEU A 656 1.934 -1.507 7.661 1.00 15.67 C ATOM 0 H LEU A 656 5.468 -1.860 4.435 1.00 12.92 H new ATOM 0 HA LEU A 656 5.248 -3.689 6.226 1.00 11.99 H new ATOM 0 HB2 LEU A 656 4.345 -1.558 6.538 1.00 14.01 H new ATOM 0 HB3 LEU A 656 3.285 -1.817 5.423 1.00 14.01 H new ATOM 0 HG LEU A 656 2.179 -3.361 6.828 1.00 15.06 H new ATOM 0 HD11 LEU A 656 2.868 -3.596 9.054 1.00 17.70 H new ATOM 0 HD12 LEU A 656 4.020 -4.077 8.080 1.00 17.70 H new ATOM 0 HD13 LEU A 656 4.110 -2.655 8.770 1.00 17.70 H new ATOM 0 HD21 LEU A 656 1.298 -1.798 8.333 1.00 15.67 H new ATOM 0 HD22 LEU A 656 2.514 -0.827 8.038 1.00 15.67 H new ATOM 0 HD23 LEU A 656 1.455 -1.139 6.902 1.00 15.67 H new ATOM 1969 N GLY A 657 3.312 -4.212 3.728 1.00 13.23 N ATOM 1970 CA GLY A 657 2.511 -5.224 3.063 1.00 12.00 C ATOM 1971 C GLY A 657 3.321 -6.460 2.735 1.00 13.28 C ATOM 1972 O GLY A 657 2.870 -7.588 2.947 1.00 11.14 O ATOM 0 H GLY A 657 3.397 -3.475 3.293 1.00 13.23 H new ATOM 0 HA2 GLY A 657 1.764 -5.469 3.631 1.00 12.00 H new ATOM 0 HA3 GLY A 657 2.138 -4.856 2.247 1.00 12.00 H new ATOM 1973 N ASP A 658 4.527 -6.250 2.208 1.00 15.55 N ATOM 1974 CA ASP A 658 5.409 -7.359 1.860 1.00 16.39 C ATOM 1975 C ASP A 658 5.654 -8.212 3.098 1.00 13.30 C ATOM 1976 O ASP A 658 5.581 -9.435 3.052 1.00 13.83 O ATOM 1977 CB ASP A 658 6.748 -6.825 1.336 1.00 18.48 C ATOM 1978 CG ASP A 658 6.632 -6.191 -0.040 1.00 22.62 C ATOM 1979 OD1 ASP A 658 5.759 -6.636 -0.819 1.00 26.83 O ATOM 1980 OD2 ASP A 658 7.411 -5.251 -0.342 1.00 22.47 O ATOM 0 H ASP A 658 4.852 -5.471 2.045 1.00 15.55 H new ATOM 0 HA ASP A 658 4.990 -7.894 1.168 1.00 16.39 H new ATOM 0 HB2 ASP A 658 7.097 -6.170 1.961 1.00 18.48 H new ATOM 0 HB3 ASP A 658 7.389 -7.552 1.299 1.00 18.48 H new ATOM 1981 N VAL A 659 5.930 -7.546 4.211 1.00 14.64 N ATOM 1982 CA VAL A 659 6.206 -8.223 5.469 1.00 16.41 C ATOM 1983 C VAL A 659 4.999 -8.989 6.015 1.00 17.29 C ATOM 1984 O VAL A 659 5.099 -10.172 6.343 1.00 16.08 O ATOM 1985 CB VAL A 659 6.710 -7.206 6.526 1.00 17.04 C ATOM 1986 CG1 VAL A 659 6.835 -7.863 7.885 1.00 17.19 C ATOM 1987 CG2 VAL A 659 8.045 -6.649 6.097 1.00 13.38 C ATOM 0 H VAL A 659 5.963 -6.688 4.258 1.00 14.64 H new ATOM 0 HA VAL A 659 6.897 -8.879 5.285 1.00 16.41 H new ATOM 0 HB VAL A 659 6.066 -6.484 6.595 1.00 17.04 H new ATOM 0 HG11 VAL A 659 7.151 -7.212 8.531 1.00 17.19 H new ATOM 0 HG12 VAL A 659 5.969 -8.200 8.163 1.00 17.19 H new ATOM 0 HG13 VAL A 659 7.466 -8.598 7.832 1.00 17.19 H new ATOM 0 HG21 VAL A 659 8.358 -6.013 6.759 1.00 13.38 H new ATOM 0 HG22 VAL A 659 8.686 -7.372 6.015 1.00 13.38 H new ATOM 0 HG23 VAL A 659 7.950 -6.203 5.241 1.00 13.38 H new ATOM 1988 N ILE A 660 3.856 -8.325 6.117 1.00 20.37 N ATOM 1989 CA ILE A 660 2.675 -9.007 6.627 1.00 21.20 C ATOM 1990 C ILE A 660 2.350 -10.193 5.729 1.00 21.36 C ATOM 1991 O ILE A 660 2.082 -11.295 6.209 1.00 23.38 O ATOM 1992 CB ILE A 660 1.461 -8.066 6.694 1.00 21.87 C ATOM 1993 CG1 ILE A 660 1.785 -6.859 7.569 1.00 21.92 C ATOM 1994 CG2 ILE A 660 0.266 -8.798 7.300 1.00 22.07 C ATOM 1995 CD1 ILE A 660 2.154 -7.228 8.986 1.00 25.90 C ATOM 0 H ILE A 660 3.743 -7.500 5.903 1.00 20.37 H new ATOM 0 HA ILE A 660 2.868 -9.310 7.528 1.00 21.20 H new ATOM 0 HB ILE A 660 1.248 -7.774 5.794 1.00 21.87 H new ATOM 0 HG12 ILE A 660 2.518 -6.365 7.169 1.00 21.92 H new ATOM 0 HG13 ILE A 660 1.018 -6.265 7.586 1.00 21.92 H new ATOM 0 HG21 ILE A 660 -0.495 -8.198 7.339 1.00 22.07 H new ATOM 0 HG22 ILE A 660 0.044 -9.566 6.751 1.00 22.07 H new ATOM 0 HG23 ILE A 660 0.489 -9.095 8.196 1.00 22.07 H new ATOM 0 HD11 ILE A 660 2.348 -6.422 9.490 1.00 25.90 H new ATOM 0 HD12 ILE A 660 1.414 -7.698 9.401 1.00 25.90 H new ATOM 0 HD13 ILE A 660 2.937 -7.800 8.978 1.00 25.90 H new ATOM 1996 N HIS A 661 2.393 -9.974 4.422 1.00 21.08 N ATOM 1997 CA HIS A 661 2.099 -11.042 3.477 1.00 21.66 C ATOM 1998 C HIS A 661 3.081 -12.181 3.651 1.00 20.26 C ATOM 1999 O HIS A 661 2.684 -13.338 3.790 1.00 19.81 O ATOM 2000 CB HIS A 661 2.167 -10.532 2.036 1.00 24.05 C ATOM 2001 CG HIS A 661 2.237 -11.629 1.019 1.00 29.24 C ATOM 2002 ND1 HIS A 661 1.165 -11.980 0.228 1.00 31.57 N ATOM 2003 CD2 HIS A 661 3.249 -12.461 0.673 1.00 30.90 C ATOM 2004 CE1 HIS A 661 1.511 -12.982 -0.559 1.00 32.39 C ATOM 2005 NE2 HIS A 661 2.771 -13.293 -0.310 1.00 33.99 N ATOM 0 H HIS A 661 2.589 -9.218 4.062 1.00 21.08 H new ATOM 0 HA HIS A 661 1.200 -11.358 3.656 1.00 21.66 H new ATOM 0 HB2 HIS A 661 1.387 -9.984 1.857 1.00 24.05 H new ATOM 0 HB3 HIS A 661 2.944 -9.960 1.939 1.00 24.05 H new ATOM 0 HD1 HIS A 661 0.391 -11.605 0.244 1.00 31.57 H new ATOM 0 HD2 HIS A 661 4.106 -12.468 1.033 1.00 30.90 H new ATOM 0 HE1 HIS A 661 0.961 -13.398 -1.183 1.00 32.39 H new ATOM 0 HE2 HIS A 661 3.219 -13.915 -0.700 1.00 33.99 H new ATOM 2006 N ALA A 662 4.368 -11.846 3.632 1.00 22.68 N ATOM 2007 CA ALA A 662 5.422 -12.840 3.788 1.00 23.67 C ATOM 2008 C ALA A 662 5.201 -13.632 5.061 1.00 24.54 C ATOM 2009 O ALA A 662 5.373 -14.850 5.081 1.00 25.25 O ATOM 2010 CB ALA A 662 6.788 -12.162 3.827 1.00 21.81 C ATOM 0 H ALA A 662 4.652 -11.041 3.529 1.00 22.68 H new ATOM 0 HA ALA A 662 5.396 -13.444 3.029 1.00 23.67 H new ATOM 0 HB1 ALA A 662 7.480 -12.834 3.931 1.00 21.81 H new ATOM 0 HB2 ALA A 662 6.932 -11.676 3.000 1.00 21.81 H new ATOM 0 HB3 ALA A 662 6.822 -11.545 4.575 1.00 21.81 H new ATOM 2011 N LEU A 663 4.815 -12.929 6.121 1.00 26.99 N ATOM 2012 CA LEU A 663 4.572 -13.549 7.416 1.00 30.54 C ATOM 2013 C LEU A 663 3.420 -14.549 7.366 1.00 34.48 C ATOM 2014 O LEU A 663 3.418 -15.540 8.101 1.00 35.06 O ATOM 2015 CB LEU A 663 4.275 -12.472 8.465 1.00 29.99 C ATOM 2016 CG LEU A 663 5.476 -11.663 8.965 1.00 29.58 C ATOM 2017 CD1 LEU A 663 5.001 -10.577 9.915 1.00 29.06 C ATOM 2018 CD2 LEU A 663 6.463 -12.586 9.656 1.00 27.16 C ATOM 0 H LEU A 663 4.687 -12.079 6.108 1.00 26.99 H new ATOM 0 HA LEU A 663 5.375 -14.035 7.660 1.00 30.54 H new ATOM 0 HB2 LEU A 663 3.626 -11.855 8.093 1.00 29.99 H new ATOM 0 HB3 LEU A 663 3.856 -12.898 9.229 1.00 29.99 H new ATOM 0 HG LEU A 663 5.921 -11.243 8.213 1.00 29.58 H new ATOM 0 HD11 LEU A 663 5.763 -10.066 10.230 1.00 29.06 H new ATOM 0 HD12 LEU A 663 4.387 -9.987 9.451 1.00 29.06 H new ATOM 0 HD13 LEU A 663 4.550 -10.983 10.671 1.00 29.06 H new ATOM 0 HD21 LEU A 663 7.222 -12.071 9.971 1.00 27.16 H new ATOM 0 HD22 LEU A 663 6.030 -13.017 10.409 1.00 27.16 H new ATOM 0 HD23 LEU A 663 6.769 -13.261 9.030 1.00 27.16 H new ATOM 2019 N GLY A 664 2.443 -14.286 6.501 1.00 37.64 N ATOM 2020 CA GLY A 664 1.304 -15.178 6.378 1.00 42.33 C ATOM 2021 C GLY A 664 1.638 -16.412 5.564 1.00 46.34 C ATOM 2022 O GLY A 664 0.889 -17.386 5.550 1.00 46.27 O ATOM 0 H GLY A 664 2.424 -13.601 5.982 1.00 37.64 H new ATOM 0 HA2 GLY A 664 1.006 -15.445 7.262 1.00 42.33 H new ATOM 0 HA3 GLY A 664 0.567 -14.705 5.961 1.00 42.33 H new ATOM 2023 N GLN A 665 2.776 -16.363 4.882 1.00 51.13 N ATOM 2024 CA GLN A 665 3.241 -17.466 4.052 1.00 55.78 C ATOM 2025 C GLN A 665 3.686 -18.660 4.890 1.00 58.68 C ATOM 2026 O GLN A 665 4.180 -18.499 6.008 1.00 59.35 O ATOM 2027 CB GLN A 665 4.417 -17.006 3.188 1.00 56.94 C ATOM 2028 CG GLN A 665 4.288 -17.369 1.729 1.00 60.06 C ATOM 2029 CD GLN A 665 3.284 -16.496 1.014 1.00 61.13 C ATOM 2030 OE1 GLN A 665 3.650 -15.513 0.377 1.00 62.49 O ATOM 2031 NE2 GLN A 665 2.006 -16.849 1.118 1.00 62.45 N ATOM 0 H GLN A 665 3.304 -15.684 4.888 1.00 51.13 H new ATOM 0 HA GLN A 665 2.497 -17.742 3.495 1.00 55.78 H new ATOM 0 HB2 GLN A 665 4.506 -16.043 3.265 1.00 56.94 H new ATOM 0 HB3 GLN A 665 5.234 -17.395 3.537 1.00 56.94 H new ATOM 0 HG2 GLN A 665 5.153 -17.285 1.298 1.00 60.06 H new ATOM 0 HG3 GLN A 665 4.021 -18.298 1.650 1.00 60.06 H new ATOM 0 HE21 GLN A 665 1.788 -17.545 1.574 1.00 62.45 H new ATOM 0 HE22 GLN A 665 1.398 -16.381 0.730 1.00 62.45 H new ATOM 2032 N PRO A 666 3.510 -19.883 4.357 1.00 60.98 N ATOM 2033 CA PRO A 666 3.910 -21.098 5.076 1.00 62.18 C ATOM 2034 C PRO A 666 5.433 -21.293 5.061 1.00 63.21 C ATOM 2035 O PRO A 666 6.023 -21.796 6.022 1.00 64.10 O ATOM 2036 CB PRO A 666 3.177 -22.224 4.329 1.00 62.01 C ATOM 2037 CG PRO A 666 2.276 -21.540 3.322 1.00 61.43 C ATOM 2038 CD PRO A 666 2.889 -20.201 3.063 1.00 61.11 C ATOM 0 HA PRO A 666 3.678 -21.068 6.017 1.00 62.18 H new ATOM 0 HB2 PRO A 666 3.807 -22.814 3.887 1.00 62.01 H new ATOM 0 HB3 PRO A 666 2.660 -22.769 4.943 1.00 62.01 H new ATOM 0 HG2 PRO A 666 2.214 -22.057 2.504 1.00 61.43 H new ATOM 0 HG3 PRO A 666 1.375 -21.448 3.669 1.00 61.43 H new ATOM 0 HD2 PRO A 666 3.542 -20.235 2.347 1.00 61.11 H new ATOM 0 HD3 PRO A 666 2.224 -19.542 2.809 1.00 61.11 H new ATOM 2039 N HIS A 672 12.702 -14.756 3.604 1.00 43.28 N ATOM 2040 CA HIS A 672 13.433 -13.598 4.109 1.00 43.75 C ATOM 2041 C HIS A 672 12.512 -12.394 4.257 1.00 41.09 C ATOM 2042 O HIS A 672 12.392 -11.583 3.341 1.00 43.10 O ATOM 2043 CB HIS A 672 14.574 -13.215 3.160 1.00 47.87 C ATOM 2044 CG HIS A 672 15.552 -14.317 2.899 1.00 53.80 C ATOM 2045 ND1 HIS A 672 15.392 -15.661 2.838 1.00 55.49 N flip ATOM 2046 CD2 HIS A 672 16.884 -14.077 2.629 1.00 55.58 C flip ATOM 2047 CE1 HIS A 672 16.618 -16.202 2.534 1.00 56.69 C flip ATOM 2048 NE2 HIS A 672 17.501 -15.225 2.413 1.00 56.59 N flip ATOM 0 HA HIS A 672 13.793 -13.844 4.975 1.00 43.75 H new ATOM 0 HB2 HIS A 672 14.195 -12.926 2.315 1.00 47.87 H new ATOM 0 HB3 HIS A 672 15.049 -12.456 3.532 1.00 47.87 H new ATOM 0 HD1 HIS A 672 14.660 -16.094 2.966 1.00 55.49 H new ATOM 0 HD2 HIS A 672 17.285 -13.238 2.603 1.00 55.58 H new ATOM 0 HE1 HIS A 672 16.798 -17.109 2.430 1.00 56.69 H new ATOM 2049 N ILE A 673 11.858 -12.275 5.404 1.00 37.18 N ATOM 2050 CA ILE A 673 10.974 -11.150 5.647 1.00 32.55 C ATOM 2051 C ILE A 673 11.834 -9.882 5.651 1.00 29.97 C ATOM 2052 O ILE A 673 12.785 -9.775 6.425 1.00 31.46 O ATOM 2053 CB ILE A 673 10.273 -11.296 7.011 1.00 32.07 C ATOM 2054 CG1 ILE A 673 9.924 -12.767 7.259 1.00 32.18 C ATOM 2055 CG2 ILE A 673 9.044 -10.410 7.072 1.00 32.98 C ATOM 2056 CD1 ILE A 673 8.735 -13.285 6.474 1.00 31.38 C ATOM 0 H ILE A 673 11.913 -12.836 6.054 1.00 37.18 H new ATOM 0 HA ILE A 673 10.291 -11.110 4.959 1.00 32.55 H new ATOM 0 HB ILE A 673 10.874 -11.006 7.715 1.00 32.07 H new ATOM 0 HG12 ILE A 673 10.698 -13.310 7.043 1.00 32.18 H new ATOM 0 HG13 ILE A 673 9.747 -12.888 8.205 1.00 32.18 H new ATOM 0 HG21 ILE A 673 8.614 -10.512 7.935 1.00 32.98 H new ATOM 0 HG22 ILE A 673 9.306 -9.484 6.949 1.00 32.98 H new ATOM 0 HG23 ILE A 673 8.425 -10.666 6.370 1.00 32.98 H new ATOM 0 HD11 ILE A 673 8.586 -14.219 6.691 1.00 31.38 H new ATOM 0 HD12 ILE A 673 7.946 -12.770 6.704 1.00 31.38 H new ATOM 0 HD13 ILE A 673 8.911 -13.198 5.524 1.00 31.38 H new ATOM 2057 N PRO A 674 11.521 -8.911 4.771 1.00 26.24 N ATOM 2058 CA PRO A 674 12.280 -7.652 4.690 1.00 23.46 C ATOM 2059 C PRO A 674 12.038 -6.631 5.814 1.00 19.09 C ATOM 2060 O PRO A 674 11.773 -5.465 5.547 1.00 16.95 O ATOM 2061 CB PRO A 674 11.883 -7.090 3.321 1.00 22.82 C ATOM 2062 CG PRO A 674 10.497 -7.613 3.102 1.00 24.36 C ATOM 2063 CD PRO A 674 10.436 -8.971 3.776 1.00 24.91 C ATOM 0 HA PRO A 674 13.227 -7.831 4.799 1.00 23.46 H new ATOM 0 HB2 PRO A 674 11.901 -6.120 3.316 1.00 22.82 H new ATOM 0 HB3 PRO A 674 12.489 -7.389 2.625 1.00 22.82 H new ATOM 0 HG2 PRO A 674 9.837 -7.010 3.480 1.00 24.36 H new ATOM 0 HG3 PRO A 674 10.303 -7.689 2.155 1.00 24.36 H new ATOM 0 HD2 PRO A 674 9.575 -9.123 4.196 1.00 24.91 H new ATOM 0 HD3 PRO A 674 10.573 -9.691 3.141 1.00 24.91 H new ATOM 2064 N PHE A 675 12.158 -7.066 7.067 1.00 18.86 N ATOM 2065 CA PHE A 675 11.942 -6.179 8.214 1.00 16.18 C ATOM 2066 C PHE A 675 12.777 -4.906 8.200 1.00 13.74 C ATOM 2067 O PHE A 675 12.285 -3.814 8.480 1.00 13.43 O ATOM 2068 CB PHE A 675 12.263 -6.904 9.523 1.00 15.96 C ATOM 2069 CG PHE A 675 11.314 -8.001 9.863 1.00 15.32 C ATOM 2070 CD1 PHE A 675 10.015 -7.710 10.280 1.00 16.89 C ATOM 2071 CD2 PHE A 675 11.716 -9.328 9.770 1.00 12.90 C ATOM 2072 CE1 PHE A 675 9.122 -8.738 10.599 1.00 17.31 C ATOM 2073 CE2 PHE A 675 10.842 -10.361 10.083 1.00 16.57 C ATOM 2074 CZ PHE A 675 9.535 -10.065 10.500 1.00 16.24 C ATOM 0 H PHE A 675 12.364 -7.874 7.277 1.00 18.86 H new ATOM 0 HA PHE A 675 11.007 -5.929 8.148 1.00 16.18 H new ATOM 0 HB2 PHE A 675 13.159 -7.271 9.466 1.00 15.96 H new ATOM 0 HB3 PHE A 675 12.267 -6.258 10.246 1.00 15.96 H new ATOM 0 HD1 PHE A 675 9.740 -6.824 10.347 1.00 16.89 H new ATOM 0 HD2 PHE A 675 12.582 -9.527 9.495 1.00 12.90 H new ATOM 0 HE1 PHE A 675 8.257 -8.537 10.876 1.00 17.31 H new ATOM 0 HE2 PHE A 675 11.122 -11.245 10.017 1.00 16.57 H new ATOM 0 HZ PHE A 675 8.946 -10.753 10.710 1.00 16.24 H new ATOM 2075 N ARG A 676 14.058 -5.056 7.892 1.00 15.17 N ATOM 2076 CA ARG A 676 14.974 -3.931 7.911 1.00 14.29 C ATOM 2077 C ARG A 676 14.809 -2.936 6.782 1.00 16.65 C ATOM 2078 O ARG A 676 15.495 -1.914 6.753 1.00 16.74 O ATOM 2079 CB ARG A 676 16.405 -4.461 7.947 1.00 13.30 C ATOM 2080 CG ARG A 676 16.555 -5.700 8.807 1.00 12.88 C ATOM 2081 CD ARG A 676 18.016 -6.111 8.986 1.00 15.12 C ATOM 2082 NE ARG A 676 18.878 -4.969 9.270 1.00 16.29 N ATOM 2083 CZ ARG A 676 19.451 -4.746 10.445 1.00 16.66 C ATOM 2084 NH1 ARG A 676 19.248 -5.594 11.439 1.00 19.86 N ATOM 2085 NH2 ARG A 676 20.201 -3.667 10.633 1.00 15.02 N ATOM 0 H ARG A 676 14.416 -5.805 7.669 1.00 15.17 H new ATOM 0 HA ARG A 676 14.760 -3.425 8.710 1.00 14.29 H new ATOM 0 HB2 ARG A 676 16.692 -4.664 7.043 1.00 13.30 H new ATOM 0 HB3 ARG A 676 16.994 -3.767 8.283 1.00 13.30 H new ATOM 0 HG2 ARG A 676 16.159 -5.537 9.677 1.00 12.88 H new ATOM 0 HG3 ARG A 676 16.063 -6.432 8.404 1.00 12.88 H new ATOM 0 HD2 ARG A 676 18.083 -6.753 9.710 1.00 15.12 H new ATOM 0 HD3 ARG A 676 18.326 -6.556 8.182 1.00 15.12 H new ATOM 0 HE ARG A 676 19.024 -4.406 8.637 1.00 16.29 H new ATOM 0 HH11 ARG A 676 18.748 -6.283 11.321 1.00 19.86 H new ATOM 0 HH12 ARG A 676 19.616 -5.456 12.204 1.00 19.86 H new ATOM 0 HH21 ARG A 676 20.318 -3.107 9.991 1.00 15.02 H new ATOM 0 HH22 ARG A 676 20.570 -3.528 11.397 1.00 15.02 H new ATOM 2086 N ASN A 677 13.883 -3.216 5.867 1.00 17.43 N ATOM 2087 CA ASN A 677 13.642 -2.335 4.729 1.00 17.40 C ATOM 2088 C ASN A 677 12.814 -1.091 5.026 1.00 16.26 C ATOM 2089 O ASN A 677 12.563 -0.284 4.138 1.00 17.43 O ATOM 2090 CB ASN A 677 13.004 -3.119 3.584 1.00 21.37 C ATOM 2091 CG ASN A 677 14.042 -3.777 2.696 1.00 25.75 C ATOM 2092 OD1 ASN A 677 15.231 -3.778 3.018 1.00 30.72 O ATOM 2093 ND2 ASN A 677 13.604 -4.338 1.576 1.00 29.16 N ATOM 0 H ASN A 677 13.382 -3.915 5.888 1.00 17.43 H new ATOM 0 HA ASN A 677 14.519 -2.004 4.481 1.00 17.40 H new ATOM 0 HB2 ASN A 677 12.414 -3.798 3.948 1.00 21.37 H new ATOM 0 HB3 ASN A 677 12.456 -2.522 3.051 1.00 21.37 H new ATOM 0 HD21 ASN A 677 14.158 -4.722 1.042 1.00 29.16 H new ATOM 0 HD22 ASN A 677 12.766 -4.318 1.384 1.00 29.16 H new ATOM 2094 N SER A 678 12.371 -0.933 6.265 1.00 12.42 N ATOM 2095 CA SER A 678 11.626 0.264 6.643 1.00 12.76 C ATOM 2096 C SER A 678 11.734 0.428 8.144 1.00 8.87 C ATOM 2097 O SER A 678 11.895 -0.556 8.868 1.00 12.05 O ATOM 2098 CB SER A 678 10.145 0.187 6.217 1.00 9.34 C ATOM 2099 OG SER A 678 9.411 -0.714 7.029 1.00 10.51 O ATOM 0 H SER A 678 12.489 -1.501 6.900 1.00 12.42 H new ATOM 0 HA SER A 678 12.006 1.029 6.184 1.00 12.76 H new ATOM 0 HB2 SER A 678 9.746 1.070 6.271 1.00 9.34 H new ATOM 0 HB3 SER A 678 10.089 -0.093 5.290 1.00 9.34 H new ATOM 0 HG SER A 678 9.903 -1.359 7.248 1.00 10.51 H new ATOM 2100 N LYS A 679 11.674 1.675 8.595 1.00 9.63 N ATOM 2101 CA LYS A 679 11.754 1.994 10.015 1.00 11.70 C ATOM 2102 C LYS A 679 10.642 1.330 10.835 1.00 13.37 C ATOM 2103 O LYS A 679 10.884 0.809 11.920 1.00 11.99 O ATOM 2104 CB LYS A 679 11.700 3.515 10.200 1.00 13.99 C ATOM 2105 CG LYS A 679 11.807 3.977 11.642 1.00 21.22 C ATOM 2106 CD LYS A 679 13.233 3.901 12.157 1.00 24.09 C ATOM 2107 CE LYS A 679 13.584 5.141 12.956 1.00 28.46 C ATOM 2108 NZ LYS A 679 15.056 5.239 13.167 1.00 32.08 N ATOM 0 H LYS A 679 11.586 2.362 8.085 1.00 9.63 H new ATOM 0 HA LYS A 679 12.596 1.643 10.344 1.00 11.70 H new ATOM 0 HB2 LYS A 679 12.420 3.917 9.689 1.00 13.99 H new ATOM 0 HB3 LYS A 679 10.868 3.846 9.827 1.00 13.99 H new ATOM 0 HG2 LYS A 679 11.486 4.890 11.713 1.00 21.22 H new ATOM 0 HG3 LYS A 679 11.232 3.430 12.200 1.00 21.22 H new ATOM 0 HD2 LYS A 679 13.339 3.113 12.712 1.00 24.09 H new ATOM 0 HD3 LYS A 679 13.846 3.807 11.411 1.00 24.09 H new ATOM 0 HE2 LYS A 679 13.267 5.931 12.490 1.00 28.46 H new ATOM 0 HE3 LYS A 679 13.131 5.117 13.814 1.00 28.46 H new ATOM 0 HZ1 LYS A 679 15.237 5.163 14.035 1.00 32.08 H new ATOM 0 HZ2 LYS A 679 15.464 4.586 12.721 1.00 32.08 H new ATOM 0 HZ3 LYS A 679 15.347 6.027 12.871 1.00 32.08 H new ATOM 2109 N LEU A 680 9.418 1.343 10.307 1.00 11.68 N ATOM 2110 CA LEU A 680 8.281 0.754 11.009 1.00 10.70 C ATOM 2111 C LEU A 680 8.371 -0.761 11.203 1.00 9.90 C ATOM 2112 O LEU A 680 8.178 -1.264 12.313 1.00 11.46 O ATOM 2113 CB LEU A 680 6.970 1.091 10.273 1.00 11.83 C ATOM 2114 CG LEU A 680 5.697 0.555 10.943 1.00 11.66 C ATOM 2115 CD1 LEU A 680 5.384 1.375 12.174 1.00 9.51 C ATOM 2116 CD2 LEU A 680 4.537 0.609 9.960 1.00 12.74 C ATOM 0 H LEU A 680 9.226 1.688 9.543 1.00 11.68 H new ATOM 0 HA LEU A 680 8.295 1.147 11.896 1.00 10.70 H new ATOM 0 HB2 LEU A 680 6.897 2.055 10.194 1.00 11.83 H new ATOM 0 HB3 LEU A 680 7.020 0.736 9.372 1.00 11.83 H new ATOM 0 HG LEU A 680 5.836 -0.367 11.210 1.00 11.66 H new ATOM 0 HD11 LEU A 680 4.579 1.034 12.595 1.00 9.51 H new ATOM 0 HD12 LEU A 680 6.124 1.317 12.798 1.00 9.51 H new ATOM 0 HD13 LEU A 680 5.247 2.301 11.920 1.00 9.51 H new ATOM 0 HD21 LEU A 680 3.735 0.270 10.387 1.00 12.74 H new ATOM 0 HD22 LEU A 680 4.391 1.527 9.681 1.00 12.74 H new ATOM 0 HD23 LEU A 680 4.745 0.065 9.184 1.00 12.74 H new ATOM 2117 N THR A 681 8.659 -1.496 10.132 1.00 9.88 N ATOM 2118 CA THR A 681 8.746 -2.947 10.230 1.00 9.00 C ATOM 2119 C THR A 681 9.964 -3.371 11.051 1.00 11.93 C ATOM 2120 O THR A 681 9.942 -4.416 11.702 1.00 11.44 O ATOM 2121 CB THR A 681 8.814 -3.625 8.823 1.00 12.61 C ATOM 2122 OG1 THR A 681 9.795 -2.970 8.016 1.00 13.31 O ATOM 2123 CG2 THR A 681 7.453 -3.539 8.103 1.00 11.23 C ATOM 0 H THR A 681 8.806 -1.176 9.347 1.00 9.88 H new ATOM 0 HA THR A 681 7.937 -3.242 10.676 1.00 9.00 H new ATOM 0 HB THR A 681 9.050 -4.557 8.952 1.00 12.61 H new ATOM 0 HG1 THR A 681 10.563 -3.200 8.267 1.00 13.31 H new ATOM 0 HG21 THR A 681 7.519 -3.965 7.234 1.00 11.23 H new ATOM 0 HG22 THR A 681 6.777 -3.990 8.633 1.00 11.23 H new ATOM 0 HG23 THR A 681 7.206 -2.608 7.988 1.00 11.23 H new ATOM 2124 N TYR A 682 11.022 -2.558 11.010 1.00 13.20 N ATOM 2125 CA TYR A 682 12.250 -2.851 11.761 1.00 12.54 C ATOM 2126 C TYR A 682 11.959 -2.676 13.241 1.00 11.03 C ATOM 2127 O TYR A 682 12.319 -3.518 14.053 1.00 13.47 O ATOM 2128 CB TYR A 682 13.376 -1.904 11.354 1.00 13.37 C ATOM 2129 CG TYR A 682 14.673 -2.197 12.065 1.00 14.36 C ATOM 2130 CD1 TYR A 682 15.211 -3.485 12.066 1.00 13.98 C ATOM 2131 CD2 TYR A 682 15.339 -1.202 12.772 1.00 13.80 C ATOM 2132 CE1 TYR A 682 16.385 -3.775 12.765 1.00 17.06 C ATOM 2133 CE2 TYR A 682 16.512 -1.481 13.474 1.00 15.37 C ATOM 2134 CZ TYR A 682 17.022 -2.769 13.466 1.00 15.03 C ATOM 2135 OH TYR A 682 18.162 -3.053 14.181 1.00 21.84 O ATOM 0 H TYR A 682 11.050 -1.830 10.553 1.00 13.20 H new ATOM 0 HA TYR A 682 12.532 -3.759 11.570 1.00 12.54 H new ATOM 0 HB2 TYR A 682 13.516 -1.967 10.396 1.00 13.37 H new ATOM 0 HB3 TYR A 682 13.108 -0.991 11.542 1.00 13.37 H new ATOM 0 HD1 TYR A 682 14.781 -4.161 11.594 1.00 13.98 H new ATOM 0 HD2 TYR A 682 14.997 -0.337 12.777 1.00 13.80 H new ATOM 0 HE1 TYR A 682 16.735 -4.637 12.759 1.00 17.06 H new ATOM 0 HE2 TYR A 682 16.948 -0.807 13.944 1.00 15.37 H new ATOM 0 HH TYR A 682 18.441 -2.354 14.554 1.00 21.84 H new ATOM 2136 N LEU A 683 11.288 -1.581 13.582 1.00 12.62 N ATOM 2137 CA LEU A 683 10.911 -1.305 14.966 1.00 12.17 C ATOM 2138 C LEU A 683 10.023 -2.405 15.556 1.00 12.91 C ATOM 2139 O LEU A 683 10.255 -2.861 16.674 1.00 14.09 O ATOM 2140 CB LEU A 683 10.169 0.034 15.052 1.00 11.92 C ATOM 2141 CG LEU A 683 9.500 0.399 16.385 1.00 12.15 C ATOM 2142 CD1 LEU A 683 10.558 0.659 17.448 1.00 13.55 C ATOM 2143 CD2 LEU A 683 8.641 1.632 16.210 1.00 12.61 C ATOM 0 H LEU A 683 11.039 -0.979 13.021 1.00 12.62 H new ATOM 0 HA LEU A 683 11.732 -1.271 15.482 1.00 12.17 H new ATOM 0 HB2 LEU A 683 10.799 0.738 14.832 1.00 11.92 H new ATOM 0 HB3 LEU A 683 9.485 0.040 14.364 1.00 11.92 H new ATOM 0 HG LEU A 683 8.942 -0.342 16.668 1.00 12.15 H new ATOM 0 HD11 LEU A 683 10.126 0.889 18.286 1.00 13.55 H new ATOM 0 HD12 LEU A 683 11.097 -0.138 17.570 1.00 13.55 H new ATOM 0 HD13 LEU A 683 11.127 1.393 17.166 1.00 13.55 H new ATOM 0 HD21 LEU A 683 8.222 1.857 17.055 1.00 12.61 H new ATOM 0 HD22 LEU A 683 9.194 2.373 15.917 1.00 12.61 H new ATOM 0 HD23 LEU A 683 7.956 1.458 15.546 1.00 12.61 H new ATOM 2144 N LEU A 684 9.018 -2.840 14.794 1.00 11.99 N ATOM 2145 CA LEU A 684 8.057 -3.846 15.249 1.00 11.40 C ATOM 2146 C LEU A 684 8.364 -5.322 15.014 1.00 12.46 C ATOM 2147 O LEU A 684 7.583 -6.183 15.407 1.00 11.91 O ATOM 2148 CB LEU A 684 6.691 -3.541 14.628 1.00 6.01 C ATOM 2149 CG LEU A 684 6.204 -2.116 14.842 1.00 8.42 C ATOM 2150 CD1 LEU A 684 4.964 -1.894 13.987 1.00 10.78 C ATOM 2151 CD2 LEU A 684 5.882 -1.899 16.308 1.00 9.15 C ATOM 0 H LEU A 684 8.874 -2.558 13.994 1.00 11.99 H new ATOM 0 HA LEU A 684 8.095 -3.756 16.214 1.00 11.40 H new ATOM 0 HB2 LEU A 684 6.736 -3.716 13.675 1.00 6.01 H new ATOM 0 HB3 LEU A 684 6.036 -4.153 14.998 1.00 6.01 H new ATOM 0 HG LEU A 684 6.893 -1.484 14.584 1.00 8.42 H new ATOM 0 HD11 LEU A 684 4.642 -0.988 14.113 1.00 10.78 H new ATOM 0 HD12 LEU A 684 5.186 -2.030 13.053 1.00 10.78 H new ATOM 0 HD13 LEU A 684 4.273 -2.522 14.249 1.00 10.78 H new ATOM 0 HD21 LEU A 684 5.572 -0.989 16.440 1.00 9.15 H new ATOM 0 HD22 LEU A 684 5.189 -2.520 16.583 1.00 9.15 H new ATOM 0 HD23 LEU A 684 6.679 -2.049 16.840 1.00 9.15 H new ATOM 2152 N GLN A 685 9.494 -5.631 14.396 1.00 13.54 N ATOM 2153 CA GLN A 685 9.813 -7.021 14.102 1.00 14.07 C ATOM 2154 C GLN A 685 9.533 -8.065 15.185 1.00 15.48 C ATOM 2155 O GLN A 685 9.001 -9.132 14.885 1.00 16.08 O ATOM 2156 CB GLN A 685 11.268 -7.139 13.657 1.00 18.33 C ATOM 2157 CG GLN A 685 12.273 -6.785 14.732 1.00 20.83 C ATOM 2158 CD GLN A 685 13.702 -7.019 14.283 1.00 26.39 C ATOM 2159 OE1 GLN A 685 13.937 -6.962 12.969 1.00 29.38 O flip ATOM 2160 NE2 GLN A 685 14.590 -7.247 15.110 1.00 22.61 N flip ATOM 0 H GLN A 685 10.084 -5.060 14.141 1.00 13.54 H new ATOM 0 HA GLN A 685 9.184 -7.243 13.397 1.00 14.07 H new ATOM 0 HB2 GLN A 685 11.433 -8.048 13.360 1.00 18.33 H new ATOM 0 HB3 GLN A 685 11.410 -6.560 12.892 1.00 18.33 H new ATOM 0 HG2 GLN A 685 12.163 -5.854 14.981 1.00 20.83 H new ATOM 0 HG3 GLN A 685 12.095 -7.314 15.525 1.00 20.83 H new ATOM 0 HE21 GLN A 685 14.400 -7.276 15.948 1.00 22.61 H new ATOM 0 HE22 GLN A 685 15.399 -7.377 14.848 1.00 22.61 H new ATOM 2161 N TYR A 686 9.889 -7.788 16.436 1.00 14.73 N ATOM 2162 CA TYR A 686 9.646 -8.775 17.484 1.00 14.39 C ATOM 2163 C TYR A 686 8.155 -8.941 17.770 1.00 13.98 C ATOM 2164 O TYR A 686 7.716 -9.982 18.269 1.00 15.23 O ATOM 2165 CB TYR A 686 10.371 -8.383 18.772 1.00 15.43 C ATOM 2166 CG TYR A 686 11.865 -8.601 18.728 1.00 16.74 C ATOM 2167 CD1 TYR A 686 12.405 -9.770 18.194 1.00 16.43 C ATOM 2168 CD2 TYR A 686 12.736 -7.641 19.232 1.00 17.28 C ATOM 2169 CE1 TYR A 686 13.779 -9.974 18.165 1.00 21.97 C ATOM 2170 CE2 TYR A 686 14.109 -7.834 19.208 1.00 21.16 C ATOM 2171 CZ TYR A 686 14.624 -9.000 18.676 1.00 21.41 C ATOM 2172 OH TYR A 686 15.988 -9.189 18.657 1.00 26.77 O ATOM 0 H TYR A 686 10.262 -7.057 16.694 1.00 14.73 H new ATOM 0 HA TYR A 686 9.991 -9.623 17.163 1.00 14.39 H new ATOM 0 HB2 TYR A 686 10.196 -7.447 18.959 1.00 15.43 H new ATOM 0 HB3 TYR A 686 10.001 -8.894 19.509 1.00 15.43 H new ATOM 0 HD1 TYR A 686 11.837 -10.423 17.852 1.00 16.43 H new ATOM 0 HD2 TYR A 686 12.391 -6.856 19.592 1.00 17.28 H new ATOM 0 HE1 TYR A 686 14.129 -10.757 17.806 1.00 21.97 H new ATOM 0 HE2 TYR A 686 14.679 -7.183 19.548 1.00 21.16 H new ATOM 0 HH TYR A 686 16.303 -8.886 17.939 1.00 26.77 H new ATOM 2173 N SER A 687 7.386 -7.908 17.457 1.00 13.49 N ATOM 2174 CA SER A 687 5.950 -7.935 17.678 1.00 12.16 C ATOM 2175 C SER A 687 5.224 -8.445 16.443 1.00 16.34 C ATOM 2176 O SER A 687 3.995 -8.553 16.429 1.00 16.12 O ATOM 2177 CB SER A 687 5.468 -6.534 18.025 1.00 9.38 C ATOM 2178 OG SER A 687 5.516 -6.318 19.431 1.00 12.53 O ATOM 0 H SER A 687 7.680 -7.177 17.113 1.00 13.49 H new ATOM 0 HA SER A 687 5.756 -8.538 18.413 1.00 12.16 H new ATOM 0 HB2 SER A 687 6.020 -5.876 17.573 1.00 9.38 H new ATOM 0 HB3 SER A 687 4.561 -6.411 17.705 1.00 9.38 H new ATOM 0 HG SER A 687 5.082 -5.625 19.623 1.00 12.53 H new ATOM 2179 N LEU A 688 5.983 -8.749 15.395 1.00 17.32 N ATOM 2180 CA LEU A 688 5.398 -9.245 14.155 1.00 16.01 C ATOM 2181 C LEU A 688 5.746 -10.700 13.925 1.00 18.48 C ATOM 2182 O LEU A 688 5.056 -11.402 13.192 1.00 20.65 O ATOM 2183 CB LEU A 688 5.881 -8.419 12.964 1.00 12.88 C ATOM 2184 CG LEU A 688 5.321 -7.008 12.821 1.00 14.14 C ATOM 2185 CD1 LEU A 688 6.123 -6.285 11.766 1.00 13.31 C ATOM 2186 CD2 LEU A 688 3.835 -7.052 12.445 1.00 10.07 C ATOM 0 H LEU A 688 6.840 -8.675 15.382 1.00 17.32 H new ATOM 0 HA LEU A 688 4.435 -9.163 14.237 1.00 16.01 H new ATOM 0 HB2 LEU A 688 6.848 -8.355 13.015 1.00 12.88 H new ATOM 0 HB3 LEU A 688 5.671 -8.909 12.154 1.00 12.88 H new ATOM 0 HG LEU A 688 5.391 -6.536 13.666 1.00 14.14 H new ATOM 0 HD11 LEU A 688 5.781 -5.383 11.660 1.00 13.31 H new ATOM 0 HD12 LEU A 688 7.054 -6.248 12.036 1.00 13.31 H new ATOM 0 HD13 LEU A 688 6.050 -6.759 10.923 1.00 13.31 H new ATOM 0 HD21 LEU A 688 3.496 -6.147 12.358 1.00 10.07 H new ATOM 0 HD22 LEU A 688 3.728 -7.519 11.602 1.00 10.07 H new ATOM 0 HD23 LEU A 688 3.340 -7.518 13.137 1.00 10.07 H new ATOM 2187 N THR A 689 6.819 -11.158 14.560 1.00 20.05 N ATOM 2188 CA THR A 689 7.259 -12.536 14.400 1.00 19.97 C ATOM 2189 C THR A 689 6.870 -13.420 15.569 1.00 21.16 C ATOM 2190 O THR A 689 6.217 -12.974 16.513 1.00 19.81 O ATOM 2191 CB THR A 689 8.793 -12.624 14.229 1.00 20.05 C ATOM 2192 OG1 THR A 689 9.438 -11.722 15.139 1.00 22.11 O ATOM 2193 CG2 THR A 689 9.182 -12.275 12.817 1.00 21.48 C ATOM 0 H THR A 689 7.306 -10.686 15.088 1.00 20.05 H new ATOM 0 HA THR A 689 6.810 -12.854 13.601 1.00 19.97 H new ATOM 0 HB THR A 689 9.074 -13.532 14.420 1.00 20.05 H new ATOM 0 HG1 THR A 689 9.367 -10.936 14.852 1.00 22.11 H new ATOM 0 HG21 THR A 689 10.146 -12.334 12.723 1.00 21.48 H new ATOM 0 HG22 THR A 689 8.759 -12.894 12.202 1.00 21.48 H new ATOM 0 HG23 THR A 689 8.892 -11.371 12.615 1.00 21.48 H new ATOM 2194 N GLY A 690 7.293 -14.679 15.493 1.00 22.45 N ATOM 2195 CA GLY A 690 7.002 -15.634 16.544 1.00 25.92 C ATOM 2196 C GLY A 690 5.527 -15.959 16.569 1.00 26.99 C ATOM 2197 O GLY A 690 4.916 -16.179 15.524 1.00 27.88 O ATOM 0 H GLY A 690 7.751 -14.996 14.838 1.00 22.45 H new ATOM 0 HA2 GLY A 690 7.515 -16.445 16.403 1.00 25.92 H new ATOM 0 HA3 GLY A 690 7.274 -15.272 17.402 1.00 25.92 H new ATOM 2198 N ASP A 691 4.951 -15.990 17.760 1.00 26.63 N ATOM 2199 CA ASP A 691 3.530 -16.276 17.887 1.00 26.23 C ATOM 2200 C ASP A 691 2.768 -14.969 18.075 1.00 25.08 C ATOM 2201 O ASP A 691 1.664 -14.954 18.626 1.00 23.72 O ATOM 2202 CB ASP A 691 3.276 -17.212 19.069 1.00 26.41 C ATOM 2203 CG ASP A 691 3.949 -16.741 20.334 1.00 27.67 C ATOM 2204 OD1 ASP A 691 4.216 -17.596 21.210 1.00 30.33 O ATOM 2205 OD2 ASP A 691 4.211 -15.519 20.446 1.00 25.14 O ATOM 0 H ASP A 691 5.360 -15.849 18.503 1.00 26.63 H new ATOM 0 HA ASP A 691 3.220 -16.716 17.080 1.00 26.23 H new ATOM 0 HB2 ASP A 691 2.321 -17.283 19.222 1.00 26.41 H new ATOM 0 HB3 ASP A 691 3.595 -18.101 18.848 1.00 26.41 H new ATOM 2206 N SER A 692 3.374 -13.873 17.618 1.00 22.09 N ATOM 2207 CA SER A 692 2.760 -12.558 17.719 1.00 21.07 C ATOM 2208 C SER A 692 1.506 -12.539 16.844 1.00 19.01 C ATOM 2209 O SER A 692 1.441 -13.242 15.842 1.00 19.51 O ATOM 2210 CB SER A 692 3.745 -11.472 17.269 1.00 21.64 C ATOM 2211 OG SER A 692 4.894 -11.444 18.110 1.00 23.08 O ATOM 0 H SER A 692 4.148 -13.875 17.243 1.00 22.09 H new ATOM 0 HA SER A 692 2.519 -12.377 18.641 1.00 21.07 H new ATOM 0 HB2 SER A 692 4.015 -11.636 16.352 1.00 21.64 H new ATOM 0 HB3 SER A 692 3.307 -10.607 17.285 1.00 21.64 H new ATOM 0 HG SER A 692 5.414 -12.067 17.895 1.00 23.08 H new ATOM 2212 N LYS A 693 0.519 -11.737 17.233 1.00 18.77 N ATOM 2213 CA LYS A 693 -0.745 -11.644 16.499 1.00 16.40 C ATOM 2214 C LYS A 693 -0.875 -10.300 15.795 1.00 14.71 C ATOM 2215 O LYS A 693 -0.714 -9.248 16.410 1.00 15.13 O ATOM 2216 CB LYS A 693 -1.914 -11.862 17.471 1.00 14.54 C ATOM 2217 CG LYS A 693 -1.746 -13.125 18.303 1.00 17.04 C ATOM 2218 CD LYS A 693 -2.988 -13.476 19.094 1.00 20.38 C ATOM 2219 CE LYS A 693 -2.898 -14.879 19.684 1.00 22.96 C ATOM 2220 NZ LYS A 693 -2.131 -15.810 18.808 1.00 28.16 N ATOM 0 H LYS A 693 0.561 -11.232 17.928 1.00 18.77 H new ATOM 0 HA LYS A 693 -0.762 -12.333 15.816 1.00 16.40 H new ATOM 0 HB2 LYS A 693 -1.988 -11.096 18.061 1.00 14.54 H new ATOM 0 HB3 LYS A 693 -2.743 -11.915 16.970 1.00 14.54 H new ATOM 0 HG2 LYS A 693 -1.520 -13.865 17.718 1.00 17.04 H new ATOM 0 HG3 LYS A 693 -1.001 -13.009 18.913 1.00 17.04 H new ATOM 0 HD2 LYS A 693 -3.111 -12.831 19.808 1.00 20.38 H new ATOM 0 HD3 LYS A 693 -3.767 -13.415 18.519 1.00 20.38 H new ATOM 0 HE2 LYS A 693 -2.475 -14.835 20.556 1.00 22.96 H new ATOM 0 HE3 LYS A 693 -3.792 -15.229 19.820 1.00 22.96 H new ATOM 0 HZ1 LYS A 693 -2.280 -16.649 19.064 1.00 28.16 H new ATOM 0 HZ2 LYS A 693 -2.393 -15.707 17.964 1.00 28.16 H new ATOM 0 HZ3 LYS A 693 -1.262 -15.631 18.873 1.00 28.16 H new ATOM 2221 N THR A 694 -1.158 -10.338 14.496 1.00 14.41 N ATOM 2222 CA THR A 694 -1.291 -9.115 13.719 1.00 13.60 C ATOM 2223 C THR A 694 -2.695 -8.959 13.152 1.00 13.07 C ATOM 2224 O THR A 694 -3.282 -9.919 12.668 1.00 11.88 O ATOM 2225 CB THR A 694 -0.271 -9.075 12.552 1.00 16.47 C ATOM 2226 OG1 THR A 694 1.060 -9.033 13.087 1.00 18.01 O ATOM 2227 CG2 THR A 694 -0.489 -7.834 11.687 1.00 16.39 C ATOM 0 H THR A 694 -1.276 -11.062 14.048 1.00 14.41 H new ATOM 0 HA THR A 694 -1.113 -8.381 14.328 1.00 13.60 H new ATOM 0 HB THR A 694 -0.394 -9.868 12.008 1.00 16.47 H new ATOM 0 HG1 THR A 694 1.329 -9.816 13.231 1.00 18.01 H new ATOM 0 HG21 THR A 694 0.157 -7.826 10.963 1.00 16.39 H new ATOM 0 HG22 THR A 694 -1.386 -7.850 11.319 1.00 16.39 H new ATOM 0 HG23 THR A 694 -0.376 -7.038 12.229 1.00 16.39 H new ATOM 2228 N LEU A 695 -3.216 -7.740 13.240 1.00 13.21 N ATOM 2229 CA LEU A 695 -4.543 -7.407 12.732 1.00 14.43 C ATOM 2230 C LEU A 695 -4.398 -6.207 11.799 1.00 13.22 C ATOM 2231 O LEU A 695 -3.988 -5.126 12.220 1.00 12.35 O ATOM 2232 CB LEU A 695 -5.498 -7.052 13.887 1.00 13.17 C ATOM 2233 CG LEU A 695 -7.019 -7.117 13.652 1.00 18.32 C ATOM 2234 CD1 LEU A 695 -7.694 -5.933 14.320 1.00 14.67 C ATOM 2235 CD2 LEU A 695 -7.334 -7.149 12.153 1.00 18.42 C ATOM 0 H LEU A 695 -2.805 -7.076 13.600 1.00 13.21 H new ATOM 0 HA LEU A 695 -4.915 -8.169 12.261 1.00 14.43 H new ATOM 0 HB2 LEU A 695 -5.292 -7.643 14.628 1.00 13.17 H new ATOM 0 HB3 LEU A 695 -5.285 -6.150 14.175 1.00 13.17 H new ATOM 0 HG LEU A 695 -7.363 -7.934 14.045 1.00 18.32 H new ATOM 0 HD11 LEU A 695 -8.651 -5.978 14.169 1.00 14.67 H new ATOM 0 HD12 LEU A 695 -7.516 -5.954 15.273 1.00 14.67 H new ATOM 0 HD13 LEU A 695 -7.347 -5.108 13.945 1.00 14.67 H new ATOM 0 HD21 LEU A 695 -8.295 -7.190 12.025 1.00 18.42 H new ATOM 0 HD22 LEU A 695 -6.986 -6.348 11.732 1.00 18.42 H new ATOM 0 HD23 LEU A 695 -6.921 -7.930 11.752 1.00 18.42 H new ATOM 2236 N MET A 696 -4.716 -6.410 10.525 1.00 15.13 N ATOM 2237 CA MET A 696 -4.649 -5.325 9.556 1.00 16.99 C ATOM 2238 C MET A 696 -6.061 -4.796 9.390 1.00 15.93 C ATOM 2239 O MET A 696 -6.968 -5.550 9.072 1.00 17.39 O ATOM 2240 CB MET A 696 -4.133 -5.826 8.211 1.00 19.53 C ATOM 2241 CG MET A 696 -2.861 -5.139 7.767 1.00 25.46 C ATOM 2242 SD MET A 696 -3.147 -3.612 6.889 1.00 23.60 S ATOM 2243 CE MET A 696 -3.526 -2.557 8.193 1.00 22.81 C ATOM 0 H MET A 696 -4.972 -7.165 10.203 1.00 15.13 H new ATOM 0 HA MET A 696 -4.041 -4.635 9.866 1.00 16.99 H new ATOM 0 HB2 MET A 696 -3.975 -6.781 8.267 1.00 19.53 H new ATOM 0 HB3 MET A 696 -4.818 -5.691 7.538 1.00 19.53 H new ATOM 0 HG2 MET A 696 -2.311 -4.958 8.545 1.00 25.46 H new ATOM 0 HG3 MET A 696 -2.358 -5.742 7.198 1.00 25.46 H new ATOM 0 HE1 MET A 696 -4.400 -2.162 8.047 1.00 22.81 H new ATOM 0 HE2 MET A 696 -3.533 -3.058 9.023 1.00 22.81 H new ATOM 0 HE3 MET A 696 -2.859 -1.854 8.245 1.00 22.81 H new ATOM 2244 N PHE A 697 -6.234 -3.507 9.634 1.00 16.62 N ATOM 2245 CA PHE A 697 -7.529 -2.851 9.518 1.00 16.51 C ATOM 2246 C PHE A 697 -7.515 -1.961 8.283 1.00 14.11 C ATOM 2247 O PHE A 697 -6.817 -0.955 8.254 1.00 12.72 O ATOM 2248 CB PHE A 697 -7.789 -1.981 10.753 1.00 22.04 C ATOM 2249 CG PHE A 697 -9.048 -2.318 11.479 1.00 23.98 C ATOM 2250 CD1 PHE A 697 -10.253 -1.731 11.117 1.00 26.58 C ATOM 2251 CD2 PHE A 697 -9.036 -3.235 12.523 1.00 29.58 C ATOM 2252 CE1 PHE A 697 -11.432 -2.051 11.781 1.00 26.49 C ATOM 2253 CE2 PHE A 697 -10.215 -3.565 13.198 1.00 29.49 C ATOM 2254 CZ PHE A 697 -11.411 -2.972 12.822 1.00 27.69 C ATOM 0 H PHE A 697 -5.597 -2.981 9.874 1.00 16.62 H new ATOM 0 HA PHE A 697 -8.226 -3.522 9.447 1.00 16.51 H new ATOM 0 HB2 PHE A 697 -7.041 -2.071 11.364 1.00 22.04 H new ATOM 0 HB3 PHE A 697 -7.823 -1.051 10.480 1.00 22.04 H new ATOM 0 HD1 PHE A 697 -10.272 -1.115 10.421 1.00 26.58 H new ATOM 0 HD2 PHE A 697 -8.235 -3.634 12.776 1.00 29.58 H new ATOM 0 HE1 PHE A 697 -12.232 -1.650 11.529 1.00 26.49 H new ATOM 0 HE2 PHE A 697 -10.197 -4.179 13.896 1.00 29.49 H new ATOM 0 HZ PHE A 697 -12.198 -3.190 13.266 1.00 27.69 H new ATOM 2255 N VAL A 698 -8.286 -2.332 7.266 1.00 13.88 N ATOM 2256 CA VAL A 698 -8.354 -1.533 6.057 1.00 13.62 C ATOM 2257 C VAL A 698 -9.601 -0.660 6.086 1.00 14.19 C ATOM 2258 O VAL A 698 -10.725 -1.156 5.992 1.00 16.93 O ATOM 2259 CB VAL A 698 -8.379 -2.416 4.803 1.00 12.03 C ATOM 2260 CG1 VAL A 698 -8.392 -1.547 3.565 1.00 11.08 C ATOM 2261 CG2 VAL A 698 -7.169 -3.325 4.799 1.00 20.08 C ATOM 0 H VAL A 698 -8.774 -3.040 7.259 1.00 13.88 H new ATOM 0 HA VAL A 698 -7.560 -0.976 6.022 1.00 13.62 H new ATOM 0 HB VAL A 698 -9.181 -2.962 4.807 1.00 12.03 H new ATOM 0 HG11 VAL A 698 -8.408 -2.109 2.775 1.00 11.08 H new ATOM 0 HG12 VAL A 698 -9.180 -0.981 3.575 1.00 11.08 H new ATOM 0 HG13 VAL A 698 -7.597 -0.992 3.551 1.00 11.08 H new ATOM 0 HG21 VAL A 698 -7.186 -3.883 4.006 1.00 20.08 H new ATOM 0 HG22 VAL A 698 -6.361 -2.788 4.799 1.00 20.08 H new ATOM 0 HG23 VAL A 698 -7.184 -3.887 5.589 1.00 20.08 H new ATOM 2262 N ASN A 699 -9.382 0.643 6.231 1.00 12.94 N ATOM 2263 CA ASN A 699 -10.454 1.622 6.280 1.00 14.52 C ATOM 2264 C ASN A 699 -10.767 2.151 4.884 1.00 15.17 C ATOM 2265 O ASN A 699 -9.861 2.477 4.116 1.00 11.65 O ATOM 2266 CB ASN A 699 -10.053 2.786 7.181 1.00 13.24 C ATOM 2267 CG ASN A 699 -9.881 2.368 8.628 1.00 18.87 C ATOM 2268 OD1 ASN A 699 -8.766 2.097 9.079 1.00 13.91 O ATOM 2269 ND2 ASN A 699 -10.987 2.317 9.367 1.00 14.45 N ATOM 0 H ASN A 699 -8.596 0.985 6.304 1.00 12.94 H new ATOM 0 HA ASN A 699 -11.245 1.189 6.636 1.00 14.52 H new ATOM 0 HB2 ASN A 699 -9.223 3.170 6.858 1.00 13.24 H new ATOM 0 HB3 ASN A 699 -10.728 3.481 7.126 1.00 13.24 H new ATOM 0 HD21 ASN A 699 -10.941 2.088 10.195 1.00 14.45 H new ATOM 0 HD22 ASN A 699 -11.748 2.513 9.017 1.00 14.45 H new ATOM 2270 N ILE A 700 -12.054 2.236 4.555 1.00 14.06 N ATOM 2271 CA ILE A 700 -12.454 2.747 3.252 1.00 12.38 C ATOM 2272 C ILE A 700 -13.681 3.634 3.371 1.00 14.62 C ATOM 2273 O ILE A 700 -14.491 3.490 4.289 1.00 12.94 O ATOM 2274 CB ILE A 700 -12.786 1.608 2.253 1.00 13.45 C ATOM 2275 CG1 ILE A 700 -13.890 0.710 2.820 1.00 14.01 C ATOM 2276 CG2 ILE A 700 -11.543 0.814 1.919 1.00 6.97 C ATOM 2277 CD1 ILE A 700 -14.717 0.019 1.746 1.00 13.47 C ATOM 0 H ILE A 700 -12.704 2.005 5.068 1.00 14.06 H new ATOM 0 HA ILE A 700 -11.698 3.255 2.919 1.00 12.38 H new ATOM 0 HB ILE A 700 -13.114 2.000 1.428 1.00 13.45 H new ATOM 0 HG12 ILE A 700 -13.489 0.038 3.393 1.00 14.01 H new ATOM 0 HG13 ILE A 700 -14.477 1.244 3.378 1.00 14.01 H new ATOM 0 HG21 ILE A 700 -11.768 0.107 1.294 1.00 6.97 H new ATOM 0 HG22 ILE A 700 -10.882 1.400 1.518 1.00 6.97 H new ATOM 0 HG23 ILE A 700 -11.180 0.425 2.730 1.00 6.97 H new ATOM 0 HD11 ILE A 700 -15.396 -0.533 2.165 1.00 13.47 H new ATOM 0 HD12 ILE A 700 -15.143 0.687 1.186 1.00 13.47 H new ATOM 0 HD13 ILE A 700 -14.139 -0.538 1.201 1.00 13.47 H new ATOM 2278 N SER A 701 -13.796 4.570 2.443 1.00 17.20 N ATOM 2279 CA SER A 701 -14.940 5.464 2.390 1.00 17.79 C ATOM 2280 C SER A 701 -15.991 4.745 1.536 1.00 17.88 C ATOM 2281 O SER A 701 -15.646 3.967 0.636 1.00 16.68 O ATOM 2282 CB SER A 701 -14.544 6.774 1.715 1.00 16.50 C ATOM 2283 OG SER A 701 -15.677 7.443 1.195 1.00 22.17 O ATOM 0 H SER A 701 -13.213 4.705 1.826 1.00 17.20 H new ATOM 0 HA SER A 701 -15.273 5.672 3.277 1.00 17.79 H new ATOM 0 HB2 SER A 701 -14.092 7.347 2.354 1.00 16.50 H new ATOM 0 HB3 SER A 701 -13.914 6.595 0.999 1.00 16.50 H new ATOM 0 HG SER A 701 -15.438 8.169 0.846 1.00 22.17 H new ATOM 2284 N PRO A 702 -17.285 4.962 1.828 1.00 17.43 N ATOM 2285 CA PRO A 702 -18.351 4.314 1.049 1.00 17.53 C ATOM 2286 C PRO A 702 -18.703 5.120 -0.211 1.00 17.36 C ATOM 2287 O PRO A 702 -19.338 4.614 -1.130 1.00 20.50 O ATOM 2288 CB PRO A 702 -19.519 4.280 2.023 1.00 15.66 C ATOM 2289 CG PRO A 702 -19.336 5.524 2.836 1.00 16.08 C ATOM 2290 CD PRO A 702 -17.835 5.789 2.918 1.00 15.78 C ATOM 0 HA PRO A 702 -18.098 3.436 0.723 1.00 17.53 H new ATOM 0 HB2 PRO A 702 -20.371 4.279 1.559 1.00 15.66 H new ATOM 0 HB3 PRO A 702 -19.498 3.485 2.578 1.00 15.66 H new ATOM 0 HG2 PRO A 702 -19.794 6.273 2.424 1.00 16.08 H new ATOM 0 HG3 PRO A 702 -19.714 5.413 3.723 1.00 16.08 H new ATOM 0 HD2 PRO A 702 -17.630 6.729 2.793 1.00 15.78 H new ATOM 0 HD3 PRO A 702 -17.473 5.532 3.780 1.00 15.78 H new ATOM 2291 N SER A 703 -18.268 6.373 -0.227 1.00 17.01 N ATOM 2292 CA SER A 703 -18.530 7.318 -1.301 1.00 17.79 C ATOM 2293 C SER A 703 -17.900 7.057 -2.674 1.00 19.65 C ATOM 2294 O SER A 703 -16.774 6.580 -2.789 1.00 17.01 O ATOM 2295 CB SER A 703 -18.137 8.707 -0.817 1.00 21.19 C ATOM 2296 OG SER A 703 -18.280 9.666 -1.846 1.00 30.39 O ATOM 0 H SER A 703 -17.796 6.707 0.409 1.00 17.01 H new ATOM 0 HA SER A 703 -19.478 7.215 -1.480 1.00 17.79 H new ATOM 0 HB2 SER A 703 -18.689 8.957 -0.060 1.00 21.19 H new ATOM 0 HB3 SER A 703 -17.218 8.696 -0.507 1.00 21.19 H new ATOM 0 HG SER A 703 -17.527 9.986 -2.037 1.00 30.39 H new ATOM 2297 N SER A 704 -18.647 7.411 -3.717 1.00 19.38 N ATOM 2298 CA SER A 704 -18.218 7.225 -5.101 1.00 20.38 C ATOM 2299 C SER A 704 -17.007 8.062 -5.509 1.00 18.47 C ATOM 2300 O SER A 704 -16.269 7.680 -6.413 1.00 19.51 O ATOM 2301 CB SER A 704 -19.386 7.536 -6.052 1.00 21.44 C ATOM 2302 OG SER A 704 -20.394 6.545 -5.957 1.00 18.41 O ATOM 0 H SER A 704 -19.425 7.770 -3.640 1.00 19.38 H new ATOM 0 HA SER A 704 -17.943 6.297 -5.167 1.00 20.38 H new ATOM 0 HB2 SER A 704 -19.760 8.405 -5.837 1.00 21.44 H new ATOM 0 HB3 SER A 704 -19.061 7.585 -6.964 1.00 21.44 H new ATOM 0 HG SER A 704 -20.056 5.827 -5.681 1.00 18.41 H new ATOM 2303 N SER A 705 -16.808 9.200 -4.850 1.00 18.99 N ATOM 2304 CA SER A 705 -15.684 10.079 -5.167 1.00 18.51 C ATOM 2305 C SER A 705 -14.350 9.467 -4.752 1.00 19.34 C ATOM 2306 O SER A 705 -13.297 9.942 -5.157 1.00 21.28 O ATOM 2307 CB SER A 705 -15.850 11.425 -4.465 1.00 17.92 C ATOM 2308 OG SER A 705 -16.156 11.240 -3.091 1.00 19.88 O ATOM 0 H SER A 705 -17.313 9.483 -4.214 1.00 18.99 H new ATOM 0 HA SER A 705 -15.681 10.202 -6.129 1.00 18.51 H new ATOM 0 HB2 SER A 705 -15.035 11.943 -4.553 1.00 17.92 H new ATOM 0 HB3 SER A 705 -16.557 11.933 -4.893 1.00 17.92 H new ATOM 0 HG SER A 705 -15.451 11.067 -2.668 1.00 19.88 H new ATOM 2309 N HIS A 706 -14.402 8.413 -3.945 1.00 18.92 N ATOM 2310 CA HIS A 706 -13.188 7.746 -3.469 1.00 17.72 C ATOM 2311 C HIS A 706 -13.107 6.304 -3.935 1.00 17.08 C ATOM 2312 O HIS A 706 -12.247 5.557 -3.475 1.00 17.74 O ATOM 2313 CB HIS A 706 -13.146 7.729 -1.937 1.00 15.48 C ATOM 2314 CG HIS A 706 -13.439 9.048 -1.302 1.00 16.33 C ATOM 2315 ND1 HIS A 706 -14.400 9.204 -0.328 1.00 18.08 N ATOM 2316 CD2 HIS A 706 -12.889 10.270 -1.488 1.00 18.86 C ATOM 2317 CE1 HIS A 706 -14.429 10.466 0.061 1.00 17.44 C ATOM 2318 NE2 HIS A 706 -13.522 11.135 -0.627 1.00 18.04 N ATOM 0 H HIS A 706 -15.134 8.064 -3.658 1.00 18.92 H new ATOM 0 HA HIS A 706 -12.444 8.249 -3.835 1.00 17.72 H new ATOM 0 HB2 HIS A 706 -13.786 7.076 -1.613 1.00 15.48 H new ATOM 0 HB3 HIS A 706 -12.268 7.432 -1.651 1.00 15.48 H new ATOM 0 HD2 HIS A 706 -12.210 10.485 -2.086 1.00 18.86 H new ATOM 0 HE1 HIS A 706 -14.992 10.823 0.709 1.00 17.44 H new ATOM 0 HE2 HIS A 706 -13.355 11.975 -0.549 1.00 18.04 H new ATOM 2319 N ILE A 707 -13.991 5.902 -4.840 1.00 14.59 N ATOM 2320 CA ILE A 707 -14.001 4.515 -5.268 1.00 14.43 C ATOM 2321 C ILE A 707 -12.674 3.966 -5.786 1.00 15.16 C ATOM 2322 O ILE A 707 -12.361 2.796 -5.557 1.00 17.08 O ATOM 2323 CB ILE A 707 -15.139 4.254 -6.297 1.00 11.94 C ATOM 2324 CG1 ILE A 707 -15.466 2.763 -6.310 1.00 12.69 C ATOM 2325 CG2 ILE A 707 -14.755 4.754 -7.679 1.00 13.79 C ATOM 2326 CD1 ILE A 707 -16.172 2.281 -5.033 1.00 15.00 C ATOM 0 H ILE A 707 -14.581 6.406 -5.211 1.00 14.59 H new ATOM 0 HA ILE A 707 -14.169 4.019 -4.451 1.00 14.43 H new ATOM 0 HB ILE A 707 -15.931 4.748 -6.032 1.00 11.94 H new ATOM 0 HG12 ILE A 707 -16.029 2.569 -7.076 1.00 12.69 H new ATOM 0 HG13 ILE A 707 -14.645 2.260 -6.427 1.00 12.69 H new ATOM 0 HG21 ILE A 707 -15.480 4.579 -8.299 1.00 13.79 H new ATOM 0 HG22 ILE A 707 -14.584 5.708 -7.642 1.00 13.79 H new ATOM 0 HG23 ILE A 707 -13.955 4.294 -7.979 1.00 13.79 H new ATOM 0 HD11 ILE A 707 -16.352 1.330 -5.102 1.00 15.00 H new ATOM 0 HD12 ILE A 707 -15.602 2.447 -4.266 1.00 15.00 H new ATOM 0 HD13 ILE A 707 -17.008 2.761 -4.924 1.00 15.00 H new ATOM 2327 N ASN A 708 -11.883 4.797 -6.458 1.00 17.40 N ATOM 2328 CA ASN A 708 -10.599 4.339 -6.986 1.00 16.30 C ATOM 2329 C ASN A 708 -9.583 4.065 -5.867 1.00 15.23 C ATOM 2330 O ASN A 708 -8.931 3.024 -5.862 1.00 14.84 O ATOM 2331 CB ASN A 708 -10.039 5.371 -7.963 1.00 18.49 C ATOM 2332 CG ASN A 708 -10.758 5.352 -9.311 1.00 20.20 C ATOM 2333 OD1 ASN A 708 -11.201 4.170 -9.740 1.00 22.74 O flip ATOM 2334 ND2 ASN A 708 -10.910 6.391 -9.954 1.00 14.95 N flip ATOM 0 H ASN A 708 -12.067 5.622 -6.619 1.00 17.40 H new ATOM 0 HA ASN A 708 -10.754 3.502 -7.451 1.00 16.30 H new ATOM 0 HB2 ASN A 708 -10.114 6.256 -7.572 1.00 18.49 H new ATOM 0 HB3 ASN A 708 -9.094 5.201 -8.102 1.00 18.49 H new ATOM 0 HD21 ASN A 708 -10.610 7.136 -9.645 1.00 14.95 H new ATOM 0 HD22 ASN A 708 -11.316 6.372 -10.712 1.00 14.95 H new ATOM 2335 N GLU A 709 -9.457 4.989 -4.919 1.00 14.54 N ATOM 2336 CA GLU A 709 -8.518 4.784 -3.817 1.00 14.71 C ATOM 2337 C GLU A 709 -9.031 3.610 -3.001 1.00 16.82 C ATOM 2338 O GLU A 709 -8.254 2.842 -2.444 1.00 16.74 O ATOM 2339 CB GLU A 709 -8.430 6.022 -2.929 1.00 13.64 C ATOM 2340 CG GLU A 709 -7.316 6.992 -3.291 1.00 15.26 C ATOM 2341 CD GLU A 709 -6.021 6.312 -3.737 1.00 15.22 C ATOM 2342 OE1 GLU A 709 -5.748 5.157 -3.357 1.00 16.36 O ATOM 2343 OE2 GLU A 709 -5.265 6.948 -4.486 1.00 17.91 O ATOM 0 H GLU A 709 -9.896 5.728 -4.893 1.00 14.54 H new ATOM 0 HA GLU A 709 -7.630 4.612 -4.169 1.00 14.71 H new ATOM 0 HB2 GLU A 709 -9.277 6.493 -2.969 1.00 13.64 H new ATOM 0 HB3 GLU A 709 -8.307 5.737 -2.010 1.00 13.64 H new ATOM 0 HG2 GLU A 709 -7.626 7.575 -4.001 1.00 15.26 H new ATOM 0 HG3 GLU A 709 -7.128 7.555 -2.524 1.00 15.26 H new ATOM 2344 N THR A 710 -10.353 3.472 -2.938 1.00 14.83 N ATOM 2345 CA THR A 710 -10.967 2.379 -2.205 1.00 12.07 C ATOM 2346 C THR A 710 -10.529 1.039 -2.787 1.00 12.57 C ATOM 2347 O THR A 710 -10.188 0.112 -2.051 1.00 14.41 O ATOM 2348 CB THR A 710 -12.516 2.477 -2.255 1.00 9.94 C ATOM 2349 OG1 THR A 710 -12.957 3.512 -1.373 1.00 13.56 O ATOM 2350 CG2 THR A 710 -13.146 1.166 -1.826 1.00 10.34 C ATOM 0 H THR A 710 -10.911 4.006 -3.316 1.00 14.83 H new ATOM 0 HA THR A 710 -10.678 2.442 -1.281 1.00 12.07 H new ATOM 0 HB THR A 710 -12.783 2.676 -3.166 1.00 9.94 H new ATOM 0 HG1 THR A 710 -13.707 3.795 -1.625 1.00 13.56 H new ATOM 0 HG21 THR A 710 -14.112 1.244 -1.863 1.00 10.34 H new ATOM 0 HG22 THR A 710 -12.856 0.457 -2.422 1.00 10.34 H new ATOM 0 HG23 THR A 710 -12.873 0.957 -0.919 1.00 10.34 H new ATOM 2351 N LEU A 711 -10.534 0.930 -4.114 1.00 14.67 N ATOM 2352 CA LEU A 711 -10.135 -0.316 -4.758 1.00 13.65 C ATOM 2353 C LEU A 711 -8.648 -0.600 -4.511 1.00 11.51 C ATOM 2354 O LEU A 711 -8.232 -1.755 -4.450 1.00 10.69 O ATOM 2355 CB LEU A 711 -10.442 -0.258 -6.265 1.00 15.22 C ATOM 2356 CG LEU A 711 -11.931 -0.487 -6.587 1.00 13.37 C ATOM 2357 CD1 LEU A 711 -12.229 -0.011 -8.001 1.00 14.89 C ATOM 2358 CD2 LEU A 711 -12.281 -1.966 -6.411 1.00 12.50 C ATOM 0 H LEU A 711 -10.763 1.559 -4.653 1.00 14.67 H new ATOM 0 HA LEU A 711 -10.646 -1.044 -4.370 1.00 13.65 H new ATOM 0 HB2 LEU A 711 -10.171 0.606 -6.612 1.00 15.22 H new ATOM 0 HB3 LEU A 711 -9.911 -0.927 -6.724 1.00 15.22 H new ATOM 0 HG LEU A 711 -12.480 0.025 -5.973 1.00 13.37 H new ATOM 0 HD11 LEU A 711 -13.167 -0.157 -8.201 1.00 14.89 H new ATOM 0 HD12 LEU A 711 -12.026 0.935 -8.074 1.00 14.89 H new ATOM 0 HD13 LEU A 711 -11.684 -0.507 -8.631 1.00 14.89 H new ATOM 0 HD21 LEU A 711 -13.219 -2.103 -6.615 1.00 12.50 H new ATOM 0 HD22 LEU A 711 -11.738 -2.501 -7.011 1.00 12.50 H new ATOM 0 HD23 LEU A 711 -12.108 -2.233 -5.495 1.00 12.50 H new ATOM 2359 N ASN A 712 -7.868 0.465 -4.358 1.00 12.41 N ATOM 2360 CA ASN A 712 -6.428 0.345 -4.093 1.00 15.29 C ATOM 2361 C ASN A 712 -6.222 -0.242 -2.699 1.00 12.37 C ATOM 2362 O ASN A 712 -5.454 -1.188 -2.523 1.00 12.61 O ATOM 2363 CB ASN A 712 -5.747 1.715 -4.151 1.00 14.03 C ATOM 2364 CG ASN A 712 -5.653 2.267 -5.559 1.00 19.31 C ATOM 2365 OD1 ASN A 712 -5.584 1.519 -6.531 1.00 19.62 O ATOM 2366 ND2 ASN A 712 -5.646 3.590 -5.673 1.00 21.88 N ATOM 0 H ASN A 712 -8.152 1.275 -4.404 1.00 12.41 H new ATOM 0 HA ASN A 712 -6.038 -0.231 -4.769 1.00 15.29 H new ATOM 0 HB2 ASN A 712 -6.239 2.340 -3.596 1.00 14.03 H new ATOM 0 HB3 ASN A 712 -4.855 1.644 -3.776 1.00 14.03 H new ATOM 0 HD21 ASN A 712 -5.592 3.954 -6.450 1.00 21.88 H new ATOM 0 HD22 ASN A 712 -5.696 4.082 -4.970 1.00 21.88 H new ATOM 2367 N SER A 713 -6.911 0.334 -1.715 1.00 11.45 N ATOM 2368 CA SER A 713 -6.817 -0.125 -0.333 1.00 9.81 C ATOM 2369 C SER A 713 -7.281 -1.576 -0.233 1.00 10.92 C ATOM 2370 O SER A 713 -6.671 -2.392 0.460 1.00 11.20 O ATOM 2371 CB SER A 713 -7.674 0.754 0.594 1.00 4.37 C ATOM 2372 OG SER A 713 -7.291 2.124 0.575 1.00 6.71 O ATOM 0 H SER A 713 -7.444 0.999 -1.830 1.00 11.45 H new ATOM 0 HA SER A 713 -5.890 -0.060 -0.054 1.00 9.81 H new ATOM 0 HB2 SER A 713 -8.605 0.680 0.331 1.00 4.37 H new ATOM 0 HB3 SER A 713 -7.608 0.418 1.502 1.00 4.37 H new ATOM 0 HG SER A 713 -7.930 2.598 0.844 1.00 6.71 H new ATOM 2373 N LEU A 714 -8.360 -1.911 -0.937 1.00 11.87 N ATOM 2374 CA LEU A 714 -8.871 -3.274 -0.891 1.00 12.24 C ATOM 2375 C LEU A 714 -7.929 -4.261 -1.566 1.00 9.95 C ATOM 2376 O LEU A 714 -7.893 -5.442 -1.219 1.00 10.74 O ATOM 2377 CB LEU A 714 -10.266 -3.339 -1.528 1.00 13.97 C ATOM 2378 CG LEU A 714 -11.362 -2.602 -0.753 1.00 13.78 C ATOM 2379 CD1 LEU A 714 -12.656 -2.618 -1.554 1.00 9.57 C ATOM 2380 CD2 LEU A 714 -11.553 -3.262 0.608 1.00 12.19 C ATOM 0 H LEU A 714 -8.803 -1.372 -1.439 1.00 11.87 H new ATOM 0 HA LEU A 714 -8.935 -3.531 0.042 1.00 12.24 H new ATOM 0 HB2 LEU A 714 -10.216 -2.969 -2.423 1.00 13.97 H new ATOM 0 HB3 LEU A 714 -10.523 -4.270 -1.620 1.00 13.97 H new ATOM 0 HG LEU A 714 -11.102 -1.678 -0.613 1.00 13.78 H new ATOM 0 HD11 LEU A 714 -13.348 -2.151 -1.061 1.00 9.57 H new ATOM 0 HD12 LEU A 714 -12.514 -2.178 -2.407 1.00 9.57 H new ATOM 0 HD13 LEU A 714 -12.931 -3.536 -1.706 1.00 9.57 H new ATOM 0 HD21 LEU A 714 -12.247 -2.796 1.099 1.00 12.19 H new ATOM 0 HD22 LEU A 714 -11.812 -4.189 0.485 1.00 12.19 H new ATOM 0 HD23 LEU A 714 -10.722 -3.222 1.107 1.00 12.19 H new ATOM 2381 N ARG A 715 -7.163 -3.782 -2.535 1.00 13.53 N ATOM 2382 CA ARG A 715 -6.210 -4.643 -3.219 1.00 15.64 C ATOM 2383 C ARG A 715 -5.021 -4.903 -2.291 1.00 16.52 C ATOM 2384 O ARG A 715 -4.518 -6.025 -2.207 1.00 16.60 O ATOM 2385 CB ARG A 715 -5.736 -3.980 -4.507 1.00 18.84 C ATOM 2386 CG ARG A 715 -6.628 -4.284 -5.706 1.00 23.91 C ATOM 2387 CD ARG A 715 -6.313 -3.377 -6.889 1.00 26.60 C ATOM 2388 NE ARG A 715 -7.461 -3.226 -7.777 1.00 30.86 N ATOM 2389 CZ ARG A 715 -7.835 -2.076 -8.322 1.00 29.91 C ATOM 2390 NH1 ARG A 715 -7.151 -0.967 -8.069 1.00 32.15 N ATOM 2391 NH2 ARG A 715 -8.892 -2.033 -9.120 1.00 31.27 N ATOM 0 H ARG A 715 -7.178 -2.968 -2.811 1.00 13.53 H new ATOM 0 HA ARG A 715 -6.635 -5.485 -3.446 1.00 15.64 H new ATOM 0 HB2 ARG A 715 -5.699 -3.020 -4.374 1.00 18.84 H new ATOM 0 HB3 ARG A 715 -4.832 -4.274 -4.701 1.00 18.84 H new ATOM 0 HG2 ARG A 715 -6.512 -5.211 -5.969 1.00 23.91 H new ATOM 0 HG3 ARG A 715 -7.558 -4.175 -5.453 1.00 23.91 H new ATOM 0 HD2 ARG A 715 -6.039 -2.505 -6.564 1.00 26.60 H new ATOM 0 HD3 ARG A 715 -5.565 -3.743 -7.387 1.00 26.60 H new ATOM 0 HE ARG A 715 -7.925 -3.927 -7.959 1.00 30.86 H new ATOM 0 HH11 ARG A 715 -6.465 -0.994 -7.551 1.00 32.15 H new ATOM 0 HH12 ARG A 715 -7.394 -0.222 -8.423 1.00 32.15 H new ATOM 0 HH21 ARG A 715 -9.336 -2.751 -9.285 1.00 31.27 H new ATOM 0 HH22 ARG A 715 -9.134 -1.287 -9.473 1.00 31.27 H new ATOM 2392 N PHE A 716 -4.585 -3.861 -1.589 1.00 18.84 N ATOM 2393 CA PHE A 716 -3.474 -3.982 -0.650 1.00 18.86 C ATOM 2394 C PHE A 716 -3.846 -5.019 0.407 1.00 21.45 C ATOM 2395 O PHE A 716 -3.039 -5.875 0.770 1.00 20.81 O ATOM 2396 CB PHE A 716 -3.197 -2.632 0.021 1.00 20.18 C ATOM 2397 CG PHE A 716 -2.270 -2.718 1.215 1.00 22.98 C ATOM 2398 CD1 PHE A 716 -2.780 -2.922 2.496 1.00 21.70 C ATOM 2399 CD2 PHE A 716 -0.886 -2.610 1.057 1.00 24.41 C ATOM 2400 CE1 PHE A 716 -1.928 -3.021 3.605 1.00 23.35 C ATOM 2401 CE2 PHE A 716 -0.027 -2.708 2.161 1.00 23.31 C ATOM 2402 CZ PHE A 716 -0.547 -2.914 3.434 1.00 21.33 C ATOM 0 H PHE A 716 -4.921 -3.071 -1.642 1.00 18.84 H new ATOM 0 HA PHE A 716 -2.673 -4.258 -1.123 1.00 18.86 H new ATOM 0 HB2 PHE A 716 -2.812 -2.029 -0.634 1.00 20.18 H new ATOM 0 HB3 PHE A 716 -4.039 -2.243 0.304 1.00 20.18 H new ATOM 0 HD1 PHE A 716 -3.699 -2.994 2.617 1.00 21.70 H new ATOM 0 HD2 PHE A 716 -0.530 -2.471 0.209 1.00 24.41 H new ATOM 0 HE1 PHE A 716 -2.283 -3.158 4.454 1.00 23.35 H new ATOM 0 HE2 PHE A 716 0.892 -2.635 2.042 1.00 23.31 H new ATOM 0 HZ PHE A 716 0.022 -2.980 4.167 1.00 21.33 H new ATOM 2403 N ALA A 717 -5.084 -4.930 0.886 1.00 22.87 N ATOM 2404 CA ALA A 717 -5.613 -5.826 1.909 1.00 26.30 C ATOM 2405 C ALA A 717 -5.682 -7.280 1.460 1.00 29.31 C ATOM 2406 O ALA A 717 -5.416 -8.191 2.240 1.00 28.55 O ATOM 2407 CB ALA A 717 -6.989 -5.356 2.328 1.00 25.54 C ATOM 0 H ALA A 717 -5.649 -4.338 0.621 1.00 22.87 H new ATOM 0 HA ALA A 717 -4.997 -5.795 2.657 1.00 26.30 H new ATOM 0 HB1 ALA A 717 -7.341 -5.951 3.008 1.00 25.54 H new ATOM 0 HB2 ALA A 717 -6.929 -4.456 2.686 1.00 25.54 H new ATOM 0 HB3 ALA A 717 -7.580 -5.359 1.559 1.00 25.54 H new ATOM 2408 N SER A 718 -6.057 -7.494 0.206 1.00 34.24 N ATOM 2409 CA SER A 718 -6.152 -8.846 -0.332 1.00 40.07 C ATOM 2410 C SER A 718 -4.771 -9.494 -0.401 1.00 42.83 C ATOM 2411 O SER A 718 -4.617 -10.690 -0.133 1.00 42.64 O ATOM 2412 CB SER A 718 -6.773 -8.815 -1.731 1.00 41.49 C ATOM 2413 OG SER A 718 -8.015 -8.134 -1.727 1.00 44.45 O ATOM 0 H SER A 718 -6.261 -6.871 -0.351 1.00 34.24 H new ATOM 0 HA SER A 718 -6.716 -9.369 0.258 1.00 40.07 H new ATOM 0 HB2 SER A 718 -6.164 -8.379 -2.348 1.00 41.49 H new ATOM 0 HB3 SER A 718 -6.900 -9.722 -2.051 1.00 41.49 H new ATOM 0 HG SER A 718 -7.884 -7.313 -1.604 1.00 44.45 H new ATOM 2414 N LYS A 719 -3.773 -8.701 -0.779 1.00 45.49 N ATOM 2415 CA LYS A 719 -2.404 -9.198 -0.862 1.00 50.31 C ATOM 2416 C LYS A 719 -1.955 -9.637 0.530 1.00 51.94 C ATOM 2417 O LYS A 719 -1.485 -10.757 0.727 1.00 52.31 O ATOM 2418 CB LYS A 719 -1.473 -8.092 -1.390 1.00 51.67 C ATOM 2419 CG LYS A 719 -0.102 -8.011 -0.706 1.00 54.72 C ATOM 2420 CD LYS A 719 0.897 -7.219 -1.543 1.00 55.68 C ATOM 2421 CE LYS A 719 2.238 -7.096 -0.833 1.00 56.13 C ATOM 2422 NZ LYS A 719 3.132 -8.275 -1.058 1.00 57.35 N ATOM 0 H LYS A 719 -3.867 -7.873 -0.991 1.00 45.49 H new ATOM 0 HA LYS A 719 -2.365 -9.951 -1.472 1.00 50.31 H new ATOM 0 HB2 LYS A 719 -1.337 -8.230 -2.340 1.00 51.67 H new ATOM 0 HB3 LYS A 719 -1.920 -7.237 -1.289 1.00 51.67 H new ATOM 0 HG2 LYS A 719 -0.198 -7.594 0.165 1.00 54.72 H new ATOM 0 HG3 LYS A 719 0.239 -8.907 -0.556 1.00 54.72 H new ATOM 0 HD2 LYS A 719 1.021 -7.655 -2.400 1.00 55.68 H new ATOM 0 HD3 LYS A 719 0.542 -6.335 -1.723 1.00 55.68 H new ATOM 0 HE2 LYS A 719 2.688 -6.293 -1.139 1.00 56.13 H new ATOM 0 HE3 LYS A 719 2.085 -6.990 0.119 1.00 56.13 H new ATOM 0 HZ1 LYS A 719 3.982 -8.016 -1.012 1.00 57.35 H new ATOM 0 HZ2 LYS A 719 2.975 -8.890 -0.434 1.00 57.35 H new ATOM 0 HZ3 LYS A 719 2.971 -8.621 -1.862 1.00 57.35 H new ATOM 2423 N VAL A 720 -2.130 -8.743 1.495 1.00 53.52 N ATOM 2424 CA VAL A 720 -1.738 -8.981 2.873 1.00 56.42 C ATOM 2425 C VAL A 720 -2.402 -10.193 3.545 1.00 59.06 C ATOM 2426 O VAL A 720 -1.995 -10.587 4.638 1.00 59.90 O ATOM 2427 CB VAL A 720 -1.971 -7.684 3.703 1.00 54.60 C ATOM 2428 CG1 VAL A 720 -2.414 -8.009 5.114 1.00 54.90 C ATOM 2429 CG2 VAL A 720 -0.703 -6.846 3.711 1.00 54.06 C ATOM 0 H VAL A 720 -2.485 -7.971 1.364 1.00 53.52 H new ATOM 0 HA VAL A 720 -0.796 -9.211 2.849 1.00 56.42 H new ATOM 0 HB VAL A 720 -2.683 -7.173 3.287 1.00 54.60 H new ATOM 0 HG11 VAL A 720 -2.552 -7.186 5.608 1.00 54.90 H new ATOM 0 HG12 VAL A 720 -3.244 -8.511 5.085 1.00 54.90 H new ATOM 0 HG13 VAL A 720 -1.731 -8.539 5.554 1.00 54.90 H new ATOM 0 HG21 VAL A 720 -0.851 -6.039 4.229 1.00 54.06 H new ATOM 0 HG22 VAL A 720 0.020 -7.356 4.108 1.00 54.06 H new ATOM 0 HG23 VAL A 720 -0.467 -6.607 2.801 1.00 54.06 H new ATOM 2430 N ASN A 721 -3.415 -10.788 2.914 1.00 62.06 N ATOM 2431 CA ASN A 721 -4.052 -11.962 3.517 1.00 64.97 C ATOM 2432 C ASN A 721 -3.965 -13.214 2.655 1.00 65.76 C ATOM 2433 O ASN A 721 -4.839 -14.079 2.673 1.00 65.17 O ATOM 2434 CB ASN A 721 -5.501 -11.639 3.964 1.00 66.89 C ATOM 2435 CG ASN A 721 -6.533 -11.824 2.862 1.00 70.06 C ATOM 2436 OD1 ASN A 721 -6.198 -12.014 1.685 1.00 71.24 O ATOM 2437 ND2 ASN A 721 -7.802 -11.757 3.241 1.00 70.20 N ATOM 0 H ASN A 721 -3.741 -10.538 2.159 1.00 62.06 H new ATOM 0 HA ASN A 721 -3.541 -12.178 4.313 1.00 64.97 H new ATOM 0 HB2 ASN A 721 -5.734 -12.208 4.714 1.00 66.89 H new ATOM 0 HB3 ASN A 721 -5.537 -10.723 4.280 1.00 66.89 H new ATOM 0 HD21 ASN A 721 -8.430 -11.847 2.660 1.00 70.20 H new ATOM 0 HD22 ASN A 721 -7.997 -11.624 4.068 1.00 70.20 H new ATOM 2438 N SER A 722 -2.866 -13.283 1.912 1.00 67.37 N ATOM 2439 CA SER A 722 -2.564 -14.405 1.040 1.00 69.46 C ATOM 2440 C SER A 722 -1.221 -14.967 1.518 1.00 71.02 C ATOM 2441 O SER A 722 -0.261 -15.020 0.713 1.00 72.48 O ATOM 2442 CB SER A 722 -2.456 -13.943 -0.422 1.00 68.74 C ATOM 2443 OG SER A 722 -2.975 -14.906 -1.321 1.00 68.46 O ATOM 0 H SER A 722 -2.266 -12.667 1.902 1.00 67.37 H new ATOM 0 HA SER A 722 -3.265 -15.075 1.077 1.00 69.46 H new ATOM 0 HB2 SER A 722 -2.935 -13.107 -0.533 1.00 68.74 H new ATOM 0 HB3 SER A 722 -1.527 -13.768 -0.637 1.00 68.74 H new ATOM 0 HG SER A 722 -2.902 -14.623 -2.108 1.00 68.46 H new TER 2444 SER A 722 HETATM 2445 MG MG A 997 -5.989 10.604 10.579 1.00 19.44 MG HETATM 2446 PB ADP A 999 -8.297 9.331 8.441 1.00 11.15 P HETATM 2447 O1B ADP A 999 -8.278 8.034 7.731 1.00 11.61 O HETATM 2448 O2B ADP A 999 -7.613 9.164 9.901 1.00 13.90 O HETATM 2449 O3B ADP A 999 -7.684 10.438 7.667 1.00 11.20 O HETATM 2450 PA ADP A 999 -10.421 10.190 10.126 1.00 16.30 P HETATM 2451 O1A ADP A 999 -10.565 9.040 11.011 1.00 16.74 O HETATM 2452 O2A ADP A 999 -9.635 11.222 10.786 1.00 20.03 O HETATM 2453 O3A ADP A 999 -9.765 9.733 8.789 1.00 14.64 O HETATM 2454 O5' ADP A 999 -11.815 10.816 9.776 1.00 17.37 O HETATM 2455 C5' ADP A 999 -12.389 11.027 8.488 1.00 14.49 C HETATM 2456 C4' ADP A 999 -13.703 11.765 8.823 1.00 14.77 C HETATM 2457 O4' ADP A 999 -14.685 10.735 8.915 1.00 16.55 O HETATM 2458 C3' ADP A 999 -13.695 12.435 10.216 1.00 16.35 C HETATM 2459 O3' ADP A 999 -14.431 13.671 10.249 1.00 21.38 O HETATM 2460 C2' ADP A 999 -14.287 11.398 11.155 1.00 14.91 C HETATM 2461 O2' ADP A 999 -14.852 11.963 12.340 1.00 16.72 O HETATM 2462 C1' ADP A 999 -15.239 10.645 10.241 1.00 13.29 C HETATM 2463 N9 ADP A 999 -15.336 9.192 10.552 1.00 14.16 N HETATM 2464 C8 ADP A 999 -14.404 8.272 10.238 1.00 9.13 C HETATM 2465 N7 ADP A 999 -14.815 7.079 10.629 1.00 11.19 N HETATM 2466 C5 ADP A 999 -16.000 7.208 11.177 1.00 11.29 C HETATM 2467 C6 ADP A 999 -16.924 6.341 11.759 1.00 12.37 C HETATM 2468 N6 ADP A 999 -16.678 5.014 11.831 1.00 13.14 N HETATM 2469 N1 ADP A 999 -18.098 6.836 12.257 1.00 11.48 N HETATM 2470 C2 ADP A 999 -18.401 8.149 12.209 1.00 7.66 C HETATM 2471 N3 ADP A 999 -17.524 8.999 11.652 1.00 13.34 N HETATM 2472 C4 ADP A 999 -16.333 8.579 11.139 1.00 12.34 C HETATM 0 HO3' ADP A 999 -14.951 13.670 10.909 1.00 21.38 H new HETATM 0 HO2' ADP A 999 -14.960 11.360 12.915 1.00 16.72 H new HETATM 0 HN62 ADP A 999 -17.255 4.489 12.192 1.00 13.14 H new HETATM 0 HN61 ADP A 999 -15.944 4.695 11.516 1.00 13.14 H new HETATM 0 H5'2 ADP A 999 -11.812 11.559 7.918 1.00 14.49 H new HETATM 0 H5'1 ADP A 999 -12.553 10.191 8.024 1.00 14.49 H new HETATM 0 H8 ADP A 999 -13.562 8.457 9.794 1.00 9.13 H new HETATM 0 H4' ADP A 999 -13.853 12.451 8.154 1.00 14.77 H new HETATM 0 H3' ADP A 999 -12.795 12.690 10.474 1.00 16.35 H new HETATM 0 H2' ADP A 999 -13.638 10.800 11.556 1.00 14.91 H new HETATM 0 H2 ADP A 999 -19.240 8.474 12.571 1.00 7.66 H new HETATM 0 H1' ADP A 999 -16.121 11.035 10.344 1.00 13.29 H new HETATM 2473 O HOH A 1 1.910 -9.994 30.076 1.00 13.40 O HETATM 2474 O HOH A 2 -15.367 4.301 -1.956 1.00 11.46 O HETATM 2475 O HOH A 3 20.690 -0.300 19.216 1.00 17.25 O HETATM 2476 O HOH A 4 -4.297 8.915 10.031 1.00 16.47 O HETATM 2477 O HOH A 5 0.083 -0.089 35.586 1.00 17.81 O HETATM 2478 O HOH A 6 11.255 13.445 19.630 1.00 15.27 O HETATM 2479 O HOH A 7 -11.391 4.483 0.599 1.00 13.24 O HETATM 2480 O HOH A 8 -13.150 0.056 18.885 1.00 11.51 O HETATM 2481 O HOH A 9 -4.300 11.775 11.637 1.00 10.21 O HETATM 2482 O HOH A 10 -0.669 5.967 35.753 1.00 31.51 O HETATM 2483 O HOH A 11 -4.156 9.584 6.479 1.00 10.83 O HETATM 2484 O HOH A 12 5.011 7.416 34.587 1.00 18.08 O HETATM 2485 O HOH A 13 8.908 -6.125 22.314 1.00 14.31 O HETATM 2486 O HOH A 14 6.482 9.190 6.760 1.00 14.81 O HETATM 2487 O HOH A 15 4.920 0.305 37.934 1.00 22.27 O HETATM 2488 O HOH A 16 -19.913 3.096 -3.583 1.00 17.86 O HETATM 2489 O HOH A 17 -19.399 -11.771 -10.905 1.00 49.62 O HETATM 2490 O HOH A 18 -3.716 1.378 -1.195 1.00 23.04 O HETATM 2491 O HOH A 19 24.462 3.284 19.075 1.00 17.59 O HETATM 2492 O HOH A 20 25.027 6.570 18.154 1.00 17.32 O HETATM 2493 O HOH A 21 8.777 -6.264 39.540 1.00 20.60 O HETATM 2494 O HOH A 22 -2.549 3.436 5.042 1.00 13.30 O HETATM 2495 O HOH A 23 -18.106 1.643 10.225 1.00 14.77 O HETATM 2496 O HOH A 24 9.529 0.424 35.831 1.00 24.85 O HETATM 2497 O HOH A 25 13.776 2.921 -2.733 1.00 53.87 O HETATM 2498 O HOH A 27 7.201 -2.436 19.948 1.00 10.77 O HETATM 2499 O HOH A 28 0.457 0.253 -0.191 1.00 23.17 O HETATM 2500 O HOH A 30 25.177 4.618 16.185 1.00 17.72 O HETATM 2501 O HOH A 31 -16.842 -1.911 -12.097 1.00 18.42 O HETATM 2502 O HOH A 32 -2.323 9.303 8.444 1.00 11.82 O HETATM 2503 O HOH A 33 -12.788 1.255 16.088 1.00 13.62 O HETATM 2504 O HOH A 34 16.241 -7.822 11.326 1.00 33.88 O HETATM 2505 O HOH A 35 -9.311 -0.016 -10.688 1.00 38.99 O HETATM 2506 O HOH A 36 8.994 1.947 22.617 1.00 19.65 O HETATM 2507 O HOH A 37 -9.045 3.551 1.872 1.00 12.53 O HETATM 2508 O HOH A 38 7.609 -10.225 24.922 1.00 20.67 O HETATM 2509 O HOH A 39 -11.239 0.252 32.757 1.00 45.39 O HETATM 2510 O HOH A 40 -21.624 6.305 15.748 1.00 31.76 O HETATM 2511 O HOH A 41 -9.549 -10.761 -1.234 1.00 43.87 O HETATM 2512 O HOH A 44 6.731 -0.433 36.200 1.00 25.39 O HETATM 2513 O HOH A 45 10.395 -9.653 31.335 1.00 35.16 O HETATM 2514 O HOH A 46 -12.788 11.193 16.693 1.00 28.12 O HETATM 2515 O HOH A 47 -10.087 10.216 16.707 1.00 31.61 O HETATM 2516 O HOH A 48 -5.443 3.524 -0.976 1.00 17.55 O HETATM 2517 O HOH A 50 -23.350 5.057 0.845 1.00 27.16 O HETATM 2518 O HOH A 51 -15.957 -7.046 25.096 1.00 50.26 O HETATM 2519 O HOH A 52 -13.620 -2.323 27.691 1.00 42.36 O HETATM 2520 O HOH A 53 -6.655 0.484 37.560 1.00 29.13 O HETATM 2521 O HOH A 55 8.118 -5.150 19.707 1.00 16.48 O HETATM 2522 O HOH A 56 10.472 4.353 26.721 1.00 47.48 O HETATM 2523 O HOH A 58 7.470 -9.980 34.013 1.00 28.23 O HETATM 2524 O HOH A 59 4.671 -2.303 32.448 1.00 18.12 O HETATM 2525 O HOH A 61 -25.993 7.529 -1.523 1.00 29.32 O HETATM 2526 O HOH A 64 -15.811 -1.048 31.040 1.00 52.13 O HETATM 2527 O HOH A 65 7.682 -12.727 41.032 1.00 48.62 O HETATM 2528 O HOH A 68 11.142 2.394 24.588 1.00 20.09 O HETATM 2529 O HOH A 69 25.810 11.879 12.859 1.00 39.38 O HETATM 2530 O HOH A 70 1.977 7.491 38.156 1.00 29.48 O HETATM 2531 O HOH A 72 6.162 -11.622 25.016 1.00 15.21 O HETATM 2532 O HOH A 74 13.592 12.891 14.815 1.00 42.51 O HETATM 2533 O HOH A 79 -14.103 4.499 10.529 1.00 14.99 O HETATM 2534 O HOH A 82 -7.311 5.144 -11.887 1.00 55.50 O HETATM 2535 O HOH A 83 4.205 -12.930 20.578 1.00 13.66 O HETATM 2536 O HOH A 84 8.563 3.482 7.865 1.00 10.72 O HETATM 2537 O HOH A 85 -12.882 -9.989 20.585 1.00 37.04 O HETATM 2538 O HOH A 86 -0.640 8.670 11.404 1.00 18.02 O HETATM 2539 O HOH A 87 -1.556 5.345 16.861 1.00 16.26 O HETATM 2540 O HOH A 88 -9.029 13.049 8.061 1.00 19.30 O HETATM 2541 O HOH A 89 -5.360 11.231 8.543 1.00 11.52 O HETATM 2542 O HOH A 90 -13.375 3.319 8.067 1.00 12.72 O HETATM 2543 O HOH A 91 10.168 8.269 30.869 1.00 28.65 O HETATM 2544 O HOH A 93 -11.701 -15.285 32.963 1.00 50.35 O HETATM 2545 O HOH A 94 2.425 -19.963 21.430 1.00 42.94 O HETATM 2546 O HOH A 95 17.899 3.161 15.496 1.00 33.14 O HETATM 2547 O HOH A 96 9.539 1.710 27.498 1.00 24.77 O HETATM 2548 O HOH A 97 1.985 -11.524 13.567 1.00 20.19 O HETATM 2549 O HOH A 99 -10.133 9.616 -3.454 1.00 21.13 O HETATM 2550 O HOH A 100 18.463 -2.972 17.582 1.00 37.94 O HETATM 2551 O HOH A 101 11.490 15.346 7.880 1.00 57.32 O HETATM 2552 O HOH A 102 -8.311 21.367 23.788 1.00 39.63 O HETATM 2553 O HOH A 104 4.390 -17.623 24.704 1.00 39.09 O HETATM 2554 O HOH A 107 9.153 18.561 -4.981 1.00 45.88 O HETATM 2555 O HOH A 108 17.661 -8.319 29.278 1.00 35.54 O HETATM 2556 O HOH A 109 -13.260 -24.566 9.615 1.00 46.37 O HETATM 2557 O HOH A 110 8.732 -12.376 19.064 1.00 21.80 O HETATM 2558 O HOH A 111 0.657 7.092 0.055 1.00 23.79 O HETATM 2559 O HOH A 112 3.103 14.140 29.737 1.00 56.87 O HETATM 2560 O HOH A 114 -19.066 -6.663 15.948 1.00 52.92 O HETATM 2561 O HOH A 117 -2.983 15.097 3.589 1.00 41.63 O HETATM 2562 O HOH A 118 -22.808 1.331 -2.459 1.00 19.53 O HETATM 2563 O HOH A 119 0.129 19.677 9.101 1.00 30.33 O HETATM 2564 O HOH A 121 -7.491 8.049 -12.867 1.00 43.79 O HETATM 2565 O HOH A 123 23.105 -5.931 9.876 1.00 27.27 O HETATM 2566 O HOH A 124 -9.807 12.257 13.206 1.00 36.70 O HETATM 2567 O HOH A 129 30.565 12.294 14.052 1.00 28.32 O HETATM 2568 O HOH A 131 -8.977 8.574 22.781 1.00 21.51 O HETATM 2569 O HOH A 132 5.450 -18.130 13.285 1.00 57.74 O HETATM 2570 O HOH A 133 20.009 14.351 17.018 1.00 40.14 O HETATM 2571 O HOH A 138 -7.366 12.355 11.207 1.00 23.13 O HETATM 2572 O HOH A 139 10.197 -5.147 17.960 1.00 11.73 O HETATM 2573 O HOH A 140 6.149 8.510 23.991 1.00 21.47 O HETATM 2574 O HOH A 141 6.843 0.522 6.957 1.00 21.40 O HETATM 2575 O HOH A 142 8.149 7.399 6.888 1.00 25.21 O HETATM 2576 O HOH A 143 -7.215 10.537 0.489 1.00 24.85 O HETATM 2577 O HOH A 144 -2.252 10.031 12.976 1.00 22.22 O HETATM 2578 O HOH A 145 -19.580 5.128 13.734 1.00 27.81 O HETATM 2579 O HOH A 146 -23.864 -4.186 1.829 1.00 26.41 O HETATM 2580 O HOH A 147 -10.433 8.219 25.274 1.00 23.38 O HETATM 2581 O HOH A 148 -9.446 4.033 27.964 1.00 44.15 O HETATM 2582 O HOH A 149 -21.401 2.724 0.051 1.00 32.91 O HETATM 2583 O HOH A 150 2.816 0.902 36.005 1.00 23.83 O HETATM 2584 O HOH A 151 -24.561 -1.086 15.847 1.00 24.62 O HETATM 2585 O HOH A 152 -20.752 -4.492 -6.232 1.00 22.54 O HETATM 2586 O HOH A 153 -4.405 -12.031 14.412 1.00 32.65 O HETATM 2587 O HOH A 154 -19.065 11.269 -3.433 1.00 28.73 O HETATM 2588 O HOH A 155 -3.292 -8.106 38.141 1.00 35.68 O HETATM 2589 O HOH A 156 16.066 8.532 12.336 1.00 30.62 O HETATM 2590 O HOH A 157 -19.176 6.139 22.784 1.00 47.64 O HETATM 2591 O HOH A 158 -8.191 1.746 -8.456 1.00 39.85 O HETATM 2592 O HOH A 159 15.008 -7.266 6.583 1.00 30.35 O HETATM 2593 O HOH A 160 15.761 -2.887 24.212 1.00 21.45 O HETATM 2594 O HOH A 161 8.529 -1.405 22.363 1.00 27.24 O HETATM 2595 O HOH A 162 13.806 -11.395 13.285 1.00 49.90 O HETATM 2596 O HOH A 163 -2.920 9.137 38.569 1.00 46.86 O HETATM 2597 O HOH A 165 -19.719 -13.624 2.651 1.00 44.75 O HETATM 2598 O HOH A 166 6.055 -13.207 28.312 1.00 31.39 O HETATM 2599 O HOH A 167 9.909 -11.187 26.690 1.00 33.92 O HETATM 2600 O HOH A 168 -17.040 -3.274 22.451 1.00 33.51 O HETATM 2601 O HOH A 169 -10.880 17.129 25.134 1.00 38.89 O HETATM 2602 O HOH A 170 0.923 14.697 15.666 1.00 30.04 O HETATM 2603 O HOH A 171 -6.917 -15.731 8.334 1.00 42.40 O HETATM 2604 O HOH A 172 -1.033 -1.390 37.335 1.00 51.38 O HETATM 2605 O HOH A 173 2.149 2.121 -1.157 1.00 32.01 O HETATM 2606 O HOH A 174 -17.490 4.443 -10.282 1.00 30.69 O HETATM 2607 O HOH A 176 -21.257 17.186 5.011 1.00 50.09 O HETATM 2608 O HOH A 177 21.181 11.261 22.364 1.00 45.78 O HETATM 2609 O HOH A 179 -16.605 -9.351 -13.208 1.00 47.43 O HETATM 2610 O HOH A 180 -18.635 -8.698 27.178 1.00 55.07 O HETATM 2611 O HOH A 181 -0.399 -19.007 26.966 1.00 38.95 O HETATM 2612 O HOH A 183 17.645 -7.201 14.867 1.00 57.38 O HETATM 2613 O HOH A 184 -11.315 14.477 37.174 1.00 40.47 O HETATM 2614 O HOH A 185 -1.316 -3.924 -3.977 1.00 52.28 O HETATM 2615 O HOH A 186 -7.512 4.319 -17.043 1.00 52.58 O HETATM 2616 O HOH A 187 3.559 -22.992 0.981 1.00 53.13 O HETATM 2617 O HOH A 190 -12.456 9.502 35.292 1.00 57.50 O HETATM 2618 O HOH A 192 -9.277 -5.456 -8.365 1.00 46.52 O HETATM 2619 O HOH A 193 15.216 10.193 -1.481 1.00 54.97 O HETATM 2620 O HOH A 194 -13.403 -17.729 19.965 1.00 54.19 O HETATM 2621 O HOH A 196 -28.826 3.419 7.890 1.00 49.76 O HETATM 2622 O HOH A 197 -12.541 -15.072 27.104 1.00 50.36 O HETATM 2623 O HOH A 198 0.872 4.514 -1.372 1.00 36.12 O HETATM 2624 O HOH A 199 -12.974 -8.858 31.497 1.00 50.09 O HETATM 2625 O HOH A 200 18.933 7.712 15.461 1.00 43.61 O HETATM 2626 O HOH A 201 13.409 5.303 -1.091 1.00 48.94 O HETATM 2627 O HOH A 202 17.448 14.380 14.067 1.00 57.68 O HETATM 2628 O HOH A 203 27.551 13.658 15.765 1.00 51.86 O HETATM 2629 O HOH A 204 -5.302 9.723 -8.933 1.00 55.13 O HETATM 2630 O HOH A 209 6.663 9.371 32.689 1.00 48.81 O HETATM 2631 O HOH A 210 15.727 18.488 19.092 1.00 58.51 O HETATM 2632 O HOH A 211 5.392 1.324 -3.832 1.00 33.85 O HETATM 2633 O HOH A 213 -12.324 13.731 18.080 1.00 41.29 O HETATM 2634 O HOH A 214 18.618 -3.264 25.485 1.00 49.28 O HETATM 2635 O HOH A 221 16.660 3.964 -2.880 1.00 56.95 O HETATM 2636 O HOH A 222 -15.153 -15.965 29.212 1.00 50.37 O HETATM 2637 O HOH A 225 -24.212 -17.100 5.802 1.00 47.37 O HETATM 2638 O HOH A 227 -18.414 3.950 24.983 1.00 38.62 O HETATM 2639 O HOH A 229 -20.551 3.199 12.052 1.00 31.07 O HETATM 2640 O HOH A 230 -24.257 -4.563 4.916 1.00 34.06 O HETATM 2641 O HOH A 231 -23.197 -4.093 14.234 1.00 43.19 O HETATM 2642 O HOH A 232 16.935 -11.671 17.410 1.00 41.16 O HETATM 2643 O HOH A 233 8.724 -10.356 22.413 1.00 27.08 O HETATM 2644 O HOH A 234 0.128 -0.467 39.977 1.00 38.45 O HETATM 2645 O HOH A 235 -3.267 -1.261 -3.867 1.00 48.18 O HETATM 2646 O HOH A 236 -26.566 7.090 -4.456 1.00 36.86 O HETATM 2647 O HOH A 237 -27.128 4.613 -5.090 1.00 28.18 O HETATM 2648 O HOH A 238 -17.402 3.677 -19.460 1.00 37.80 O HETATM 2649 O HOH A 239 -13.599 -5.265 29.433 1.00 34.15 O HETATM 2650 O HOH A 240 20.488 -3.323 22.286 1.00 47.51 O HETATM 2651 O HOH A 241 20.362 7.188 22.086 1.00 50.54 O HETATM 2652 O HOH A 242 -7.835 5.372 38.860 1.00 45.95 O HETATM 2653 O HOH A 243 7.000 -7.487 24.043 1.00 34.41 O HETATM 2654 O HOH A 244 6.507 -13.549 25.857 1.00 33.48 O HETATM 2655 O HOH A 245 -3.159 4.297 -3.357 1.00 35.26 O HETATM 2656 O HOH A 246 11.058 -3.736 1.058 1.00 51.55 O HETATM 2657 O HOH A 247 2.356 -20.202 9.845 1.00 48.93 O HETATM 2658 O HOH A 248 14.508 -9.206 2.211 1.00 41.92 O HETATM 2659 O HOH A 249 -10.292 7.820 -5.614 1.00 39.52 O HETATM 2660 O HOH A 250 -5.313 9.446 -5.027 1.00 40.05 O HETATM 2661 O HOH A 251 -12.113 7.270 -7.591 1.00 42.81 O HETATM 2662 O HOH A 252 -3.627 -1.250 -6.390 1.00 38.58 O HETATM 2663 O HOH A 253 4.866 0.118 34.263 1.00 39.19 O HETATM 2664 O HOH A 254 2.169 8.166 34.514 1.00 50.90 O HETATM 2665 O HOH A 255 5.991 -12.674 22.879 1.00 39.34 O HETATM 2666 O HOH A 256 -11.331 -12.527 -3.446 1.00 51.21 O HETATM 2667 O HOH A 257 10.669 -11.186 29.213 1.00 48.88 O HETATM 2668 O HOH A 258 -13.270 -9.293 38.585 1.00 45.80 O HETATM 2669 O HOH A 259 -3.131 7.962 16.033 1.00 44.69 O HETATM 2670 O HOH A 260 -10.220 14.172 6.016 1.00 44.14 O HETATM 2671 O HOH A 261 15.395 5.563 15.580 1.00 36.02 O HETATM 2672 O HOH A 262 14.820 8.128 14.394 1.00 35.45 O HETATM 2673 O HOH A 263 9.474 -0.429 28.229 1.00 28.23 O HETATM 2674 O HOH A 264 11.533 13.261 9.819 1.00 39.31 O HETATM 2675 O HOH A 265 0.694 16.069 13.667 1.00 37.08 O HETATM 2676 O HOH A 266 -1.414 18.338 15.262 1.00 49.79 O HETATM 2677 O HOH A 267 -5.466 -16.187 6.956 1.00 49.66 O HETATM 2678 O HOH A 268 -3.844 -16.532 5.809 1.00 39.13 O HETATM 2679 O HOH A 269 17.767 11.519 0.559 1.00 41.62 O HETATM 2680 O HOH A 270 -1.190 2.824 -4.731 1.00 48.15 O HETATM 2681 O HOH A 271 -2.508 -0.766 41.390 1.00 49.60 O CONECT 763 2445 CONECT 2445 763 2448 2476 2481 CONECT 2445 2541 2571 CONECT 2446 2447 2448 2449 2453 CONECT 2447 2446 CONECT 2448 2445 2446 CONECT 2449 2446 CONECT 2450 2451 2452 2453 2454 CONECT 2451 2450 CONECT 2452 2450 CONECT 2453 2446 2450 CONECT 2454 2450 2455 CONECT 2455 2454 2456 CONECT 2456 2455 2457 2458 CONECT 2457 2456 2462 CONECT 2458 2456 2459 2460 CONECT 2459 2458 CONECT 2460 2458 2461 2462 CONECT 2461 2460 CONECT 2462 2457 2460 2463 CONECT 2463 2462 2464 2472 CONECT 2464 2463 2465 CONECT 2465 2464 2466 CONECT 2466 2465 2467 2472 CONECT 2467 2466 2468 2469 CONECT 2468 2467 CONECT 2469 2467 2470 CONECT 2470 2469 2471 CONECT 2471 2470 2472 CONECT 2472 2463 2466 2471 CONECT 2476 2445 CONECT 2481 2445 CONECT 2541 2445 CONECT 2571 2445 END