USER MOD reduce.3.24.130724 H: found=0, std=0, add=1328, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1322 hydrogens (0 hets) HEADER STRUCTURAL PROTEIN 13-JUL-16 5LHX TITLE PB3 DOMAIN OF DROSOPHILA MELANOGASTER PLK4 (SAK) COMPND MOL_ID: 1; COMPND 2 MOLECULE: SERINE/THREONINE-PROTEIN KINASE PLK4; COMPND 3 CHAIN: A, B; COMPND 4 FRAGMENT: UNP RESIDUES 657-745; COMPND 5 SYNONYM: POLO-LIKE KINASE 4,PLK-4,SERINE/THREONINE-PROTEIN KINASE COMPND 6 SAK; COMPND 7 EC: 2.7.11.21; COMPND 8 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: DROSOPHILA MELANOGASTER; SOURCE 3 ORGANISM_COMMON: FRUIT FLY; SOURCE 4 ORGANISM_TAXID: 7227; SOURCE 5 GENE: SAK, CG7186; SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI B; SOURCE 7 EXPRESSION_SYSTEM_TAXID: 37762; SOURCE 8 EXPRESSION_SYSTEM_STRAIN: B834 KEYWDS POLO BOX DOMAIN, CENTRIOLE, TRANSFERASE, STRUCTURAL PROTEIN EXPDTA X-RAY DIFFRACTION AUTHOR M.A.COTTEE,S.M.LEA REVDAT 2 08-MAR-17 5LHX 1 JRNL REVDAT 1 01-MAR-17 5LHX 0 JRNL AUTH M.A.COTTEE,S.JOHNSON,J.W.RAFF,S.M.LEA JRNL TITL A KEY CENTRIOLE ASSEMBLY INTERACTION INTERFACE BETWEEN HUMAN JRNL TITL 2 PLK4 AND STIL APPEARS TO NOT BE CONSERVED IN FLIES. JRNL REF BIOL OPEN 2017 JRNL REFN ISSN 2046-6390 JRNL PMID 28202467 JRNL DOI 10.1242/BIO.024661 REMARK 2 REMARK 2 RESOLUTION. 1.53 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : PHENIX (1.10.1_2155) REMARK 3 AUTHORS : PAUL ADAMS,PAVEL AFONINE,VINCENT CHEN,IAN REMARK 3 : DAVIS,KRESHNA GOPAL,RALF GROSSE-KUNSTLEVE, REMARK 3 : LI-WEI HUNG,ROBERT IMMORMINO,TOM IOERGER, REMARK 3 : AIRLIE MCCOY,ERIK MCKEE,NIGEL MORIARTY, REMARK 3 : REETAL PAI,RANDY READ,JANE RICHARDSON, REMARK 3 : DAVID RICHARDSON,TOD ROMO,JIM SACCHETTINI, REMARK 3 : NICHOLAS SAUTER,JACOB SMITH,LAURENT REMARK 3 : STORONI,TOM TERWILLIGER,PETER ZWART REMARK 3 REMARK 3 REFINEMENT TARGET : NULL REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 1.53 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 40.64 REMARK 3 MIN(FOBS/SIGMA_FOBS) : 1.340 REMARK 3 COMPLETENESS FOR RANGE (%) : 97.5 REMARK 3 NUMBER OF REFLECTIONS : 22153 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT. REMARK 3 R VALUE (WORKING + TEST SET) : 0.169 REMARK 3 R VALUE (WORKING SET) : 0.167 REMARK 3 FREE R VALUE : 0.209 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 4.930 REMARK 3 FREE R VALUE TEST SET COUNT : 1092 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT (IN BINS). REMARK 3 BIN RESOLUTION RANGE COMPL. NWORK NFREE RWORK RFREE REMARK 3 1 40.6555 - 3.0597 0.97 2669 134 0.1601 0.1876 REMARK 3 2 3.0597 - 2.4286 0.97 2616 151 0.1883 0.2205 REMARK 3 3 2.4286 - 2.1217 0.98 2637 137 0.1554 0.2134 REMARK 3 4 2.1217 - 1.9277 0.98 2674 122 0.1349 0.2067 REMARK 3 5 1.9277 - 1.7895 0.98 2633 135 0.1425 0.2009 REMARK 3 6 1.7895 - 1.6840 0.98 2635 136 0.1711 0.2698 REMARK 3 7 1.6840 - 1.5997 0.98 2635 131 0.2280 0.2753 REMARK 3 8 1.5997 - 1.5300 0.96 2562 146 0.3161 0.3758 REMARK 3 REMARK 3 BULK SOLVENT MODELLING. REMARK 3 METHOD USED : NULL REMARK 3 SOLVENT RADIUS : 1.11 REMARK 3 SHRINKAGE RADIUS : 0.90 REMARK 3 K_SOL : NULL REMARK 3 B_SOL : NULL REMARK 3 REMARK 3 ERROR ESTIMATES. REMARK 3 COORDINATE ERROR (MAXIMUM-LIKELIHOOD BASED) : 0.220 REMARK 3 PHASE ERROR (DEGREES, MAXIMUM-LIKELIHOOD BASED) : 27.740 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 TWINNING INFORMATION. REMARK 3 FRACTION: NULL REMARK 3 OPERATOR: NULL REMARK 3 REMARK 3 DEVIATIONS FROM IDEAL VALUES. REMARK 3 RMSD COUNT REMARK 3 BOND : 0.010 1322 REMARK 3 ANGLE : 1.014 1799 REMARK 3 CHIRALITY : 0.065 209 REMARK 3 PLANARITY : 0.008 236 REMARK 3 DIHEDRAL : 11.043 794 REMARK 3 REMARK 3 TLS DETAILS REMARK 3 NUMBER OF TLS GROUPS : NULL REMARK 3 REMARK 3 NCS DETAILS REMARK 3 NUMBER OF NCS GROUPS : NULL REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 5LHX COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY PDBE ON 13-JUL-16. REMARK 100 THE DEPOSITION ID IS D_1200000760. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 22-NOV-15 REMARK 200 TEMPERATURE (KELVIN) : 100 REMARK 200 PH : 7.5 REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : Y REMARK 200 RADIATION SOURCE : DIAMOND REMARK 200 BEAMLINE : I03 REMARK 200 X-RAY GENERATOR MODEL : NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 0.9795 REMARK 200 MONOCHROMATOR : NULL REMARK 200 OPTICS : NULL REMARK 200 REMARK 200 DETECTOR TYPE : PIXEL REMARK 200 DETECTOR MANUFACTURER : DECTRIS PILATUS 6M REMARK 200 INTENSITY-INTEGRATION SOFTWARE : XDS REMARK 200 DATA SCALING SOFTWARE : AIMLESS REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 22170 REMARK 200 RESOLUTION RANGE HIGH (A) : 1.530 REMARK 200 RESOLUTION RANGE LOW (A) : 40.641 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : NULL REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 97.8 REMARK 200 DATA REDUNDANCY : 3.700 REMARK 200 R MERGE (I) : NULL REMARK 200 R SYM (I) : NULL REMARK 200 FOR THE DATA SET : 11.3000 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 1.53 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : NULL REMARK 200 COMPLETENESS FOR SHELL (%) : NULL REMARK 200 DATA REDUNDANCY IN SHELL : NULL REMARK 200 R MERGE FOR SHELL (I) : 0.89100 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: MOLECULAR REPLACEMENT REMARK 200 SOFTWARE USED: PHASER REMARK 200 STARTING MODEL: 4YYP REMARK 200 REMARK 200 REMARK: LARGE TEARDROPS REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 36.17 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 1.93 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: 150 NL PROTEIN SOLUTION (40.0 MG/ML REMARK 280 PROTEIN IN IN 20 MM TRIS PH 7.5, 150 MM NACL, 2 MM DTT) AND 50 REMARK 280 NL MOTHER LIQUOR (1.5 M AMMONIUM SULPHATE, 2% V/V PEG400, 100 MM REMARK 280 NA HEPES PH 7.5), VAPOR DIFFUSION, SITTING DROP, TEMPERATURE 292K 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 26.07000 REMARK 290 SMTRY3 2 0.000000 0.000000 -1.000000 0.00000 REMARK 290 REMARK 290 REMARK: NULL REMARK 300 REMARK 300 BIOMOLECULE: 1, 2 REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON REMARK 300 BURIED SURFACE AREA. REMARK 350 REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. REMARK 350 REMARK 350 BIOMOLECULE: 1 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: MONOMERIC REMARK 350 APPLY THE FOLLOWING TO CHAINS: A REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 350 REMARK 350 BIOMOLECULE: 2 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: MONOMERIC REMARK 350 APPLY THE FOLLOWING TO CHAINS: B REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 465 REMARK 465 MISSING RESIDUES REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE REMARK 465 EXPERIMENT. (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 465 IDENTIFIER; SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.) REMARK 465 REMARK 465 M RES C SSSEQI REMARK 465 GLY A 653 REMARK 465 PRO A 654 REMARK 465 MET A 655 REMARK 465 GLY A 656 REMARK 465 GLN A 657 REMARK 465 SER A 745 REMARK 465 GLY B 653 REMARK 465 PRO B 654 REMARK 465 MET B 655 REMARK 465 GLY B 656 REMARK 465 GLN B 657 REMARK 465 ASN B 658 REMARK 465 ILE B 659 REMARK 465 SER B 745 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 GLU A 668 -5.60 75.95 REMARK 500 GLU B 668 -22.16 77.67 REMARK 500 ILE B 669 -60.68 -104.51 REMARK 500 REMARK 500 REMARK: NULL DBREF 5LHX A 657 745 UNP O97143 PLK4_DROME 657 745 DBREF 5LHX B 657 745 UNP O97143 PLK4_DROME 657 745 SEQADV 5LHX GLY A 653 UNP O97143 EXPRESSION TAG SEQADV 5LHX PRO A 654 UNP O97143 EXPRESSION TAG SEQADV 5LHX MET A 655 UNP O97143 EXPRESSION TAG SEQADV 5LHX GLY A 656 UNP O97143 EXPRESSION TAG SEQADV 5LHX GLY B 653 UNP O97143 EXPRESSION TAG SEQADV 5LHX PRO B 654 UNP O97143 EXPRESSION TAG SEQADV 5LHX MET B 655 UNP O97143 EXPRESSION TAG SEQADV 5LHX GLY B 656 UNP O97143 EXPRESSION TAG SEQRES 1 A 93 GLY PRO MET GLY GLN ASN ILE PRO ILE LYS ARG ILE ASN SEQRES 2 A 93 VAL PRO GLU ILE GLY ILE ALA THR GLU LEU SER HIS GLY SEQRES 3 A 93 VAL VAL GLN VAL GLN PHE TYR ASP GLY SER VAL VAL SER SEQRES 4 A 93 VAL ILE PRO SER MET GLN GLY GLY GLY ILE THR TYR THR SEQRES 5 A 93 GLN PRO ASN GLY THR SER THR HIS PHE GLY LYS GLY ASP SEQRES 6 A 93 ASP LEU PRO PHE PRO VAL ARG ASP ARG VAL GLY GLN ILE SEQRES 7 A 93 PRO ASN ILE GLN LEU LYS LEU LYS THR ALA PRO LEU LEU SEQRES 8 A 93 GLY SER SEQRES 1 B 93 GLY PRO MET GLY GLN ASN ILE PRO ILE LYS ARG ILE ASN SEQRES 2 B 93 VAL PRO GLU ILE GLY ILE ALA THR GLU LEU SER HIS GLY SEQRES 3 B 93 VAL VAL GLN VAL GLN PHE TYR ASP GLY SER VAL VAL SER SEQRES 4 B 93 VAL ILE PRO SER MET GLN GLY GLY GLY ILE THR TYR THR SEQRES 5 B 93 GLN PRO ASN GLY THR SER THR HIS PHE GLY LYS GLY ASP SEQRES 6 B 93 ASP LEU PRO PHE PRO VAL ARG ASP ARG VAL GLY GLN ILE SEQRES 7 B 93 PRO ASN ILE GLN LEU LYS LEU LYS THR ALA PRO LEU LEU SEQRES 8 B 93 GLY SER FORMUL 3 HOH *35(H2 O) HELIX 1 AA1 PRO A 694 GLY A 698 5 5 HELIX 2 AA2 PRO A 722 GLY A 728 1 7 HELIX 3 AA3 GLN A 729 THR A 739 1 11 HELIX 4 AA4 PRO B 720 GLY B 728 1 9 HELIX 5 AA5 GLN B 729 ALA B 740 1 12 SHEET 1 AA1 6 PRO A 660 VAL A 666 0 SHEET 2 AA1 6 GLY A 670 LEU A 675 -1 O GLY A 670 N VAL A 666 SHEET 3 AA1 6 VAL A 680 PHE A 684 -1 O GLN A 683 N ILE A 671 SHEET 4 AA1 6 VAL A 689 VAL A 692 -1 O VAL A 692 N VAL A 680 SHEET 5 AA1 6 ILE A 701 THR A 704 -1 O THR A 704 N VAL A 689 SHEET 6 AA1 6 SER A 710 PHE A 713 -1 O PHE A 713 N ILE A 701 SHEET 1 AA2 6 LYS B 662 VAL B 666 0 SHEET 2 AA2 6 GLY B 670 GLU B 674 -1 O GLY B 670 N VAL B 666 SHEET 3 AA2 6 VAL B 680 PHE B 684 -1 O GLN B 681 N THR B 673 SHEET 4 AA2 6 VAL B 689 VAL B 692 -1 O VAL B 690 N VAL B 682 SHEET 5 AA2 6 ILE B 701 THR B 704 -1 O THR B 704 N VAL B 689 SHEET 6 AA2 6 SER B 710 PHE B 713 -1 O PHE B 713 N ILE B 701 CISPEP 1 PHE A 721 PRO A 722 0 -0.64 CRYST1 35.870 52.140 42.530 90.00 107.14 90.00 P 1 21 1 4 ORIGX1 1.000000 0.000000 0.000000 0.00000 ORIGX2 0.000000 1.000000 0.000000 0.00000 ORIGX3 0.000000 0.000000 1.000000 0.00000 SCALE1 0.027878 0.000000 0.008598 0.00000 SCALE2 0.000000 0.019179 0.000000 0.00000 SCALE3 0.000000 0.000000 0.024606 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 685 TYR OH : rot -145:sc= 1.54 USER MOD Set 1.2: B 729 GLN : amide:sc= 1.66 K(o=3.2,f=0.99) USER MOD Set 2.1: B 707 ASN : amide:sc= -0.576! C(o=-0.53!,f=-10!) USER MOD Set 2.2: B 709 THR OG1 : rot 84:sc= 0.0457 USER MOD Set 3.1: B 704 THR OG1 : rot 180:sc= 0 USER MOD Set 3.2: B 710 SER OG : rot 180:sc= 0 USER MOD Set 4.1: B 702 THR OG1 : rot 180:sc= 0.0113 USER MOD Set 4.2: B 712 HIS : no HE2:sc= 0.0117 X(o=0.023,f=-0.3) USER MOD Set 5.1: B 676 SER OG : rot -91:sc= 0.0105 USER MOD Set 5.2: B 677 HIS : no HD1:sc= 0 X(o=0.01,f=-0.093) USER MOD Set 6.1: A 704 THR OG1 : rot -79:sc= 2.36 USER MOD Set 6.2: A 710 SER OG : rot 95:sc= 2.34 USER MOD Set 7.1: A 707 ASN : amide:sc= -0.514 K(o=-0.42,f=-6.2!) USER MOD Set 7.2: A 709 THR OG1 : rot 86:sc= 0.0951 USER MOD Set 8.1: A 688 SER OG : rot 83:sc= -0.281 USER MOD Set 8.2: A 703 TYR OH : rot 146:sc= 1.47 USER MOD Set 9.1: A 702 THR OG1 : rot 180:sc= 0.0754 USER MOD Set 9.2: A 712 HIS : no HE2:sc= 0.0725 K(o=0.15,f=-0.83) USER MOD Set10.1: A 658 ASN : amide:sc= -1.6! C(o=0.76!,f=0.58!) USER MOD Set10.2: A 676 SER OG : rot -66:sc= 0.979 USER MOD Set10.3: A 677 HIS : no HD1:sc= 0.327 K(o=0.76,f=-2.2!) USER MOD Set10.4: A 697 GLN : amide:sc= 1.06 K(o=0.76,f=-3.5) USER MOD Set11.1: A 681 GLN : amide:sc= 0.243 K(o=0.46,f=-0.043) USER MOD Set11.2: A 691 SER OG : rot 150:sc= 0.221 USER MOD Single : A 662 LYS NZ :NH3+ -132:sc= -0.115 (180deg=-0.402) USER MOD Single : A 665 ASN : amide:sc= -0.145 K(o=-0.15,f=-2) USER MOD Single : A 673 THR OG1 : rot -11:sc= 1.49 USER MOD Single : A 683 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 695 SER OG : rot 180:sc= 0 USER MOD Single : A 696 MET CE :methyl -160:sc= -0.0618 (180deg=-0.238) USER MOD Single : A 705 GLN : amide:sc= 0.822 K(o=0.82,f=-0.32) USER MOD Single : A 711 THR OG1 : rot -8:sc= 1.04 USER MOD Single : A 715 LYS NZ :NH3+ -164:sc= 0 (180deg=-0.216) USER MOD Single : A 729 GLN : amide:sc= 0.984 K(o=0.98,f=-0.99) USER MOD Single : A 732 ASN : amide:sc= -0.289 X(o=-0.29,f=-0.15) USER MOD Single : A 734 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 736 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 738 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0299) USER MOD Single : A 739 THR OG1 : rot 180:sc= 0 USER MOD Single : B 662 LYS NZ :NH3+ 145:sc= 0.41 (180deg=0.0625) USER MOD Single : B 665 ASN : amide:sc= -0.983 K(o=-0.98,f=-3.2!) USER MOD Single : B 673 THR OG1 : rot 94:sc= 0.551 USER MOD Single : B 681 GLN : amide:sc= 0.0723 X(o=0.072,f=0.34) USER MOD Single : B 683 GLN : amide:sc= 0.988 K(o=0.99,f=0.18) USER MOD Single : B 685 TYR OH : rot 180:sc= 0 USER MOD Single : B 688 SER OG : rot -73:sc= 1.5 USER MOD Single : B 691 SER OG : rot 180:sc= 0 USER MOD Single : B 695 SER OG : rot 180:sc= 0 USER MOD Single : B 696 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 697 GLN : amide:sc= -0.185 K(o=-0.18,f=-1.9!) USER MOD Single : B 703 TYR OH : rot 163:sc= 1.29 USER MOD Single : B 705 GLN : amide:sc= 0 X(o=0,f=-0.39) USER MOD Single : B 711 THR OG1 : rot 87:sc= 0.748 USER MOD Single : B 715 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 732 ASN : amide:sc= -0.384 X(o=-0.38,f=-0.015) USER MOD Single : B 734 GLN : amide:sc= -0.0151 K(o=-0.015,f=-1.7!) USER MOD Single : B 736 LYS NZ :NH3+ -152:sc= -0.0305 (180deg=-0.2) USER MOD Single : B 738 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 739 THR OG1 : rot -36:sc= 1.34 USER MOD ----------------------------------------------------------------- ATOM 1 N ASN A 658 30.449 12.511 13.942 1.00 55.63 N ANISOU 1 N ASN A 658 7310 7371 6458 -308 544 -182 N ATOM 2 CA ASN A 658 31.600 13.347 13.645 1.00 55.10 C ANISOU 2 CA ASN A 658 7299 7176 6458 -436 716 -61 C ATOM 3 C ASN A 658 32.842 12.779 14.356 1.00 52.30 C ANISOU 3 C ASN A 658 6730 6839 6303 -403 908 178 C ATOM 4 O ASN A 658 32.749 11.743 14.999 1.00 52.41 O ANISOU 4 O ASN A 658 6765 6840 6306 -415 931 303 O ATOM 5 CB ASN A 658 31.298 14.779 14.066 1.00 57.46 C ANISOU 5 CB ASN A 658 7695 7524 6612 -493 532 -224 C ATOM 6 CG ASN A 658 32.360 15.751 13.634 1.00 58.36 C ANISOU 6 CG ASN A 658 7617 7802 6753 -597 100 -464 C ATOM 7 OD1 ASN A 658 32.741 16.637 14.394 1.00 58.69 O ANISOU 7 OD1 ASN A 658 7703 7789 6808 -589 -160 -499 O ATOM 8 ND2 ASN A 658 32.857 15.589 12.413 1.00 59.41 N ANISOU 8 ND2 ASN A 658 7626 7966 6981 -532 -56 -680 N ATOM 0 HA ASN A 658 31.786 13.351 12.693 1.00 55.10 H new ATOM 0 HB2 ASN A 658 30.446 15.049 13.689 1.00 57.46 H new ATOM 0 HB3 ASN A 658 31.206 14.815 15.031 1.00 57.46 H new ATOM 0 HD21 ASN A 658 33.472 16.117 12.125 1.00 59.41 H new ATOM 0 HD22 ASN A 658 32.564 14.956 11.910 1.00 59.41 H new ATOM 14 N ILE A 659 33.999 13.428 14.242 1.00 49.69 N ANISOU 14 N ILE A 659 6349 6540 5991 -588 1118 175 N ATOM 15 CA ILE A 659 35.248 12.843 14.733 1.00 49.16 C ANISOU 15 CA ILE A 659 6197 6661 5820 -898 1560 -198 C ATOM 16 C ILE A 659 35.269 12.827 16.258 1.00 46.70 C ANISOU 16 C ILE A 659 5456 6392 5897 -1180 1512 -439 C ATOM 17 O ILE A 659 35.215 13.891 16.891 1.00 45.11 O ANISOU 17 O ILE A 659 4711 6227 6203 -1629 1446 -443 O ATOM 18 CB ILE A 659 36.470 13.597 14.182 1.00 50.73 C ANISOU 18 CB ILE A 659 6792 6983 5501 -723 1966 -315 C ATOM 19 CG1 ILE A 659 36.528 13.459 12.658 1.00 51.67 C ANISOU 19 CG1 ILE A 659 7139 7085 5410 -780 2190 -602 C ATOM 20 CG2 ILE A 659 37.769 13.063 14.804 1.00 51.54 C ANISOU 20 CG2 ILE A 659 6938 7172 5473 -545 2191 -158 C ATOM 21 CD1 ILE A 659 37.604 14.310 11.990 1.00 53.23 C ANISOU 21 CD1 ILE A 659 7436 7356 5435 -760 2429 -467 C ATOM 0 H ILE A 659 34.084 14.206 13.885 1.00 49.69 H new ATOM 0 HA ILE A 659 35.295 11.928 14.414 1.00 49.16 H new ATOM 0 HB ILE A 659 36.380 14.534 14.416 1.00 50.73 H new ATOM 0 HG12 ILE A 659 36.682 12.528 12.434 1.00 51.67 H new ATOM 0 HG13 ILE A 659 35.664 13.701 12.289 1.00 51.67 H new ATOM 0 HG21 ILE A 659 38.525 13.551 14.443 1.00 51.54 H new ATOM 0 HG22 ILE A 659 37.739 13.179 15.767 1.00 51.54 H new ATOM 0 HG23 ILE A 659 37.864 12.120 14.596 1.00 51.54 H new ATOM 0 HD11 ILE A 659 37.579 14.169 11.031 1.00 53.23 H new ATOM 0 HD12 ILE A 659 37.442 15.247 12.184 1.00 53.23 H new ATOM 0 HD13 ILE A 659 38.476 14.056 12.331 1.00 53.23 H new ATOM 33 N PRO A 660 35.349 11.661 16.899 1.00 45.57 N ANISOU 33 N PRO A 660 5273 6383 5657 -956 1646 -675 N ATOM 34 CA PRO A 660 35.482 11.651 18.359 1.00 43.13 C ANISOU 34 CA PRO A 660 4620 6403 5365 -701 1230 -574 C ATOM 35 C PRO A 660 36.852 12.152 18.783 1.00 41.65 C ANISOU 35 C PRO A 660 4113 6352 5359 -403 1563 -545 C ATOM 36 O PRO A 660 37.875 11.746 18.232 1.00 41.45 O ANISOU 36 O PRO A 660 3931 6647 5172 -81 1622 -710 O ATOM 37 CB PRO A 660 35.278 10.178 18.726 1.00 45.29 C ANISOU 37 CB PRO A 660 5140 6626 5443 -560 1352 -594 C ATOM 38 CG PRO A 660 34.516 9.618 17.589 1.00 46.52 C ANISOU 38 CG PRO A 660 5583 6647 5446 -931 1411 -727 C ATOM 39 CD PRO A 660 35.040 10.318 16.386 1.00 46.80 C ANISOU 39 CD PRO A 660 5529 6601 5651 -877 1649 -639 C ATOM 0 HA PRO A 660 34.849 12.235 18.805 1.00 43.13 H new ATOM 0 HB2 PRO A 660 36.126 9.722 18.842 1.00 45.29 H new ATOM 0 HB3 PRO A 660 34.790 10.085 19.559 1.00 45.29 H new ATOM 0 HG2 PRO A 660 34.644 8.659 17.520 1.00 46.52 H new ATOM 0 HG3 PRO A 660 33.564 9.770 17.696 1.00 46.52 H new ATOM 0 HD2 PRO A 660 35.828 9.879 16.029 1.00 46.80 H new ATOM 0 HD3 PRO A 660 34.384 10.348 15.672 1.00 46.80 H new ATOM 47 N ILE A 661 36.866 13.038 19.768 1.00 38.83 N ANISOU 47 N ILE A 661 3473 5739 5542 -471 1437 -379 N ATOM 48 CA ILE A 661 38.115 13.487 20.358 1.00 40.86 C ANISOU 48 CA ILE A 661 3975 5483 6066 -699 1450 -198 C ATOM 49 C ILE A 661 38.268 13.022 21.799 1.00 38.84 C ANISOU 49 C ILE A 661 3219 5154 6384 -482 909 118 C ATOM 50 O ILE A 661 39.403 12.924 22.282 1.00 40.35 O ANISOU 50 O ILE A 661 3179 5373 6778 -255 808 444 O ATOM 51 CB ILE A 661 38.265 15.020 20.240 1.00 43.26 C ANISOU 51 CB ILE A 661 4630 5668 6139 -712 1452 -219 C ATOM 52 CG1 ILE A 661 37.203 15.771 21.033 1.00 42.12 C ANISOU 52 CG1 ILE A 661 4176 5659 6168 -801 742 -328 C ATOM 53 CG2 ILE A 661 38.136 15.415 18.774 1.00 44.99 C ANISOU 53 CG2 ILE A 661 5270 5756 6068 -528 1517 -80 C ATOM 54 CD1 ILE A 661 37.383 17.299 21.001 1.00 42.64 C ANISOU 54 CD1 ILE A 661 4312 5760 6127 -819 711 -35 C ATOM 0 H ILE A 661 36.161 13.392 20.110 1.00 38.83 H new ATOM 0 HA ILE A 661 38.835 13.077 19.853 1.00 40.86 H new ATOM 0 HB ILE A 661 39.134 15.257 20.601 1.00 43.26 H new ATOM 0 HG12 ILE A 661 36.327 15.548 20.680 1.00 42.12 H new ATOM 0 HG13 ILE A 661 37.223 15.469 21.955 1.00 42.12 H new ATOM 0 HG21 ILE A 661 38.229 16.377 18.688 1.00 44.99 H new ATOM 0 HG22 ILE A 661 38.831 14.976 18.258 1.00 44.99 H new ATOM 0 HG23 ILE A 661 37.266 15.144 18.441 1.00 44.99 H new ATOM 0 HD11 ILE A 661 36.680 17.719 21.521 1.00 42.64 H new ATOM 0 HD12 ILE A 661 38.246 17.531 21.378 1.00 42.64 H new ATOM 0 HD13 ILE A 661 37.336 17.611 20.084 1.00 42.64 H new ATOM 66 N LYS A 662 37.179 12.684 22.479 1.00 36.53 N ANISOU 66 N LYS A 662 2932 4697 6252 -236 792 475 N ATOM 67 CA LYS A 662 37.238 11.993 23.744 1.00 35.38 C ANISOU 67 CA LYS A 662 2611 4554 6279 56 479 470 C ATOM 68 C LYS A 662 36.110 10.982 23.740 1.00 34.55 C ANISOU 68 C LYS A 662 2457 4361 6311 99 968 348 C ATOM 69 O LYS A 662 35.058 11.210 23.140 1.00 32.20 O ANISOU 69 O LYS A 662 2406 3661 6168 -34 672 359 O ATOM 70 CB LYS A 662 37.122 12.932 24.936 1.00 37.70 C ANISOU 70 CB LYS A 662 2932 5000 6392 -220 459 511 C ATOM 71 CG LYS A 662 38.249 13.938 25.012 1.00 41.94 C ANISOU 71 CG LYS A 662 3901 5409 6624 -857 644 244 C ATOM 72 CD LYS A 662 37.873 15.104 25.884 1.00 46.03 C ANISOU 72 CD LYS A 662 4546 6036 6906 -1165 483 280 C ATOM 73 CE LYS A 662 39.119 15.870 26.382 1.00 49.57 C ANISOU 73 CE LYS A 662 5025 6628 7182 -1459 566 143 C ATOM 74 NZ LYS A 662 40.102 15.013 27.158 1.00 52.46 N ANISOU 74 NZ LYS A 662 5574 7027 7332 -1391 680 -56 N ATOM 0 H LYS A 662 36.380 12.854 22.210 1.00 36.53 H new ATOM 0 HA LYS A 662 38.102 11.563 23.841 1.00 35.38 H new ATOM 0 HB2 LYS A 662 36.277 13.405 24.887 1.00 37.70 H new ATOM 0 HB3 LYS A 662 37.107 12.409 25.753 1.00 37.70 H new ATOM 0 HG2 LYS A 662 39.045 13.510 25.364 1.00 41.94 H new ATOM 0 HG3 LYS A 662 38.466 14.253 24.121 1.00 41.94 H new ATOM 0 HD2 LYS A 662 37.299 15.708 25.388 1.00 46.03 H new ATOM 0 HD3 LYS A 662 37.362 14.788 26.645 1.00 46.03 H new ATOM 0 HE2 LYS A 662 39.575 16.258 25.619 1.00 49.57 H new ATOM 0 HE3 LYS A 662 38.831 16.606 26.945 1.00 49.57 H new ATOM 0 HZ1 LYS A 662 40.331 15.430 27.910 1.00 52.46 H new ATOM 0 HZ2 LYS A 662 39.724 14.232 27.356 1.00 52.46 H new ATOM 0 HZ3 LYS A 662 40.829 14.873 26.664 1.00 52.46 H new ATOM 88 N ARG A 663 36.354 9.859 24.388 1.00 34.33 N ANISOU 88 N ARG A 663 2239 4436 6367 214 828 318 N ATOM 89 CA ARG A 663 35.315 8.862 24.576 1.00 34.04 C ANISOU 89 CA ARG A 663 2265 4170 6499 292 1079 645 C ATOM 90 C ARG A 663 35.634 8.096 25.835 1.00 35.17 C ANISOU 90 C ARG A 663 2396 4310 6659 412 528 584 C ATOM 91 O ARG A 663 36.757 7.618 25.995 1.00 38.64 O ANISOU 91 O ARG A 663 2936 4461 7284 405 823 827 O ATOM 92 CB ARG A 663 35.209 7.919 23.384 1.00 33.05 C ANISOU 92 CB ARG A 663 2384 4052 6123 318 1491 764 C ATOM 93 CG ARG A 663 34.177 6.829 23.586 1.00 35.40 C ANISOU 93 CG ARG A 663 3050 4264 6136 350 1462 254 C ATOM 94 CD ARG A 663 33.983 6.037 22.311 1.00 39.51 C ANISOU 94 CD ARG A 663 3889 4854 6270 -71 1356 44 C ATOM 95 NE ARG A 663 33.155 6.809 21.397 1.00 40.71 N ANISOU 95 NE ARG A 663 4053 4999 6416 446 1284 365 N ATOM 96 CZ ARG A 663 33.153 6.687 20.072 1.00 43.41 C ANISOU 96 CZ ARG A 663 4721 5036 6736 462 1470 338 C ATOM 97 NH1 ARG A 663 33.959 5.825 19.462 1.00 44.82 N ANISOU 97 NH1 ARG A 663 5150 5018 6861 726 2128 -113 N ATOM 98 NH2 ARG A 663 32.334 7.444 19.356 1.00 43.48 N ANISOU 98 NH2 ARG A 663 5084 4818 6620 -74 1047 609 N ATOM 0 H ARG A 663 37.116 9.652 24.729 1.00 34.33 H new ATOM 0 HA ARG A 663 34.455 9.304 24.653 1.00 34.04 H new ATOM 0 HB2 ARG A 663 34.982 8.431 22.592 1.00 33.05 H new ATOM 0 HB3 ARG A 663 36.075 7.513 23.221 1.00 33.05 H new ATOM 0 HG2 ARG A 663 34.460 6.237 24.301 1.00 35.40 H new ATOM 0 HG3 ARG A 663 33.334 7.222 23.860 1.00 35.40 H new ATOM 0 HD2 ARG A 663 34.841 5.843 21.903 1.00 39.51 H new ATOM 0 HD3 ARG A 663 33.562 5.185 22.506 1.00 39.51 H new ATOM 0 HE ARG A 663 32.624 7.391 21.741 1.00 40.71 H new ATOM 0 HH11 ARG A 663 34.493 5.335 19.924 1.00 44.82 H new ATOM 0 HH12 ARG A 663 33.946 5.757 18.605 1.00 44.82 H new ATOM 0 HH21 ARG A 663 31.813 8.005 19.749 1.00 43.48 H new ATOM 0 HH22 ARG A 663 32.323 7.375 18.499 1.00 43.48 H new ATOM 112 N ILE A 664 34.641 7.966 26.708 1.00 31.94 N ANISOU 112 N ILE A 664 1894 4097 6146 366 -51 449 N ATOM 113 CA ILE A 664 34.794 7.281 27.976 1.00 31.74 C ANISOU 113 CA ILE A 664 2558 4014 5487 281 -406 393 C ATOM 114 C ILE A 664 33.597 6.376 28.200 1.00 30.32 C ANISOU 114 C ILE A 664 2614 3902 5003 618 -383 669 C ATOM 115 O ILE A 664 32.473 6.687 27.796 1.00 29.32 O ANISOU 115 O ILE A 664 2896 3719 4525 411 -199 1125 O ATOM 116 CB ILE A 664 34.930 8.255 29.158 1.00 34.78 C ANISOU 116 CB ILE A 664 3364 4548 5304 1 -652 211 C ATOM 117 CG1 ILE A 664 33.762 9.232 29.186 1.00 37.65 C ANISOU 117 CG1 ILE A 664 4336 4636 5334 -7 -326 338 C ATOM 118 CG2 ILE A 664 36.239 8.986 29.063 1.00 37.63 C ANISOU 118 CG2 ILE A 664 3826 4838 5635 -436 -229 -295 C ATOM 119 CD1 ILE A 664 33.644 10.019 30.467 1.00 38.25 C ANISOU 119 CD1 ILE A 664 4609 4699 5225 303 -406 411 C ATOM 0 H ILE A 664 33.851 8.279 26.575 1.00 31.94 H new ATOM 0 HA ILE A 664 35.613 6.763 27.934 1.00 31.74 H new ATOM 0 HB ILE A 664 34.914 7.751 29.987 1.00 34.78 H new ATOM 0 HG12 ILE A 664 33.854 9.851 28.445 1.00 37.65 H new ATOM 0 HG13 ILE A 664 32.938 8.740 29.044 1.00 37.65 H new ATOM 0 HG21 ILE A 664 36.322 9.600 29.810 1.00 37.63 H new ATOM 0 HG22 ILE A 664 36.969 8.348 29.087 1.00 37.63 H new ATOM 0 HG23 ILE A 664 36.272 9.484 28.231 1.00 37.63 H new ATOM 0 HD11 ILE A 664 32.882 10.616 30.411 1.00 38.25 H new ATOM 0 HD12 ILE A 664 33.522 9.409 31.212 1.00 38.25 H new ATOM 0 HD13 ILE A 664 34.452 10.538 30.604 1.00 38.25 H new ATOM 131 N ASN A 665 33.839 5.274 28.904 1.00 32.74 N ANISOU 131 N ASN A 665 3372 3847 5220 495 150 630 N ATOM 132 CA ASN A 665 32.751 4.496 29.467 1.00 33.46 C ANISOU 132 CA ASN A 665 3441 4258 5015 430 -650 690 C ATOM 133 C ASN A 665 32.306 5.152 30.765 1.00 32.23 C ANISOU 133 C ASN A 665 3356 4484 4408 -232 -878 434 C ATOM 134 O ASN A 665 33.130 5.532 31.596 1.00 36.03 O ANISOU 134 O ASN A 665 3498 5359 4832 -352 -435 456 O ATOM 135 CB ASN A 665 33.191 3.051 29.727 1.00 40.26 C ANISOU 135 CB ASN A 665 4363 4901 6033 1082 -489 670 C ATOM 136 CG ASN A 665 33.475 2.284 28.445 1.00 46.62 C ANISOU 136 CG ASN A 665 5300 5613 6799 1422 -130 498 C ATOM 137 OD1 ASN A 665 32.946 2.605 27.383 1.00 49.23 O ANISOU 137 OD1 ASN A 665 5452 5975 7279 1637 -5 474 O ATOM 138 ND2 ASN A 665 34.307 1.263 28.541 1.00 50.52 N ANISOU 138 ND2 ASN A 665 6073 5889 7235 1312 355 195 N ATOM 0 H ASN A 665 34.625 4.964 29.065 1.00 32.74 H new ATOM 0 HA ASN A 665 32.013 4.472 28.838 1.00 33.46 H new ATOM 0 HB2 ASN A 665 33.987 3.054 30.281 1.00 40.26 H new ATOM 0 HB3 ASN A 665 32.499 2.591 30.228 1.00 40.26 H new ATOM 0 HD21 ASN A 665 34.496 0.795 27.844 1.00 50.52 H new ATOM 0 HD22 ASN A 665 34.660 1.066 29.300 1.00 50.52 H new ATOM 145 N VAL A 666 31.005 5.304 30.934 1.00 29.27 N ANISOU 145 N VAL A 666 3162 4218 3743 -500 -955 451 N ATOM 146 CA VAL A 666 30.460 5.845 32.169 1.00 30.96 C ANISOU 146 CA VAL A 666 3419 4336 4006 -775 -621 437 C ATOM 147 C VAL A 666 29.744 4.690 32.858 1.00 32.78 C ANISOU 147 C VAL A 666 3327 4650 4480 -392 -528 759 C ATOM 148 O VAL A 666 28.639 4.309 32.444 1.00 31.03 O ANISOU 148 O VAL A 666 3396 4188 4206 -399 -372 844 O ATOM 149 CB VAL A 666 29.529 7.033 31.888 1.00 30.83 C ANISOU 149 CB VAL A 666 3729 4083 3902 -942 -239 428 C ATOM 150 CG1 VAL A 666 28.957 7.593 33.186 1.00 32.86 C ANISOU 150 CG1 VAL A 666 4214 4388 3886 -1000 17 359 C ATOM 151 CG2 VAL A 666 30.266 8.110 31.115 1.00 33.88 C ANISOU 151 CG2 VAL A 666 4308 4414 4153 -916 335 428 C ATOM 0 H VAL A 666 30.415 5.099 30.343 1.00 29.27 H new ATOM 0 HA VAL A 666 31.156 6.199 32.745 1.00 30.96 H new ATOM 0 HB VAL A 666 28.788 6.720 31.346 1.00 30.83 H new ATOM 0 HG11 VAL A 666 28.373 8.341 32.986 1.00 32.86 H new ATOM 0 HG12 VAL A 666 28.452 6.902 33.642 1.00 32.86 H new ATOM 0 HG13 VAL A 666 29.682 7.893 33.757 1.00 32.86 H new ATOM 0 HG21 VAL A 666 29.667 8.854 30.944 1.00 33.88 H new ATOM 0 HG22 VAL A 666 31.025 8.419 31.634 1.00 33.88 H new ATOM 0 HG23 VAL A 666 30.578 7.747 30.271 1.00 33.88 H new ATOM 161 N PRO A 667 30.335 4.081 33.878 1.00 36.74 N ANISOU 161 N PRO A 667 3393 5513 5055 -115 -873 434 N ATOM 162 CA PRO A 667 29.746 2.857 34.427 1.00 37.84 C ANISOU 162 CA PRO A 667 3718 5595 5063 82 -610 882 C ATOM 163 C PRO A 667 28.301 3.076 34.838 1.00 36.14 C ANISOU 163 C PRO A 667 3781 5290 4661 -23 -368 843 C ATOM 164 O PRO A 667 27.952 4.107 35.416 1.00 37.37 O ANISOU 164 O PRO A 667 4280 5571 4350 -521 -235 946 O ATOM 165 CB PRO A 667 30.640 2.538 35.626 1.00 40.21 C ANISOU 165 CB PRO A 667 3990 5962 5324 -206 -624 389 C ATOM 166 CG PRO A 667 31.922 3.139 35.294 1.00 41.02 C ANISOU 166 CG PRO A 667 3967 6076 5543 -112 -539 630 C ATOM 167 CD PRO A 667 31.638 4.383 34.500 1.00 38.91 C ANISOU 167 CD PRO A 667 3606 5794 5382 -216 -952 392 C ATOM 0 HA PRO A 667 29.713 2.130 33.786 1.00 37.84 H new ATOM 0 HB2 PRO A 667 30.278 2.909 36.446 1.00 40.21 H new ATOM 0 HB3 PRO A 667 30.723 1.581 35.760 1.00 40.21 H new ATOM 0 HG2 PRO A 667 32.419 3.353 36.099 1.00 41.02 H new ATOM 0 HG3 PRO A 667 32.467 2.522 34.780 1.00 41.02 H new ATOM 0 HD2 PRO A 667 31.593 5.169 35.066 1.00 38.91 H new ATOM 0 HD3 PRO A 667 32.324 4.551 33.835 1.00 38.91 H new ATOM 175 N GLU A 668 27.459 2.103 34.497 1.00 32.14 N ANISOU 175 N GLU A 668 3280 4596 4336 -397 -456 1027 N ATOM 176 CA GLU A 668 26.042 2.047 34.810 1.00 32.84 C ANISOU 176 CA GLU A 668 3778 4205 4497 -236 131 756 C ATOM 177 C GLU A 668 25.203 2.972 33.941 1.00 29.59 C ANISOU 177 C GLU A 668 3355 4004 3885 -583 -100 382 C ATOM 178 O GLU A 668 23.974 2.966 34.078 1.00 30.86 O ANISOU 178 O GLU A 668 3827 3888 4010 -625 410 301 O ATOM 179 CB GLU A 668 25.754 2.378 36.282 1.00 34.41 C ANISOU 179 CB GLU A 668 4100 4297 4677 69 -164 665 C ATOM 180 CG GLU A 668 26.547 1.556 37.273 1.00 38.56 C ANISOU 180 CG GLU A 668 4751 4800 5099 -146 -61 523 C ATOM 181 CD GLU A 668 26.306 2.018 38.689 1.00 39.51 C ANISOU 181 CD GLU A 668 4962 4793 5256 -451 -290 393 C ATOM 182 OE1 GLU A 668 25.168 1.862 39.179 1.00 37.42 O ANISOU 182 OE1 GLU A 668 4722 4160 5334 -499 -462 483 O ATOM 183 OE2 GLU A 668 27.252 2.570 39.300 1.00 41.69 O1- ANISOU 183 OE2 GLU A 668 5103 5443 5294 -408 -286 395 O1- ATOM 0 H GLU A 668 27.721 1.417 34.049 1.00 32.14 H new ATOM 0 HA GLU A 668 25.790 1.128 34.627 1.00 32.84 H new ATOM 0 HB2 GLU A 668 25.942 3.317 36.434 1.00 34.41 H new ATOM 0 HB3 GLU A 668 24.808 2.247 36.453 1.00 34.41 H new ATOM 0 HG2 GLU A 668 26.302 0.621 37.190 1.00 38.56 H new ATOM 0 HG3 GLU A 668 27.493 1.621 37.066 1.00 38.56 H new ATOM 190 N ILE A 669 25.806 3.804 33.088 1.00 28.55 N ANISOU 190 N ILE A 669 3218 3711 3920 -411 -113 394 N ATOM 191 CA ILE A 669 25.049 4.772 32.301 1.00 27.50 C ANISOU 191 CA ILE A 669 2953 3671 3825 -623 -529 572 C ATOM 192 C ILE A 669 25.203 4.467 30.825 1.00 27.12 C ANISOU 192 C ILE A 669 2888 3650 3765 -614 -282 904 C ATOM 193 O ILE A 669 24.207 4.308 30.111 1.00 28.10 O ANISOU 193 O ILE A 669 2623 4123 3929 -457 -100 963 O ATOM 194 CB ILE A 669 25.484 6.211 32.628 1.00 29.94 C ANISOU 194 CB ILE A 669 3452 3615 4310 -412 -437 612 C ATOM 195 CG1 ILE A 669 25.149 6.499 34.086 1.00 33.36 C ANISOU 195 CG1 ILE A 669 4100 3923 4652 -508 -147 326 C ATOM 196 CG2 ILE A 669 24.774 7.214 31.724 1.00 30.71 C ANISOU 196 CG2 ILE A 669 3464 3419 4786 -554 -286 992 C ATOM 197 CD1 ILE A 669 25.190 7.969 34.492 1.00 35.21 C ANISOU 197 CD1 ILE A 669 4382 4086 4908 -512 -118 -247 C ATOM 0 H ILE A 669 26.655 3.821 32.952 1.00 28.55 H new ATOM 0 HA ILE A 669 24.110 4.698 32.532 1.00 27.50 H new ATOM 0 HB ILE A 669 26.438 6.299 32.478 1.00 29.94 H new ATOM 0 HG12 ILE A 669 24.262 6.153 34.272 1.00 33.36 H new ATOM 0 HG13 ILE A 669 25.769 6.007 34.647 1.00 33.36 H new ATOM 0 HG21 ILE A 669 25.063 8.113 31.948 1.00 30.71 H new ATOM 0 HG22 ILE A 669 24.992 7.026 30.798 1.00 30.71 H new ATOM 0 HG23 ILE A 669 23.815 7.142 31.851 1.00 30.71 H new ATOM 0 HD11 ILE A 669 24.964 8.052 35.432 1.00 35.21 H new ATOM 0 HD12 ILE A 669 26.081 8.322 34.342 1.00 35.21 H new ATOM 0 HD13 ILE A 669 24.551 8.470 33.961 1.00 35.21 H new ATOM 209 N GLY A 670 26.428 4.432 30.341 1.00 26.94 N ANISOU 209 N GLY A 670 3076 3800 3359 -553 -703 524 N ATOM 210 CA GLY A 670 26.633 4.199 28.920 1.00 27.52 C ANISOU 210 CA GLY A 670 3100 3864 3494 -463 -405 330 C ATOM 211 C GLY A 670 28.008 4.694 28.483 1.00 28.56 C ANISOU 211 C GLY A 670 2830 4030 3993 -490 -423 -77 C ATOM 212 O GLY A 670 28.963 4.656 29.251 1.00 32.35 O ANISOU 212 O GLY A 670 2628 5123 4541 -664 -579 287 O ATOM 0 H GLY A 670 27.145 4.538 30.804 1.00 26.94 H new ATOM 0 HA2 GLY A 670 26.549 3.252 28.728 1.00 27.52 H new ATOM 0 HA3 GLY A 670 25.944 4.654 28.411 1.00 27.52 H new ATOM 216 N ILE A 671 28.093 5.102 27.227 1.00 25.29 N ANISOU 216 N ILE A 671 2368 3102 4138 -47 -282 -68 N ATOM 217 CA ILE A 671 29.342 5.553 26.625 1.00 24.62 C ANISOU 217 CA ILE A 671 2238 3040 4078 60 -8 -257 C ATOM 218 C ILE A 671 29.168 7.000 26.210 1.00 24.63 C ANISOU 218 C ILE A 671 2358 3141 3859 378 329 -193 C ATOM 219 O ILE A 671 28.184 7.345 25.543 1.00 24.35 O ANISOU 219 O ILE A 671 2430 2897 3925 88 271 -21 O ATOM 220 CB ILE A 671 29.717 4.688 25.417 1.00 28.38 C ANISOU 220 CB ILE A 671 2981 3062 4738 106 779 -324 C ATOM 221 CG1 ILE A 671 29.932 3.254 25.887 1.00 34.06 C ANISOU 221 CG1 ILE A 671 4278 3466 5195 1300 1837 -220 C ATOM 222 CG2 ILE A 671 30.971 5.210 24.746 1.00 31.06 C ANISOU 222 CG2 ILE A 671 3518 3285 4998 -15 1408 -723 C ATOM 223 CD1 ILE A 671 30.121 2.272 24.789 1.00 38.10 C ANISOU 223 CD1 ILE A 671 4911 4094 5471 1269 2283 -388 C ATOM 0 H ILE A 671 27.420 5.126 26.692 1.00 25.29 H new ATOM 0 HA ILE A 671 30.063 5.473 27.269 1.00 24.62 H new ATOM 0 HB ILE A 671 28.997 4.720 24.767 1.00 28.38 H new ATOM 0 HG12 ILE A 671 30.709 3.228 26.467 1.00 34.06 H new ATOM 0 HG13 ILE A 671 29.170 2.982 26.422 1.00 34.06 H new ATOM 0 HG21 ILE A 671 31.189 4.648 23.986 1.00 31.06 H new ATOM 0 HG22 ILE A 671 30.822 6.119 24.443 1.00 31.06 H new ATOM 0 HG23 ILE A 671 31.706 5.197 25.379 1.00 31.06 H new ATOM 0 HD11 ILE A 671 30.251 1.387 25.165 1.00 38.10 H new ATOM 0 HD12 ILE A 671 29.336 2.269 24.219 1.00 38.10 H new ATOM 0 HD13 ILE A 671 30.899 2.518 24.265 1.00 38.10 H new ATOM 235 N ALA A 672 30.121 7.838 26.596 1.00 23.25 N ANISOU 235 N ALA A 672 2115 2816 3903 322 177 -127 N ATOM 236 CA ALA A 672 30.076 9.270 26.335 1.00 22.47 C ANISOU 236 CA ALA A 672 2112 2764 3660 237 258 -472 C ATOM 237 C ALA A 672 31.172 9.659 25.368 1.00 23.73 C ANISOU 237 C ALA A 672 2131 2967 3917 166 254 -373 C ATOM 238 O ALA A 672 32.305 9.182 25.476 1.00 25.48 O ANISOU 238 O ALA A 672 2148 3620 3912 441 362 117 O ATOM 239 CB ALA A 672 30.251 10.059 27.620 1.00 24.67 C ANISOU 239 CB ALA A 672 2815 3132 3424 -28 594 -690 C ATOM 0 H ALA A 672 30.823 7.587 27.024 1.00 23.25 H new ATOM 0 HA ALA A 672 29.209 9.475 25.951 1.00 22.47 H new ATOM 0 HB1 ALA A 672 30.218 11.008 27.424 1.00 24.67 H new ATOM 0 HB2 ALA A 672 29.539 9.832 28.239 1.00 24.67 H new ATOM 0 HB3 ALA A 672 31.108 9.841 28.019 1.00 24.67 H new ATOM 245 N THR A 673 30.842 10.522 24.438 1.00 24.74 N ANISOU 245 N THR A 673 2191 3047 4164 -27 475 -237 N ATOM 246 CA THR A 673 31.781 10.977 23.427 1.00 25.47 C ANISOU 246 CA THR A 673 2259 3331 4089 236 285 145 C ATOM 247 C THR A 673 31.730 12.484 23.327 1.00 25.06 C ANISOU 247 C THR A 673 2250 3082 4189 138 739 94 C ATOM 248 O THR A 673 30.648 13.066 23.364 1.00 26.10 O ANISOU 248 O THR A 673 2227 3007 4681 121 820 442 O ATOM 249 CB THR A 673 31.433 10.393 22.082 1.00 30.49 C ANISOU 249 CB THR A 673 3474 3917 4193 -60 786 371 C ATOM 250 OG1 THR A 673 31.387 8.973 22.175 1.00 32.63 O ANISOU 250 OG1 THR A 673 3738 4282 4377 649 588 404 O ATOM 251 CG2 THR A 673 32.452 10.756 21.079 1.00 33.07 C ANISOU 251 CG2 THR A 673 3848 4133 4583 -195 1122 226 C ATOM 0 H THR A 673 30.058 10.869 24.369 1.00 24.74 H new ATOM 0 HA THR A 673 32.670 10.687 23.684 1.00 25.47 H new ATOM 0 HB THR A 673 30.571 10.746 21.813 1.00 30.49 H new ATOM 0 HG1 THR A 673 31.707 8.730 22.912 1.00 32.63 H new ATOM 0 HG21 THR A 673 32.213 10.373 20.221 1.00 33.07 H new ATOM 0 HG22 THR A 673 32.499 11.722 21.000 1.00 33.07 H new ATOM 0 HG23 THR A 673 33.316 10.413 21.356 1.00 33.07 H new ATOM 259 N GLU A 674 32.886 13.111 23.178 1.00 24.93 N ANISOU 259 N GLU A 674 2433 3029 4009 38 490 176 N ATOM 260 CA GLU A 674 32.966 14.499 22.753 1.00 27.14 C ANISOU 260 CA GLU A 674 2409 3653 4250 -276 496 410 C ATOM 261 C GLU A 674 33.392 14.526 21.291 1.00 29.50 C ANISOU 261 C GLU A 674 2919 4018 4269 -497 884 269 C ATOM 262 O GLU A 674 34.409 13.924 20.924 1.00 30.49 O ANISOU 262 O GLU A 674 2806 4546 4232 -346 967 100 O ATOM 263 CB GLU A 674 33.936 15.295 23.617 1.00 31.77 C ANISOU 263 CB GLU A 674 3136 4112 4825 -824 352 455 C ATOM 264 CG GLU A 674 34.005 16.753 23.172 1.00 35.61 C ANISOU 264 CG GLU A 674 4111 4253 5168 -1151 -29 345 C ATOM 265 CD GLU A 674 34.466 17.712 24.239 1.00 45.55 C ANISOU 265 CD GLU A 674 6219 5081 6007 -913 558 591 C ATOM 266 OE1 GLU A 674 34.835 17.265 25.348 1.00 49.54 O ANISOU 266 OE1 GLU A 674 7033 5474 6315 -635 713 677 O ATOM 267 OE2 GLU A 674 34.453 18.933 23.952 1.00 47.41 O1- ANISOU 267 OE2 GLU A 674 6861 4982 6170 -1169 632 299 O1- ATOM 0 H GLU A 674 33.650 12.743 23.321 1.00 24.93 H new ATOM 0 HA GLU A 674 32.097 14.917 22.854 1.00 27.14 H new ATOM 0 HB2 GLU A 674 33.657 15.251 24.545 1.00 31.77 H new ATOM 0 HB3 GLU A 674 34.819 14.897 23.567 1.00 31.77 H new ATOM 0 HG2 GLU A 674 34.605 16.819 22.413 1.00 35.61 H new ATOM 0 HG3 GLU A 674 33.127 17.027 22.864 1.00 35.61 H new ATOM 274 N LEU A 675 32.579 15.161 20.460 1.00 31.63 N ANISOU 274 N LEU A 675 3757 4360 3902 -651 951 230 N ATOM 275 CA LEU A 675 32.870 15.332 19.048 1.00 36.59 C ANISOU 275 CA LEU A 675 4311 5005 4587 -1241 818 310 C ATOM 276 C LEU A 675 33.676 16.611 18.803 1.00 39.23 C ANISOU 276 C LEU A 675 4502 5346 5058 -1331 498 616 C ATOM 277 O LEU A 675 33.692 17.536 19.619 1.00 36.69 O ANISOU 277 O LEU A 675 4160 5133 4649 -1165 153 1051 O ATOM 278 CB LEU A 675 31.566 15.344 18.251 1.00 39.08 C ANISOU 278 CB LEU A 675 5058 5192 4597 -1259 736 256 C ATOM 279 CG LEU A 675 30.774 14.039 18.378 1.00 40.93 C ANISOU 279 CG LEU A 675 5497 5200 4853 -1312 377 19 C ATOM 280 CD1 LEU A 675 29.512 14.079 17.550 1.00 42.22 C ANISOU 280 CD1 LEU A 675 5745 5198 5097 -1182 257 258 C ATOM 281 CD2 LEU A 675 31.615 12.851 17.953 1.00 42.40 C ANISOU 281 CD2 LEU A 675 5848 5167 5096 -1559 266 -108 C ATOM 0 H LEU A 675 31.832 15.510 20.705 1.00 31.63 H new ATOM 0 HA LEU A 675 33.413 14.586 18.748 1.00 36.59 H new ATOM 0 HB2 LEU A 675 31.014 16.082 18.554 1.00 39.08 H new ATOM 0 HB3 LEU A 675 31.766 15.505 17.316 1.00 39.08 H new ATOM 0 HG LEU A 675 30.532 13.942 19.312 1.00 40.93 H new ATOM 0 HD11 LEU A 675 29.033 13.242 17.650 1.00 42.22 H new ATOM 0 HD12 LEU A 675 28.950 14.811 17.851 1.00 42.22 H new ATOM 0 HD13 LEU A 675 29.741 14.211 16.617 1.00 42.22 H new ATOM 0 HD21 LEU A 675 31.094 12.037 18.042 1.00 42.40 H new ATOM 0 HD22 LEU A 675 31.887 12.961 17.029 1.00 42.40 H new ATOM 0 HD23 LEU A 675 32.402 12.793 18.517 1.00 42.40 H new ATOM 293 N SER A 676 34.367 16.638 17.656 1.00 42.32 N ANISOU 293 N SER A 676 4563 5827 5689 -1858 418 522 N ATOM 294 CA SER A 676 35.384 17.659 17.402 1.00 46.15 C ANISOU 294 CA SER A 676 5057 6427 6051 -1641 379 540 C ATOM 295 C SER A 676 34.834 19.073 17.427 1.00 48.23 C ANISOU 295 C SER A 676 5277 6451 6598 -1408 500 767 C ATOM 296 O SER A 676 35.610 20.025 17.606 1.00 49.14 O ANISOU 296 O SER A 676 5416 6522 6734 -1092 855 820 O ATOM 297 CB SER A 676 36.010 17.442 16.036 1.00 49.07 C ANISOU 297 CB SER A 676 5607 7003 6034 -1567 476 577 C ATOM 298 OG SER A 676 35.081 17.806 15.019 1.00 53.45 O ANISOU 298 OG SER A 676 6568 7490 6251 -1221 927 646 O ATOM 0 H SER A 676 34.260 16.074 17.016 1.00 42.32 H new ATOM 0 HA SER A 676 36.034 17.567 18.117 1.00 46.15 H new ATOM 0 HB2 SER A 676 36.818 17.972 15.953 1.00 49.07 H new ATOM 0 HB3 SER A 676 36.268 16.513 15.933 1.00 49.07 H new ATOM 0 HG SER A 676 34.429 17.277 15.032 1.00 53.45 H new ATOM 304 N HIS A 677 33.536 19.235 17.190 1.00 50.59 N ANISOU 304 N HIS A 677 5660 6491 7071 -967 740 1202 N ATOM 305 CA HIS A 677 32.910 20.544 17.137 1.00 50.67 C ANISOU 305 CA HIS A 677 5637 6178 7437 -749 788 1411 C ATOM 306 C HIS A 677 32.113 20.872 18.396 1.00 47.38 C ANISOU 306 C HIS A 677 4759 5759 7485 -683 670 1570 C ATOM 307 O HIS A 677 31.355 21.847 18.394 1.00 49.52 O ANISOU 307 O HIS A 677 5338 5522 7956 -674 814 1606 O ATOM 308 CB HIS A 677 32.013 20.648 15.899 1.00 54.01 C ANISOU 308 CB HIS A 677 6201 6372 7949 -655 1170 1423 C ATOM 309 CG HIS A 677 30.831 19.725 15.913 1.00 56.00 C ANISOU 309 CG HIS A 677 6170 6593 8514 -229 1182 1383 C ATOM 310 ND1 HIS A 677 30.947 18.365 16.115 1.00 57.27 N ANISOU 310 ND1 HIS A 677 6217 6655 8889 129 1179 1436 N ATOM 311 CD2 HIS A 677 29.508 19.966 15.734 1.00 55.88 C ANISOU 311 CD2 HIS A 677 5970 6714 8547 21 1150 1456 C ATOM 312 CE1 HIS A 677 29.751 17.808 16.062 1.00 56.10 C ANISOU 312 CE1 HIS A 677 5762 6713 8843 217 1145 1437 C ATOM 313 NE2 HIS A 677 28.860 18.758 15.831 1.00 55.80 N ANISOU 313 NE2 HIS A 677 5679 6830 8692 162 912 1451 N ATOM 0 H HIS A 677 32.993 18.582 17.055 1.00 50.59 H new ATOM 0 HA HIS A 677 33.625 21.197 17.080 1.00 50.67 H new ATOM 0 HB2 HIS A 677 31.696 21.561 15.818 1.00 54.01 H new ATOM 0 HB3 HIS A 677 32.546 20.462 15.110 1.00 54.01 H new ATOM 0 HD2 HIS A 677 29.114 20.793 15.575 1.00 55.88 H new ATOM 0 HE1 HIS A 677 29.567 16.903 16.169 1.00 56.10 H new ATOM 0 HE2 HIS A 677 28.012 18.639 15.754 1.00 55.80 H new ATOM 321 N GLY A 678 32.270 20.088 19.466 1.00 43.00 N ANISOU 321 N GLY A 678 3869 5159 7310 -765 874 1782 N ATOM 322 CA GLY A 678 31.821 20.470 20.793 1.00 40.43 C ANISOU 322 CA GLY A 678 3642 4800 6921 -496 1052 1601 C ATOM 323 C GLY A 678 30.576 19.754 21.256 1.00 38.29 C ANISOU 323 C GLY A 678 3679 4541 6327 -759 1039 1486 C ATOM 324 O GLY A 678 30.234 19.828 22.443 1.00 39.09 O ANISOU 324 O GLY A 678 3599 4588 6665 -857 833 1192 O ATOM 0 H GLY A 678 32.644 19.314 19.435 1.00 43.00 H new ATOM 0 HA2 GLY A 678 32.535 20.298 21.427 1.00 40.43 H new ATOM 0 HA3 GLY A 678 31.655 21.426 20.805 1.00 40.43 H new ATOM 328 N VAL A 679 29.887 19.061 20.358 1.00 35.01 N ANISOU 328 N VAL A 679 3508 4317 5479 -481 669 1801 N ATOM 329 CA VAL A 679 28.747 18.262 20.775 1.00 30.92 C ANISOU 329 CA VAL A 679 3150 4001 4596 -484 405 1495 C ATOM 330 C VAL A 679 29.208 17.166 21.724 1.00 27.41 C ANISOU 330 C VAL A 679 2713 3469 4233 25 189 1176 C ATOM 331 O VAL A 679 30.255 16.540 21.524 1.00 29.05 O ANISOU 331 O VAL A 679 2575 3862 4599 340 371 946 O ATOM 332 CB VAL A 679 28.053 17.661 19.548 1.00 32.81 C ANISOU 332 CB VAL A 679 4216 4219 4031 -540 -24 1516 C ATOM 333 CG1 VAL A 679 26.987 16.638 19.963 1.00 32.38 C ANISOU 333 CG1 VAL A 679 4279 3931 4092 -458 -298 1242 C ATOM 334 CG2 VAL A 679 27.425 18.757 18.738 1.00 36.68 C ANISOU 334 CG2 VAL A 679 4996 4649 4291 -591 432 1366 C ATOM 0 H VAL A 679 30.060 19.040 19.516 1.00 35.01 H new ATOM 0 HA VAL A 679 28.110 18.827 21.240 1.00 30.92 H new ATOM 0 HB VAL A 679 28.719 17.201 19.012 1.00 32.81 H new ATOM 0 HG11 VAL A 679 26.563 16.273 19.171 1.00 32.38 H new ATOM 0 HG12 VAL A 679 27.405 15.921 20.466 1.00 32.38 H new ATOM 0 HG13 VAL A 679 26.319 17.073 20.515 1.00 32.38 H new ATOM 0 HG21 VAL A 679 26.986 18.375 17.962 1.00 36.68 H new ATOM 0 HG22 VAL A 679 26.772 19.226 19.280 1.00 36.68 H new ATOM 0 HG23 VAL A 679 28.111 19.379 18.448 1.00 36.68 H new ATOM 344 N VAL A 680 28.414 16.906 22.755 1.00 26.46 N ANISOU 344 N VAL A 680 2819 3165 4068 -25 136 731 N ATOM 345 CA VAL A 680 28.642 15.787 23.663 1.00 24.82 C ANISOU 345 CA VAL A 680 2637 2914 3880 -96 17 448 C ATOM 346 C VAL A 680 27.499 14.818 23.462 1.00 25.63 C ANISOU 346 C VAL A 680 2434 3096 4209 -160 342 589 C ATOM 347 O VAL A 680 26.343 15.230 23.440 1.00 25.38 O ANISOU 347 O VAL A 680 2506 3030 4109 132 244 734 O ATOM 348 CB VAL A 680 28.717 16.253 25.122 1.00 26.99 C ANISOU 348 CB VAL A 680 3083 3214 3956 -452 157 282 C ATOM 349 CG1 VAL A 680 28.749 15.084 26.099 1.00 28.40 C ANISOU 349 CG1 VAL A 680 3438 3398 3956 -882 222 175 C ATOM 350 CG2 VAL A 680 29.921 17.083 25.278 1.00 28.86 C ANISOU 350 CG2 VAL A 680 3391 3750 3824 -224 -226 -239 C ATOM 0 H VAL A 680 27.722 17.377 22.950 1.00 26.46 H new ATOM 0 HA VAL A 680 29.493 15.363 23.470 1.00 24.82 H new ATOM 0 HB VAL A 680 27.919 16.764 25.328 1.00 26.99 H new ATOM 0 HG11 VAL A 680 28.796 15.422 27.007 1.00 28.40 H new ATOM 0 HG12 VAL A 680 27.945 14.552 25.994 1.00 28.40 H new ATOM 0 HG13 VAL A 680 29.526 14.533 25.919 1.00 28.40 H new ATOM 0 HG21 VAL A 680 29.987 17.389 26.196 1.00 28.86 H new ATOM 0 HG22 VAL A 680 30.706 16.559 25.055 1.00 28.86 H new ATOM 0 HG23 VAL A 680 29.865 17.849 24.686 1.00 28.86 H new ATOM 360 N GLN A 681 27.822 13.553 23.261 1.00 25.55 N ANISOU 360 N GLN A 681 2230 3174 4304 -232 361 568 N ATOM 361 CA GLN A 681 26.820 12.518 23.057 1.00 25.75 C ANISOU 361 CA GLN A 681 2271 3098 4414 -75 175 403 C ATOM 362 C GLN A 681 26.947 11.500 24.171 1.00 25.76 C ANISOU 362 C GLN A 681 2215 3079 4493 189 258 682 C ATOM 363 O GLN A 681 28.057 11.159 24.596 1.00 29.13 O ANISOU 363 O GLN A 681 2132 3294 5642 174 586 1377 O ATOM 364 CB GLN A 681 26.997 11.797 21.724 1.00 30.20 C ANISOU 364 CB GLN A 681 3482 3572 4422 -189 81 640 C ATOM 365 CG GLN A 681 26.861 12.630 20.501 1.00 38.63 C ANISOU 365 CG GLN A 681 4895 4606 5176 -78 476 117 C ATOM 366 CD GLN A 681 26.649 11.764 19.277 1.00 44.38 C ANISOU 366 CD GLN A 681 6042 5390 5430 406 295 -192 C ATOM 367 OE1 GLN A 681 27.354 10.779 19.067 1.00 46.32 O ANISOU 367 OE1 GLN A 681 6520 5738 5342 534 180 -475 O ATOM 368 NE2 GLN A 681 25.664 12.123 18.467 1.00 49.60 N ANISOU 368 NE2 GLN A 681 6837 5950 6060 495 894 -235 N ATOM 0 H GLN A 681 28.633 13.266 23.238 1.00 25.55 H new ATOM 0 HA GLN A 681 25.948 12.943 23.055 1.00 25.75 H new ATOM 0 HB2 GLN A 681 27.875 11.385 21.715 1.00 30.20 H new ATOM 0 HB3 GLN A 681 26.346 11.079 21.677 1.00 30.20 H new ATOM 0 HG2 GLN A 681 26.114 13.241 20.603 1.00 38.63 H new ATOM 0 HG3 GLN A 681 27.657 13.172 20.384 1.00 38.63 H new ATOM 0 HE21 GLN A 681 25.192 12.819 18.647 1.00 49.60 H new ATOM 0 HE22 GLN A 681 25.497 11.660 17.762 1.00 49.60 H new ATOM 377 N VAL A 682 25.831 10.975 24.625 1.00 23.66 N ANISOU 377 N VAL A 682 2209 2724 4055 65 43 414 N ATOM 378 CA VAL A 682 25.858 9.835 25.520 1.00 24.53 C ANISOU 378 CA VAL A 682 2541 3064 3715 -189 -51 146 C ATOM 379 C VAL A 682 24.946 8.787 24.920 1.00 23.71 C ANISOU 379 C VAL A 682 2050 3142 3817 57 -53 476 C ATOM 380 O VAL A 682 23.792 9.077 24.606 1.00 24.78 O ANISOU 380 O VAL A 682 2435 3197 3784 116 -244 511 O ATOM 381 CB VAL A 682 25.418 10.178 26.952 1.00 26.70 C ANISOU 381 CB VAL A 682 2813 3403 3928 98 266 4 C ATOM 382 CG1 VAL A 682 25.432 8.908 27.820 1.00 27.81 C ANISOU 382 CG1 VAL A 682 2937 3917 3713 135 624 38 C ATOM 383 CG2 VAL A 682 26.306 11.250 27.526 1.00 30.61 C ANISOU 383 CG2 VAL A 682 3392 4056 4184 51 560 -192 C ATOM 0 H VAL A 682 25.044 11.262 24.429 1.00 23.66 H new ATOM 0 HA VAL A 682 26.770 9.516 25.603 1.00 24.53 H new ATOM 0 HB VAL A 682 24.512 10.523 26.938 1.00 26.70 H new ATOM 0 HG11 VAL A 682 25.154 9.130 28.722 1.00 27.81 H new ATOM 0 HG12 VAL A 682 24.822 8.253 27.446 1.00 27.81 H new ATOM 0 HG13 VAL A 682 26.329 8.539 27.840 1.00 27.81 H new ATOM 0 HG21 VAL A 682 26.020 11.458 28.429 1.00 30.61 H new ATOM 0 HG22 VAL A 682 27.224 10.936 27.543 1.00 30.61 H new ATOM 0 HG23 VAL A 682 26.248 12.047 26.977 1.00 30.61 H new ATOM 393 N GLN A 683 25.480 7.593 24.737 1.00 24.08 N ANISOU 393 N GLN A 683 2378 2716 4054 -126 282 337 N ATOM 394 CA GLN A 683 24.724 6.440 24.304 1.00 24.96 C ANISOU 394 CA GLN A 683 2833 2930 3722 180 181 216 C ATOM 395 C GLN A 683 24.463 5.614 25.547 1.00 23.78 C ANISOU 395 C GLN A 683 2462 2897 3677 101 -52 165 C ATOM 396 O GLN A 683 25.391 5.061 26.138 1.00 25.28 O ANISOU 396 O GLN A 683 2507 3379 3718 268 52 590 O ATOM 397 CB GLN A 683 25.496 5.638 23.273 1.00 28.83 C ANISOU 397 CB GLN A 683 3942 3082 3932 294 618 100 C ATOM 398 CG GLN A 683 24.757 4.408 22.824 1.00 34.42 C ANISOU 398 CG GLN A 683 5145 3649 4284 568 1180 -182 C ATOM 399 CD GLN A 683 25.533 3.685 21.764 1.00 41.08 C ANISOU 399 CD GLN A 683 6165 4514 4928 396 1564 -345 C ATOM 400 OE1 GLN A 683 25.643 4.173 20.641 1.00 44.31 O ANISOU 400 OE1 GLN A 683 6972 5094 4769 366 1394 -362 O ATOM 401 NE2 GLN A 683 26.120 2.546 22.118 1.00 44.14 N ANISOU 401 NE2 GLN A 683 6714 4643 5415 360 1604 -517 N ATOM 0 H GLN A 683 26.314 7.428 24.865 1.00 24.08 H new ATOM 0 HA GLN A 683 23.894 6.706 23.879 1.00 24.96 H new ATOM 0 HB2 GLN A 683 25.680 6.199 22.504 1.00 28.83 H new ATOM 0 HB3 GLN A 683 26.353 5.378 23.646 1.00 28.83 H new ATOM 0 HG2 GLN A 683 24.608 3.820 23.581 1.00 34.42 H new ATOM 0 HG3 GLN A 683 23.884 4.656 22.481 1.00 34.42 H new ATOM 0 HE21 GLN A 683 26.017 2.239 22.915 1.00 44.14 H new ATOM 0 HE22 GLN A 683 26.602 2.116 21.550 1.00 44.14 H new ATOM 410 N PHE A 684 23.202 5.548 25.947 1.00 23.68 N ANISOU 410 N PHE A 684 2333 3011 3655 -251 -349 204 N ATOM 411 CA PHE A 684 22.817 4.916 27.188 1.00 24.79 C ANISOU 411 CA PHE A 684 2691 3098 3629 -60 335 389 C ATOM 412 C PHE A 684 22.749 3.405 27.008 1.00 25.13 C ANISOU 412 C PHE A 684 2856 3213 3478 -177 437 232 C ATOM 413 O PHE A 684 22.732 2.876 25.896 1.00 26.67 O ANISOU 413 O PHE A 684 3281 3368 3485 -91 824 154 O ATOM 414 CB PHE A 684 21.467 5.466 27.660 1.00 26.52 C ANISOU 414 CB PHE A 684 2691 3228 4159 96 583 515 C ATOM 415 CG PHE A 684 21.543 6.870 28.164 1.00 28.23 C ANISOU 415 CG PHE A 684 3129 3267 4329 455 549 619 C ATOM 416 CD1 PHE A 684 21.487 7.916 27.292 1.00 29.82 C ANISOU 416 CD1 PHE A 684 3651 2741 4938 75 887 448 C ATOM 417 CD2 PHE A 684 21.712 7.140 29.505 1.00 31.23 C ANISOU 417 CD2 PHE A 684 4142 3250 4475 550 519 672 C ATOM 418 CE1 PHE A 684 21.585 9.218 27.738 1.00 31.51 C ANISOU 418 CE1 PHE A 684 3929 2899 5145 121 1323 255 C ATOM 419 CE2 PHE A 684 21.804 8.449 29.956 1.00 30.54 C ANISOU 419 CE2 PHE A 684 3783 3014 4807 165 88 625 C ATOM 420 CZ PHE A 684 21.751 9.475 29.069 1.00 32.24 C ANISOU 420 CZ PHE A 684 4068 3104 5078 54 668 262 C ATOM 0 H PHE A 684 22.543 5.873 25.499 1.00 23.68 H new ATOM 0 HA PHE A 684 23.484 5.114 27.864 1.00 24.79 H new ATOM 0 HB2 PHE A 684 20.835 5.427 26.926 1.00 26.52 H new ATOM 0 HB3 PHE A 684 21.121 4.895 28.364 1.00 26.52 H new ATOM 0 HD1 PHE A 684 21.381 7.750 26.383 1.00 29.82 H new ATOM 0 HD2 PHE A 684 21.765 6.438 30.113 1.00 31.23 H new ATOM 0 HE1 PHE A 684 21.538 9.921 27.132 1.00 31.51 H new ATOM 0 HE2 PHE A 684 21.902 8.623 30.864 1.00 30.54 H new ATOM 0 HZ PHE A 684 21.828 10.352 29.367 1.00 32.24 H new ATOM 430 N TYR A 685 22.687 2.721 28.141 1.00 26.80 N ANISOU 430 N TYR A 685 3276 3384 3523 104 353 225 N ATOM 431 CA TYR A 685 22.716 1.268 28.178 1.00 25.69 C ANISOU 431 CA TYR A 685 3184 3003 3574 96 68 -25 C ATOM 432 C TYR A 685 21.565 0.625 27.386 1.00 27.16 C ANISOU 432 C TYR A 685 3329 3048 3943 -398 103 -139 C ATOM 433 O TYR A 685 21.699 -0.531 26.950 1.00 29.49 O ANISOU 433 O TYR A 685 3625 3314 4266 -69 264 55 O ATOM 434 CB TYR A 685 22.687 0.824 29.652 1.00 26.26 C ANISOU 434 CB TYR A 685 3487 3011 3477 -71 114 -105 C ATOM 435 CG TYR A 685 21.416 1.220 30.343 1.00 26.38 C ANISOU 435 CG TYR A 685 3328 3111 3586 -19 274 232 C ATOM 436 CD1 TYR A 685 20.322 0.357 30.376 1.00 27.00 C ANISOU 436 CD1 TYR A 685 3150 3314 3793 253 554 438 C ATOM 437 CD2 TYR A 685 21.282 2.457 30.947 1.00 26.01 C ANISOU 437 CD2 TYR A 685 3273 3207 3405 -237 179 97 C ATOM 438 CE1 TYR A 685 19.138 0.733 30.976 1.00 27.55 C ANISOU 438 CE1 TYR A 685 3643 3316 3510 369 932 45 C ATOM 439 CE2 TYR A 685 20.112 2.827 31.545 1.00 26.93 C ANISOU 439 CE2 TYR A 685 3370 3379 3483 -195 626 485 C ATOM 440 CZ TYR A 685 19.050 1.954 31.565 1.00 26.67 C ANISOU 440 CZ TYR A 685 3503 3139 3490 108 740 254 C ATOM 441 OH TYR A 685 17.856 2.305 32.139 1.00 29.23 O ANISOU 441 OH TYR A 685 4363 3608 3134 -29 787 109 O ATOM 0 H TYR A 685 22.626 3.090 28.916 1.00 26.80 H new ATOM 0 HA TYR A 685 23.530 0.965 27.747 1.00 25.69 H new ATOM 0 HB2 TYR A 685 22.791 -0.139 29.699 1.00 26.26 H new ATOM 0 HB3 TYR A 685 23.442 1.214 30.120 1.00 26.26 H new ATOM 0 HD1 TYR A 685 20.391 -0.485 29.988 1.00 27.00 H new ATOM 0 HD2 TYR A 685 22.001 3.047 30.946 1.00 26.01 H new ATOM 0 HE1 TYR A 685 18.408 0.157 30.977 1.00 27.55 H new ATOM 0 HE2 TYR A 685 20.034 3.666 31.937 1.00 26.93 H new ATOM 0 HH TYR A 685 17.729 3.130 32.040 1.00 29.23 H new ATOM 451 N ASP A 686 20.470 1.359 27.155 1.00 26.13 N ANISOU 451 N ASP A 686 3073 3068 3786 -471 -36 33 N ATOM 452 CA ASP A 686 19.299 0.878 26.423 1.00 27.86 C ANISOU 452 CA ASP A 686 3435 3077 4073 -139 254 422 C ATOM 453 C ASP A 686 19.293 1.305 24.961 1.00 29.34 C ANISOU 453 C ASP A 686 3853 3267 4028 -225 -193 455 C ATOM 454 O ASP A 686 18.317 1.058 24.251 1.00 32.05 O ANISOU 454 O ASP A 686 4527 3428 4222 -447 67 141 O ATOM 455 CB ASP A 686 18.007 1.340 27.119 1.00 27.69 C ANISOU 455 CB ASP A 686 3064 3166 4292 -265 191 795 C ATOM 456 CG ASP A 686 17.808 2.834 27.093 1.00 27.97 C ANISOU 456 CG ASP A 686 3123 3522 3982 -425 -80 514 C ATOM 457 OD1 ASP A 686 18.671 3.549 26.546 1.00 28.26 O ANISOU 457 OD1 ASP A 686 3427 3207 4103 -428 230 427 O ATOM 458 OD2 ASP A 686 16.754 3.282 27.630 1.00 28.80 O1- ANISOU 458 OD2 ASP A 686 3570 3588 3784 -410 346 320 O1- ATOM 0 H ASP A 686 20.389 2.170 27.428 1.00 26.13 H new ATOM 0 HA ASP A 686 19.345 -0.091 26.430 1.00 27.86 H new ATOM 0 HB2 ASP A 686 17.248 0.913 26.692 1.00 27.69 H new ATOM 0 HB3 ASP A 686 18.020 1.039 28.041 1.00 27.69 H new ATOM 463 N GLY A 687 20.376 1.894 24.480 1.00 28.96 N ANISOU 463 N GLY A 687 4045 3350 3609 -206 46 859 N ATOM 464 CA GLY A 687 20.487 2.251 23.099 1.00 30.09 C ANISOU 464 CA GLY A 687 4463 3661 3309 71 124 590 C ATOM 465 C GLY A 687 20.036 3.654 22.793 1.00 27.12 C ANISOU 465 C GLY A 687 4031 3173 3099 -79 92 749 C ATOM 466 O GLY A 687 20.274 4.128 21.682 1.00 31.72 O ANISOU 466 O GLY A 687 4739 3710 3605 162 559 726 O ATOM 0 H GLY A 687 21.064 2.094 24.955 1.00 28.96 H new ATOM 0 HA2 GLY A 687 21.411 2.150 22.821 1.00 30.09 H new ATOM 0 HA3 GLY A 687 19.962 1.630 22.570 1.00 30.09 H new ATOM 470 N SER A 688 19.407 4.332 23.750 1.00 24.98 N ANISOU 470 N SER A 688 2941 3068 3481 122 92 323 N ATOM 471 CA SER A 688 19.058 5.744 23.583 1.00 24.07 C ANISOU 471 CA SER A 688 2534 3093 3518 68 -259 298 C ATOM 472 C SER A 688 20.320 6.578 23.410 1.00 24.30 C ANISOU 472 C SER A 688 2764 3039 3432 -204 -224 339 C ATOM 473 O SER A 688 21.392 6.229 23.902 1.00 25.70 O ANISOU 473 O SER A 688 3064 3161 3540 -7 -345 677 O ATOM 474 CB SER A 688 18.337 6.278 24.801 1.00 27.98 C ANISOU 474 CB SER A 688 2854 3220 4556 -167 367 94 C ATOM 475 OG SER A 688 17.134 5.634 25.014 1.00 33.40 O ANISOU 475 OG SER A 688 3933 3573 5184 -222 215 335 O ATOM 0 H SER A 688 19.173 3.994 24.505 1.00 24.98 H new ATOM 0 HA SER A 688 18.486 5.806 22.802 1.00 24.07 H new ATOM 0 HB2 SER A 688 18.902 6.173 25.582 1.00 27.98 H new ATOM 0 HB3 SER A 688 18.179 7.229 24.691 1.00 27.98 H new ATOM 0 HG SER A 688 17.270 4.917 25.429 1.00 33.40 H new ATOM 481 N VAL A 689 20.188 7.702 22.727 1.00 23.98 N ANISOU 481 N VAL A 689 2621 2949 3542 131 -174 180 N ATOM 482 CA VAL A 689 21.302 8.614 22.534 1.00 25.66 C ANISOU 482 CA VAL A 689 2772 3096 3880 -216 -42 416 C ATOM 483 C VAL A 689 20.825 10.015 22.889 1.00 25.31 C ANISOU 483 C VAL A 689 2463 2669 4484 141 -109 858 C ATOM 484 O VAL A 689 19.778 10.447 22.399 1.00 28.34 O ANISOU 484 O VAL A 689 2843 3232 4694 -39 -861 786 O ATOM 485 CB VAL A 689 21.820 8.588 21.089 1.00 29.98 C ANISOU 485 CB VAL A 689 3547 3754 4089 -346 408 411 C ATOM 486 CG1 VAL A 689 22.974 9.589 20.929 1.00 31.16 C ANISOU 486 CG1 VAL A 689 3886 3856 4098 -191 694 766 C ATOM 487 CG2 VAL A 689 22.240 7.187 20.668 1.00 32.29 C ANISOU 487 CG2 VAL A 689 3853 4232 4186 -927 401 386 C ATOM 0 H VAL A 689 19.452 7.958 22.363 1.00 23.98 H new ATOM 0 HA VAL A 689 22.038 8.341 23.104 1.00 25.66 H new ATOM 0 HB VAL A 689 21.096 8.852 20.501 1.00 29.98 H new ATOM 0 HG11 VAL A 689 23.297 9.568 20.014 1.00 31.16 H new ATOM 0 HG12 VAL A 689 22.660 10.482 21.140 1.00 31.16 H new ATOM 0 HG13 VAL A 689 23.696 9.350 21.532 1.00 31.16 H new ATOM 0 HG21 VAL A 689 22.561 7.206 19.753 1.00 32.29 H new ATOM 0 HG22 VAL A 689 22.948 6.872 21.252 1.00 32.29 H new ATOM 0 HG23 VAL A 689 21.479 6.588 20.731 1.00 32.29 H new ATOM 497 N VAL A 690 21.613 10.745 23.688 1.00 26.96 N ANISOU 497 N VAL A 690 2741 2572 4930 106 -76 533 N ATOM 498 CA VAL A 690 21.396 12.182 23.930 1.00 27.53 C ANISOU 498 CA VAL A 690 2275 2769 5417 -171 -552 546 C ATOM 499 C VAL A 690 22.573 12.924 23.336 1.00 29.30 C ANISOU 499 C VAL A 690 2415 2916 5800 -194 -445 428 C ATOM 500 O VAL A 690 23.727 12.544 23.573 1.00 30.96 O ANISOU 500 O VAL A 690 2577 3045 6140 77 -738 826 O ATOM 501 CB VAL A 690 21.303 12.531 25.421 1.00 33.96 C ANISOU 501 CB VAL A 690 4154 3227 5522 -228 516 273 C ATOM 502 CG1 VAL A 690 21.050 14.036 25.599 1.00 40.27 C ANISOU 502 CG1 VAL A 690 5794 3793 5716 160 1680 150 C ATOM 503 CG2 VAL A 690 20.219 11.797 26.074 1.00 35.79 C ANISOU 503 CG2 VAL A 690 4251 3972 5375 -250 105 214 C ATOM 0 H VAL A 690 22.291 10.421 24.107 1.00 26.96 H new ATOM 0 HA VAL A 690 20.551 12.433 23.525 1.00 27.53 H new ATOM 0 HB VAL A 690 22.146 12.281 25.830 1.00 33.96 H new ATOM 0 HG11 VAL A 690 20.993 14.245 26.544 1.00 40.27 H new ATOM 0 HG12 VAL A 690 21.780 14.536 25.201 1.00 40.27 H new ATOM 0 HG13 VAL A 690 20.217 14.278 25.164 1.00 40.27 H new ATOM 0 HG21 VAL A 690 20.185 12.038 27.013 1.00 35.79 H new ATOM 0 HG22 VAL A 690 19.375 12.022 25.652 1.00 35.79 H new ATOM 0 HG23 VAL A 690 20.377 10.844 25.990 1.00 35.79 H new ATOM 513 N SER A 691 22.284 13.976 22.580 1.00 30.24 N ANISOU 513 N SER A 691 2591 3050 5850 -399 -211 264 N ATOM 514 CA SER A 691 23.303 14.882 22.070 1.00 29.53 C ANISOU 514 CA SER A 691 2457 3168 5596 -167 -645 233 C ATOM 515 C SER A 691 23.031 16.249 22.664 1.00 28.06 C ANISOU 515 C SER A 691 2250 2981 5429 139 -390 740 C ATOM 516 O SER A 691 21.942 16.794 22.487 1.00 28.91 O ANISOU 516 O SER A 691 2117 3220 5645 58 -312 664 O ATOM 517 CB SER A 691 23.296 14.977 20.544 1.00 34.57 C ANISOU 517 CB SER A 691 3377 3828 5931 157 -362 -85 C ATOM 518 OG SER A 691 23.683 13.766 19.915 1.00 37.85 O ANISOU 518 OG SER A 691 3809 4472 6100 494 -228 -277 O ATOM 0 H SER A 691 21.483 14.186 22.347 1.00 30.24 H new ATOM 0 HA SER A 691 24.176 14.544 22.323 1.00 29.53 H new ATOM 0 HB2 SER A 691 22.407 15.223 20.244 1.00 34.57 H new ATOM 0 HB3 SER A 691 23.896 15.687 20.266 1.00 34.57 H new ATOM 0 HG SER A 691 23.298 13.701 19.171 1.00 37.85 H new ATOM 524 N VAL A 692 24.024 16.809 23.332 1.00 27.76 N ANISOU 524 N VAL A 692 2773 2688 5087 -23 -146 606 N ATOM 525 CA VAL A 692 23.938 18.149 23.881 1.00 28.93 C ANISOU 525 CA VAL A 692 2817 3094 5081 -97 -596 720 C ATOM 526 C VAL A 692 24.692 19.072 22.943 1.00 29.91 C ANISOU 526 C VAL A 692 3044 3473 4847 -414 -247 510 C ATOM 527 O VAL A 692 25.880 18.871 22.667 1.00 28.85 O ANISOU 527 O VAL A 692 2770 3566 4625 -412 -18 733 O ATOM 528 CB VAL A 692 24.475 18.215 25.311 1.00 34.03 C ANISOU 528 CB VAL A 692 4214 3354 5360 -249 -515 703 C ATOM 529 CG1 VAL A 692 24.394 19.632 25.846 1.00 36.59 C ANISOU 529 CG1 VAL A 692 4896 3585 5421 -174 -474 549 C ATOM 530 CG2 VAL A 692 23.684 17.306 26.191 1.00 35.78 C ANISOU 530 CG2 VAL A 692 4514 3836 5246 -57 -593 1033 C ATOM 0 H VAL A 692 24.775 16.418 23.481 1.00 27.76 H new ATOM 0 HA VAL A 692 23.011 18.427 23.944 1.00 28.93 H new ATOM 0 HB VAL A 692 25.404 17.935 25.304 1.00 34.03 H new ATOM 0 HG11 VAL A 692 24.738 19.656 26.753 1.00 36.59 H new ATOM 0 HG12 VAL A 692 24.922 20.221 25.285 1.00 36.59 H new ATOM 0 HG13 VAL A 692 23.470 19.927 25.843 1.00 36.59 H new ATOM 0 HG21 VAL A 692 24.028 17.351 27.097 1.00 35.78 H new ATOM 0 HG22 VAL A 692 22.753 17.579 26.185 1.00 35.78 H new ATOM 0 HG23 VAL A 692 23.755 16.396 25.864 1.00 35.78 H new ATOM 540 N ILE A 693 23.985 20.068 22.436 1.00 29.86 N ANISOU 540 N ILE A 693 3043 3582 4720 -523 -336 608 N ATOM 541 CA ILE A 693 24.488 20.937 21.384 1.00 30.82 C ANISOU 541 CA ILE A 693 3577 3357 4778 -476 154 744 C ATOM 542 C ILE A 693 25.020 22.190 22.054 1.00 32.57 C ANISOU 542 C ILE A 693 3880 3429 5064 -616 263 711 C ATOM 543 O ILE A 693 24.306 22.784 22.880 1.00 34.25 O ANISOU 543 O ILE A 693 4934 3160 4920 -444 608 856 O ATOM 544 CB ILE A 693 23.390 21.307 20.376 1.00 31.65 C ANISOU 544 CB ILE A 693 3856 3530 4639 -369 -28 681 C ATOM 545 CG1 ILE A 693 22.597 20.058 19.918 1.00 34.37 C ANISOU 545 CG1 ILE A 693 4437 3899 4723 271 240 732 C ATOM 546 CG2 ILE A 693 24.006 22.131 19.227 1.00 32.21 C ANISOU 546 CG2 ILE A 693 4072 3495 4673 -201 31 856 C ATOM 547 CD1 ILE A 693 23.403 18.921 19.429 1.00 37.73 C ANISOU 547 CD1 ILE A 693 4659 4706 4970 104 577 584 C ATOM 0 H ILE A 693 23.188 20.262 22.696 1.00 29.86 H new ATOM 0 HA ILE A 693 25.183 20.478 20.886 1.00 30.82 H new ATOM 0 HB ILE A 693 22.726 21.873 20.800 1.00 31.65 H new ATOM 0 HG12 ILE A 693 22.055 19.751 20.661 1.00 34.37 H new ATOM 0 HG13 ILE A 693 21.987 20.325 19.213 1.00 34.37 H new ATOM 0 HG21 ILE A 693 23.314 22.365 18.589 1.00 32.21 H new ATOM 0 HG22 ILE A 693 24.402 22.940 19.585 1.00 32.21 H new ATOM 0 HG23 ILE A 693 24.690 21.606 18.783 1.00 32.21 H new ATOM 0 HD11 ILE A 693 22.815 18.195 19.169 1.00 37.73 H new ATOM 0 HD12 ILE A 693 23.928 19.202 18.663 1.00 37.73 H new ATOM 0 HD13 ILE A 693 23.997 18.618 20.134 1.00 37.73 H new ATOM 559 N PRO A 694 26.223 22.640 21.716 1.00 33.63 N ANISOU 559 N PRO A 694 3857 3553 5368 -641 148 1190 N ATOM 560 CA PRO A 694 26.756 23.856 22.325 1.00 35.04 C ANISOU 560 CA PRO A 694 4110 3860 5345 -646 291 1086 C ATOM 561 C PRO A 694 25.851 25.053 22.062 1.00 35.55 C ANISOU 561 C PRO A 694 4534 3760 5212 -937 757 650 C ATOM 562 O PRO A 694 25.206 25.170 21.011 1.00 33.81 O ANISOU 562 O PRO A 694 4113 3539 5194 -712 199 883 O ATOM 563 CB PRO A 694 28.125 24.015 21.653 1.00 37.04 C ANISOU 563 CB PRO A 694 4274 4073 5725 -742 -95 1062 C ATOM 564 CG PRO A 694 28.475 22.684 21.101 1.00 35.63 C ANISOU 564 CG PRO A 694 3751 4099 5689 -746 -375 1265 C ATOM 565 CD PRO A 694 27.196 21.965 20.838 1.00 35.84 C ANISOU 565 CD PRO A 694 4016 3841 5762 -799 266 1182 C ATOM 0 HA PRO A 694 26.818 23.802 23.292 1.00 35.04 H new ATOM 0 HB2 PRO A 694 28.090 24.683 20.950 1.00 37.04 H new ATOM 0 HB3 PRO A 694 28.792 24.311 22.292 1.00 37.04 H new ATOM 0 HG2 PRO A 694 28.990 22.777 20.284 1.00 35.63 H new ATOM 0 HG3 PRO A 694 29.024 22.187 21.727 1.00 35.63 H new ATOM 0 HD2 PRO A 694 26.937 22.029 19.905 1.00 35.84 H new ATOM 0 HD3 PRO A 694 27.269 21.021 21.048 1.00 35.84 H new ATOM 573 N SER A 695 25.786 25.946 23.045 1.00 38.67 N ANISOU 573 N SER A 695 5211 4373 5108 -880 1014 377 N ATOM 574 CA SER A 695 24.946 27.121 22.878 1.00 39.91 C ANISOU 574 CA SER A 695 5415 4389 5360 -1063 1202 297 C ATOM 575 C SER A 695 25.345 27.909 21.637 1.00 38.11 C ANISOU 575 C SER A 695 4894 4049 5539 -857 1050 650 C ATOM 576 O SER A 695 24.480 28.480 20.967 1.00 35.95 O ANISOU 576 O SER A 695 4615 3458 5586 -432 1080 611 O ATOM 577 CB SER A 695 25.027 27.999 24.121 1.00 44.95 C ANISOU 577 CB SER A 695 6065 5318 5696 -1149 1233 79 C ATOM 578 OG SER A 695 26.355 28.430 24.316 1.00 49.11 O ANISOU 578 OG SER A 695 6519 6160 5979 -952 1262 240 O ATOM 0 H SER A 695 26.207 25.893 23.793 1.00 38.67 H new ATOM 0 HA SER A 695 24.029 26.828 22.759 1.00 39.91 H new ATOM 0 HB2 SER A 695 24.440 28.765 24.024 1.00 44.95 H new ATOM 0 HB3 SER A 695 24.722 27.504 24.897 1.00 44.95 H new ATOM 0 HG SER A 695 26.395 28.915 25.001 1.00 49.11 H new ATOM 584 N MET A 696 26.640 27.934 21.299 1.00 38.43 N ANISOU 584 N MET A 696 4696 4088 5816 -772 784 1026 N ATOM 585 CA MET A 696 27.073 28.672 20.113 1.00 39.82 C ANISOU 585 CA MET A 696 4522 4617 5990 -820 429 1038 C ATOM 586 C MET A 696 26.485 28.107 18.832 1.00 38.76 C ANISOU 586 C MET A 696 4650 4580 5495 -706 609 1344 C ATOM 587 O MET A 696 26.343 28.840 17.845 1.00 38.10 O ANISOU 587 O MET A 696 4525 4862 5090 -919 695 1532 O ATOM 588 CB MET A 696 28.599 28.664 20.010 1.00 44.44 C ANISOU 588 CB MET A 696 4820 5021 7044 -991 690 608 C ATOM 589 CG MET A 696 29.247 29.570 20.980 1.00 49.51 C ANISOU 589 CG MET A 696 5557 5229 8026 -949 966 471 C ATOM 590 SD MET A 696 29.202 31.243 20.338 1.00 54.25 S ANISOU 590 SD MET A 696 6045 5423 9147 -1175 1528 7 S ATOM 591 CE MET A 696 30.519 31.208 19.129 1.00 56.86 C ANISOU 591 CE MET A 696 6694 5667 9242 -973 1899 21 C ATOM 0 H MET A 696 27.268 27.539 21.734 1.00 38.43 H new ATOM 0 HA MET A 696 26.749 29.581 20.216 1.00 39.82 H new ATOM 0 HB2 MET A 696 28.923 27.761 20.152 1.00 44.44 H new ATOM 0 HB3 MET A 696 28.859 28.921 19.111 1.00 44.44 H new ATOM 0 HG2 MET A 696 28.791 29.527 21.835 1.00 49.51 H new ATOM 0 HG3 MET A 696 30.164 29.295 21.134 1.00 49.51 H new ATOM 0 HE1 MET A 696 30.807 32.114 18.937 1.00 56.86 H new ATOM 0 HE2 MET A 696 31.267 30.699 19.479 1.00 56.86 H new ATOM 0 HE3 MET A 696 30.199 30.791 18.314 1.00 56.86 H new ATOM 601 N GLN A 697 26.156 26.818 18.810 1.00 38.81 N ANISOU 601 N GLN A 697 4955 4340 5449 -619 562 1643 N ATOM 602 CA GLN A 697 25.607 26.181 17.622 1.00 41.02 C ANISOU 602 CA GLN A 697 5269 4641 5675 -362 219 1692 C ATOM 603 C GLN A 697 24.095 26.046 17.690 1.00 41.85 C ANISOU 603 C GLN A 697 5236 4881 5785 -627 265 1443 C ATOM 604 O GLN A 697 23.511 25.261 16.939 1.00 44.92 O ANISOU 604 O GLN A 697 5788 5614 5665 -333 107 1261 O ATOM 605 CB GLN A 697 26.245 24.805 17.418 1.00 44.69 C ANISOU 605 CB GLN A 697 5794 5193 5994 -272 -27 1155 C ATOM 606 CG GLN A 697 27.672 24.866 16.893 1.00 46.62 C ANISOU 606 CG GLN A 697 5803 5626 6285 -502 39 809 C ATOM 607 CD GLN A 697 28.359 23.529 16.983 1.00 48.78 C ANISOU 607 CD GLN A 697 6098 5992 6445 -440 126 685 C ATOM 608 OE1 GLN A 697 27.793 22.503 16.608 1.00 50.64 O ANISOU 608 OE1 GLN A 697 6397 6212 6632 -416 311 606 O ATOM 609 NE2 GLN A 697 29.580 23.526 17.496 1.00 49.72 N ANISOU 609 NE2 GLN A 697 6268 6121 6504 -158 325 786 N ATOM 0 H GLN A 697 26.245 26.291 19.483 1.00 38.81 H new ATOM 0 HA GLN A 697 25.816 26.752 16.866 1.00 41.02 H new ATOM 0 HB2 GLN A 697 26.239 24.326 18.261 1.00 44.69 H new ATOM 0 HB3 GLN A 697 25.702 24.294 16.798 1.00 44.69 H new ATOM 0 HG2 GLN A 697 27.665 25.164 15.970 1.00 46.62 H new ATOM 0 HG3 GLN A 697 28.175 25.523 17.399 1.00 46.62 H new ATOM 0 HE21 GLN A 697 29.943 24.264 17.747 1.00 49.72 H new ATOM 0 HE22 GLN A 697 30.010 22.786 17.578 1.00 49.72 H new ATOM 618 N GLY A 698 23.451 26.779 18.583 1.00 39.04 N ANISOU 618 N GLY A 698 4470 4566 5799 -950 422 1512 N ATOM 619 CA GLY A 698 22.011 26.820 18.654 1.00 38.82 C ANISOU 619 CA GLY A 698 4175 4576 5997 -930 355 1394 C ATOM 620 C GLY A 698 21.448 26.186 19.896 1.00 38.67 C ANISOU 620 C GLY A 698 4093 4372 6226 -458 521 1321 C ATOM 621 O GLY A 698 20.273 26.408 20.213 1.00 40.79 O ANISOU 621 O GLY A 698 4250 4559 6688 -499 262 1228 O ATOM 0 H GLY A 698 23.845 27.270 19.169 1.00 39.04 H new ATOM 0 HA2 GLY A 698 21.719 27.744 18.612 1.00 38.82 H new ATOM 0 HA3 GLY A 698 21.644 26.371 17.877 1.00 38.82 H new ATOM 625 N GLY A 699 22.244 25.411 20.601 1.00 36.31 N ANISOU 625 N GLY A 699 3788 4074 5934 -152 560 1078 N ATOM 626 CA GLY A 699 21.839 24.892 21.870 1.00 35.04 C ANISOU 626 CA GLY A 699 3717 3754 5841 7 607 947 C ATOM 627 C GLY A 699 20.860 23.750 21.730 1.00 33.93 C ANISOU 627 C GLY A 699 3603 3643 5648 -131 366 739 C ATOM 628 O GLY A 699 20.601 23.202 20.658 1.00 35.24 O ANISOU 628 O GLY A 699 3908 3971 5510 -430 269 573 O ATOM 0 H GLY A 699 23.033 25.175 20.352 1.00 36.31 H new ATOM 0 HA2 GLY A 699 22.620 24.589 22.358 1.00 35.04 H new ATOM 0 HA3 GLY A 699 21.434 25.601 22.394 1.00 35.04 H new ATOM 632 N GLY A 700 20.316 23.394 22.854 1.00 33.04 N ANISOU 632 N GLY A 700 3325 3210 6020 -286 547 567 N ATOM 633 CA GLY A 700 19.305 22.382 22.869 1.00 32.45 C ANISOU 633 CA GLY A 700 3416 2756 6159 -108 692 893 C ATOM 634 C GLY A 700 19.895 20.992 22.972 1.00 30.59 C ANISOU 634 C GLY A 700 3028 2867 5727 233 255 634 C ATOM 635 O GLY A 700 21.102 20.740 23.160 1.00 32.23 O ANISOU 635 O GLY A 700 3083 3249 5914 -76 597 630 O ATOM 0 H GLY A 700 20.516 23.724 23.623 1.00 33.04 H new ATOM 0 HA2 GLY A 700 18.707 22.535 23.617 1.00 32.45 H new ATOM 0 HA3 GLY A 700 18.772 22.447 22.061 1.00 32.45 H new ATOM 639 N ILE A 701 18.977 20.060 22.831 1.00 29.76 N ANISOU 639 N ILE A 701 3154 2903 5251 -556 240 177 N ATOM 640 CA ILE A 701 19.204 18.641 23.079 1.00 30.15 C ANISOU 640 CA ILE A 701 3384 3109 4964 -274 -32 329 C ATOM 641 C ILE A 701 18.563 17.879 21.936 1.00 28.90 C ANISOU 641 C ILE A 701 3363 3122 4496 15 -25 582 C ATOM 642 O ILE A 701 17.412 18.148 21.592 1.00 30.49 O ANISOU 642 O ILE A 701 3023 3514 5049 391 -350 210 O ATOM 643 CB ILE A 701 18.546 18.190 24.403 1.00 36.23 C ANISOU 643 CB ILE A 701 4881 3747 5137 -679 236 268 C ATOM 644 CG1 ILE A 701 19.191 18.872 25.607 1.00 38.76 C ANISOU 644 CG1 ILE A 701 5035 4394 5299 -639 -46 608 C ATOM 645 CG2 ILE A 701 18.544 16.687 24.529 1.00 40.39 C ANISOU 645 CG2 ILE A 701 5531 4143 5671 -875 667 303 C ATOM 646 CD1 ILE A 701 20.502 18.306 25.961 1.00 39.65 C ANISOU 646 CD1 ILE A 701 5027 4675 5365 -1287 189 389 C ATOM 0 H ILE A 701 18.173 20.235 22.580 1.00 29.76 H new ATOM 0 HA ILE A 701 20.157 18.471 23.143 1.00 30.15 H new ATOM 0 HB ILE A 701 17.618 18.473 24.386 1.00 36.23 H new ATOM 0 HG12 ILE A 701 19.294 19.818 25.419 1.00 38.76 H new ATOM 0 HG13 ILE A 701 18.597 18.798 26.370 1.00 38.76 H new ATOM 0 HG21 ILE A 701 18.126 16.433 25.367 1.00 40.39 H new ATOM 0 HG22 ILE A 701 18.048 16.301 23.791 1.00 40.39 H new ATOM 0 HG23 ILE A 701 19.457 16.359 24.511 1.00 40.39 H new ATOM 0 HD11 ILE A 701 20.861 18.777 26.729 1.00 39.65 H new ATOM 0 HD12 ILE A 701 20.401 17.366 26.177 1.00 39.65 H new ATOM 0 HD13 ILE A 701 21.109 18.402 25.211 1.00 39.65 H new ATOM 658 N THR A 702 19.268 16.919 21.366 1.00 24.76 N ANISOU 658 N THR A 702 2539 2740 4127 -271 -279 570 N ATOM 659 CA THR A 702 18.637 15.953 20.477 1.00 26.55 C ANISOU 659 CA THR A 702 2661 3094 4334 -274 -274 506 C ATOM 660 C THR A 702 18.629 14.618 21.184 1.00 25.56 C ANISOU 660 C THR A 702 2604 2954 4152 269 -681 683 C ATOM 661 O THR A 702 19.669 14.146 21.634 1.00 27.10 O ANISOU 661 O THR A 702 3182 2694 4422 269 -617 813 O ATOM 662 CB THR A 702 19.352 15.873 19.137 1.00 28.94 C ANISOU 662 CB THR A 702 3332 3321 4342 -157 -195 887 C ATOM 663 OG1 THR A 702 19.227 17.149 18.487 1.00 31.95 O ANISOU 663 OG1 THR A 702 4223 3558 4359 -419 -63 871 O ATOM 664 CG2 THR A 702 18.758 14.833 18.254 1.00 30.28 C ANISOU 664 CG2 THR A 702 3601 3238 4664 188 154 1184 C ATOM 0 H THR A 702 20.113 16.806 21.478 1.00 24.76 H new ATOM 0 HA THR A 702 17.729 16.229 20.277 1.00 26.55 H new ATOM 0 HB THR A 702 20.280 15.639 19.297 1.00 28.94 H new ATOM 0 HG1 THR A 702 19.618 17.125 17.744 1.00 31.95 H new ATOM 0 HG21 THR A 702 19.238 14.811 17.411 1.00 30.28 H new ATOM 0 HG22 THR A 702 18.823 13.967 18.685 1.00 30.28 H new ATOM 0 HG23 THR A 702 17.825 15.043 18.089 1.00 30.28 H new ATOM 672 N TYR A 703 17.456 14.013 21.284 1.00 25.68 N ANISOU 672 N TYR A 703 2671 2920 4168 -152 -527 645 N ATOM 673 CA TYR A 703 17.268 12.783 22.024 1.00 25.87 C ANISOU 673 CA TYR A 703 2850 2926 4054 165 -515 797 C ATOM 674 C TYR A 703 16.716 11.733 21.086 1.00 25.75 C ANISOU 674 C TYR A 703 2906 2951 3926 60 -627 754 C ATOM 675 O TYR A 703 15.679 11.949 20.445 1.00 26.29 O ANISOU 675 O TYR A 703 2813 3026 4150 -89 -722 670 O ATOM 676 CB TYR A 703 16.309 12.982 23.189 1.00 27.90 C ANISOU 676 CB TYR A 703 3030 3236 4334 -89 -141 700 C ATOM 677 CG TYR A 703 16.155 11.763 24.039 1.00 28.36 C ANISOU 677 CG TYR A 703 2985 3622 4170 -590 -301 642 C ATOM 678 CD1 TYR A 703 17.024 11.536 25.078 1.00 30.04 C ANISOU 678 CD1 TYR A 703 3419 3690 4305 -774 13 642 C ATOM 679 CD2 TYR A 703 15.164 10.829 23.790 1.00 28.64 C ANISOU 679 CD2 TYR A 703 2791 3858 4234 -328 -174 913 C ATOM 680 CE1 TYR A 703 16.928 10.459 25.868 1.00 30.15 C ANISOU 680 CE1 TYR A 703 3221 3862 4374 -729 121 1159 C ATOM 681 CE2 TYR A 703 15.055 9.697 24.574 1.00 30.29 C ANISOU 681 CE2 TYR A 703 3216 4051 4241 -544 80 895 C ATOM 682 CZ TYR A 703 15.938 9.522 25.622 1.00 29.72 C ANISOU 682 CZ TYR A 703 3009 4011 4270 -419 -480 1292 C ATOM 683 OH TYR A 703 15.846 8.406 26.426 1.00 33.37 O ANISOU 683 OH TYR A 703 3804 4574 4302 -312 -216 1289 O ATOM 0 H TYR A 703 16.737 14.312 20.918 1.00 25.68 H new ATOM 0 HA TYR A 703 18.123 12.500 22.385 1.00 25.87 H new ATOM 0 HB2 TYR A 703 16.626 13.715 23.739 1.00 27.90 H new ATOM 0 HB3 TYR A 703 15.440 13.241 22.844 1.00 27.90 H new ATOM 0 HD1 TYR A 703 17.703 12.151 25.238 1.00 30.04 H new ATOM 0 HD2 TYR A 703 14.567 10.965 23.090 1.00 28.64 H new ATOM 0 HE1 TYR A 703 17.520 10.341 26.575 1.00 30.15 H new ATOM 0 HE2 TYR A 703 14.398 9.063 24.399 1.00 30.29 H new ATOM 0 HH TYR A 703 15.040 8.184 26.506 1.00 33.37 H new ATOM 693 N THR A 704 17.383 10.583 21.035 1.00 25.27 N ANISOU 693 N THR A 704 2694 2875 4033 -57 -452 589 N ATOM 694 CA THR A 704 16.913 9.475 20.215 1.00 26.23 C ANISOU 694 CA THR A 704 2856 3082 4027 -179 -529 679 C ATOM 695 C THR A 704 16.534 8.316 21.127 1.00 26.59 C ANISOU 695 C THR A 704 2684 3170 4249 -61 -806 1124 C ATOM 696 O THR A 704 17.349 7.860 21.935 1.00 27.66 O ANISOU 696 O THR A 704 2958 3078 4473 -221 -841 1163 O ATOM 697 CB THR A 704 17.967 9.080 19.185 1.00 28.57 C ANISOU 697 CB THR A 704 3514 3194 4147 -474 -349 593 C ATOM 698 OG1 THR A 704 18.307 10.232 18.393 1.00 29.43 O ANISOU 698 OG1 THR A 704 3445 3488 4250 -158 56 809 O ATOM 699 CG2 THR A 704 17.424 8.016 18.243 1.00 31.91 C ANISOU 699 CG2 THR A 704 4311 3252 4560 -615 154 432 C ATOM 0 H THR A 704 18.109 10.426 21.468 1.00 25.27 H new ATOM 0 HA THR A 704 16.126 9.742 19.714 1.00 26.23 H new ATOM 0 HB THR A 704 18.741 8.736 19.657 1.00 28.57 H new ATOM 0 HG1 THR A 704 17.714 10.357 17.812 1.00 29.43 H new ATOM 0 HG21 THR A 704 18.106 7.778 17.596 1.00 31.91 H new ATOM 0 HG22 THR A 704 17.173 7.230 18.753 1.00 31.91 H new ATOM 0 HG23 THR A 704 16.646 8.361 17.779 1.00 31.91 H new ATOM 707 N GLN A 705 15.285 7.848 20.989 1.00 27.73 N ANISOU 707 N GLN A 705 3053 3193 4290 -616 -615 1173 N ATOM 708 CA GLN A 705 14.738 6.764 21.784 1.00 29.36 C ANISOU 708 CA GLN A 705 3042 3412 4703 -778 -776 1250 C ATOM 709 C GLN A 705 15.282 5.433 21.310 1.00 30.87 C ANISOU 709 C GLN A 705 3531 3426 4772 -504 -611 1041 C ATOM 710 O GLN A 705 15.771 5.324 20.182 1.00 32.75 O ANISOU 710 O GLN A 705 3868 3504 5072 -217 -408 865 O ATOM 711 CB GLN A 705 13.220 6.761 21.661 1.00 31.29 C ANISOU 711 CB GLN A 705 3377 3764 4748 -738 -772 1100 C ATOM 712 CG GLN A 705 12.605 7.863 22.423 1.00 34.53 C ANISOU 712 CG GLN A 705 3672 4537 4910 -856 -637 1371 C ATOM 713 CD GLN A 705 11.171 8.080 22.042 1.00 37.07 C ANISOU 713 CD GLN A 705 3825 5118 5141 -1146 -544 1298 C ATOM 714 OE1 GLN A 705 10.864 8.838 21.117 1.00 38.49 O ANISOU 714 OE1 GLN A 705 4026 5271 5327 -948 -647 1152 O ATOM 715 NE2 GLN A 705 10.276 7.421 22.757 1.00 38.99 N ANISOU 715 NE2 GLN A 705 4256 5592 4965 -1018 -193 1688 N ATOM 0 H GLN A 705 14.728 8.166 20.415 1.00 27.73 H new ATOM 0 HA GLN A 705 14.994 6.896 22.710 1.00 29.36 H new ATOM 0 HB2 GLN A 705 12.971 6.836 20.726 1.00 31.29 H new ATOM 0 HB3 GLN A 705 12.872 5.914 21.980 1.00 31.29 H new ATOM 0 HG2 GLN A 705 12.661 7.669 23.372 1.00 34.53 H new ATOM 0 HG3 GLN A 705 13.106 8.679 22.270 1.00 34.53 H new ATOM 0 HE21 GLN A 705 10.532 6.902 23.394 1.00 38.99 H new ATOM 0 HE22 GLN A 705 9.438 7.511 22.586 1.00 38.99 H new ATOM 724 N PRO A 706 15.183 4.386 22.142 1.00 30.83 N ANISOU 724 N PRO A 706 3665 3470 4578 -499 -895 809 N ATOM 725 CA PRO A 706 15.647 3.076 21.682 1.00 32.54 C ANISOU 725 CA PRO A 706 4352 3298 4713 -471 -350 903 C ATOM 726 C PRO A 706 14.988 2.653 20.384 1.00 37.07 C ANISOU 726 C PRO A 706 5552 3545 4986 -326 -180 384 C ATOM 727 O PRO A 706 15.623 1.953 19.584 1.00 39.51 O ANISOU 727 O PRO A 706 6298 3640 5074 275 31 554 O ATOM 728 CB PRO A 706 15.293 2.149 22.854 1.00 32.87 C ANISOU 728 CB PRO A 706 4335 3453 4701 -250 -333 997 C ATOM 729 CG PRO A 706 15.280 3.026 24.032 1.00 31.58 C ANISOU 729 CG PRO A 706 3772 3424 4803 -701 -407 883 C ATOM 730 CD PRO A 706 14.701 4.327 23.529 1.00 30.05 C ANISOU 730 CD PRO A 706 3686 3215 4519 -557 -375 1130 C ATOM 0 HA PRO A 706 16.593 3.064 21.469 1.00 32.54 H new ATOM 0 HB2 PRO A 706 14.431 1.726 22.720 1.00 32.87 H new ATOM 0 HB3 PRO A 706 15.946 1.438 22.951 1.00 32.87 H new ATOM 0 HG2 PRO A 706 14.740 2.651 24.745 1.00 31.58 H new ATOM 0 HG3 PRO A 706 16.173 3.151 24.389 1.00 31.58 H new ATOM 0 HD2 PRO A 706 13.732 4.330 23.573 1.00 30.05 H new ATOM 0 HD3 PRO A 706 15.011 5.084 24.050 1.00 30.05 H new ATOM 738 N ASN A 707 13.747 3.088 20.128 1.00 38.08 N ANISOU 738 N ASN A 707 6012 3500 4958 -446 -480 363 N ATOM 739 CA ASN A 707 13.020 2.704 18.922 1.00 39.67 C ANISOU 739 CA ASN A 707 6305 3816 4954 -562 -529 604 C ATOM 740 C ASN A 707 13.382 3.561 17.708 1.00 40.99 C ANISOU 740 C ASN A 707 6650 4079 4847 -614 -682 694 C ATOM 741 O ASN A 707 12.736 3.426 16.662 1.00 42.07 O ANISOU 741 O ASN A 707 7091 4300 4592 -810 -1114 659 O ATOM 742 CB ASN A 707 11.504 2.767 19.172 1.00 40.12 C ANISOU 742 CB ASN A 707 6223 3865 5157 -1059 -539 398 C ATOM 743 CG ASN A 707 10.983 4.199 19.373 1.00 39.54 C ANISOU 743 CG ASN A 707 5802 4016 5205 -658 -669 778 C ATOM 744 OD1 ASN A 707 11.694 5.159 19.171 1.00 38.37 O ANISOU 744 OD1 ASN A 707 5572 3763 5246 -739 -348 927 O ATOM 745 ND2 ASN A 707 9.723 4.324 19.755 1.00 42.06 N ANISOU 745 ND2 ASN A 707 6228 4372 5382 -532 -568 916 N ATOM 0 H ASN A 707 13.309 3.612 20.650 1.00 38.08 H new ATOM 0 HA ASN A 707 13.284 1.794 18.717 1.00 39.67 H new ATOM 0 HB2 ASN A 707 11.041 2.363 18.421 1.00 40.12 H new ATOM 0 HB3 ASN A 707 11.289 2.238 19.956 1.00 40.12 H new ATOM 0 HD21 ASN A 707 9.383 5.106 19.868 1.00 42.06 H new ATOM 0 HD22 ASN A 707 9.243 3.623 19.891 1.00 42.06 H new ATOM 752 N GLY A 708 14.380 4.435 17.815 1.00 38.34 N ANISOU 752 N GLY A 708 6007 4010 4552 -587 -1101 986 N ATOM 753 CA GLY A 708 14.874 5.183 16.671 1.00 38.42 C ANISOU 753 CA GLY A 708 5991 3864 4743 -654 -699 903 C ATOM 754 C GLY A 708 14.267 6.557 16.480 1.00 38.25 C ANISOU 754 C GLY A 708 5588 4020 4925 -662 -692 455 C ATOM 755 O GLY A 708 14.707 7.296 15.583 1.00 39.53 O ANISOU 755 O GLY A 708 5975 4252 4792 -487 -307 591 O ATOM 0 H GLY A 708 14.787 4.608 18.553 1.00 38.34 H new ATOM 0 HA2 GLY A 708 15.835 5.280 16.758 1.00 38.42 H new ATOM 0 HA3 GLY A 708 14.713 4.661 15.869 1.00 38.42 H new ATOM 759 N THR A 709 13.277 6.929 17.287 1.00 38.04 N ANISOU 759 N THR A 709 5318 3983 5154 -453 -632 503 N ATOM 760 CA THR A 709 12.627 8.225 17.157 1.00 33.94 C ANISOU 760 CA THR A 709 4423 3597 4876 -458 -1353 577 C ATOM 761 C THR A 709 13.497 9.311 17.763 1.00 30.25 C ANISOU 761 C THR A 709 3710 3328 4455 -414 -1357 708 C ATOM 762 O THR A 709 13.863 9.220 18.937 1.00 30.69 O ANISOU 762 O THR A 709 3656 3615 4391 -414 -1198 637 O ATOM 763 CB THR A 709 11.283 8.207 17.874 1.00 36.05 C ANISOU 763 CB THR A 709 4124 3957 5617 -653 -1263 437 C ATOM 764 OG1 THR A 709 10.433 7.201 17.289 1.00 38.75 O ANISOU 764 OG1 THR A 709 4815 4142 5765 -617 -904 185 O ATOM 765 CG2 THR A 709 10.617 9.583 17.804 1.00 39.25 C ANISOU 765 CG2 THR A 709 4530 4431 5951 -582 -1016 885 C ATOM 0 H THR A 709 12.966 6.439 17.921 1.00 38.04 H new ATOM 0 HA THR A 709 12.492 8.408 16.214 1.00 33.94 H new ATOM 0 HB THR A 709 11.428 7.991 18.809 1.00 36.05 H new ATOM 0 HG1 THR A 709 10.593 6.457 17.645 1.00 38.75 H new ATOM 0 HG21 THR A 709 9.764 9.554 18.265 1.00 39.25 H new ATOM 0 HG22 THR A 709 11.190 10.242 18.227 1.00 39.25 H new ATOM 0 HG23 THR A 709 10.475 9.827 16.876 1.00 39.25 H new ATOM 773 N SER A 710 13.804 10.347 16.974 1.00 29.52 N ANISOU 773 N SER A 710 3678 3196 4343 -181 -571 939 N ATOM 774 CA SER A 710 14.609 11.475 17.427 1.00 29.25 C ANISOU 774 CA SER A 710 3376 3247 4492 15 -401 982 C ATOM 775 C SER A 710 13.728 12.704 17.624 1.00 29.39 C ANISOU 775 C SER A 710 3113 3638 4417 5 -506 1063 C ATOM 776 O SER A 710 12.799 12.945 16.845 1.00 29.51 O ANISOU 776 O SER A 710 3048 3987 4178 -40 -568 1327 O ATOM 777 CB SER A 710 15.718 11.804 16.422 1.00 30.14 C ANISOU 777 CB SER A 710 3441 3449 4563 25 -493 827 C ATOM 778 OG SER A 710 16.680 10.773 16.360 1.00 32.32 O ANISOU 778 OG SER A 710 3610 3730 4940 229 -190 520 O ATOM 0 H SER A 710 13.547 10.410 16.156 1.00 29.52 H new ATOM 0 HA SER A 710 15.018 11.226 18.271 1.00 29.25 H new ATOM 0 HB2 SER A 710 15.330 11.940 15.543 1.00 30.14 H new ATOM 0 HB3 SER A 710 16.149 12.636 16.674 1.00 30.14 H new ATOM 0 HG SER A 710 16.494 10.254 15.727 1.00 32.32 H new ATOM 784 N THR A 711 14.023 13.468 18.676 1.00 27.11 N ANISOU 784 N THR A 711 2934 3142 4226 217 -359 1153 N ATOM 785 CA THR A 711 13.296 14.690 19.006 1.00 26.76 C ANISOU 785 CA THR A 711 2852 3519 3798 -60 -218 781 C ATOM 786 C THR A 711 14.317 15.745 19.387 1.00 27.03 C ANISOU 786 C THR A 711 2883 3556 3831 42 -105 614 C ATOM 787 O THR A 711 15.264 15.442 20.117 1.00 27.50 O ANISOU 787 O THR A 711 3001 3536 3912 -224 -307 736 O ATOM 788 CB THR A 711 12.346 14.477 20.183 1.00 28.97 C ANISOU 788 CB THR A 711 3165 4051 3791 -587 -164 654 C ATOM 789 OG1 THR A 711 11.396 13.449 19.858 1.00 29.92 O ANISOU 789 OG1 THR A 711 3478 4305 3585 -734 -118 604 O ATOM 790 CG2 THR A 711 11.603 15.765 20.517 1.00 31.24 C ANISOU 790 CG2 THR A 711 3379 4429 4063 -273 258 907 C ATOM 0 H THR A 711 14.660 13.287 19.224 1.00 27.11 H new ATOM 0 HA THR A 711 12.767 14.961 18.239 1.00 26.76 H new ATOM 0 HB THR A 711 12.869 14.210 20.955 1.00 28.97 H new ATOM 0 HG1 THR A 711 11.479 13.236 19.050 1.00 29.92 H new ATOM 0 HG21 THR A 711 11.006 15.610 21.265 1.00 31.24 H new ATOM 0 HG22 THR A 711 12.242 16.456 20.752 1.00 31.24 H new ATOM 0 HG23 THR A 711 11.087 16.050 19.747 1.00 31.24 H new ATOM 798 N HIS A 712 14.141 16.972 18.900 1.00 26.92 N ANISOU 798 N HIS A 712 3030 3369 3831 -80 -143 687 N ATOM 799 CA HIS A 712 14.979 18.086 19.329 1.00 27.80 C ANISOU 799 CA HIS A 712 2912 3347 4302 54 103 849 C ATOM 800 C HIS A 712 14.229 18.930 20.343 1.00 27.26 C ANISOU 800 C HIS A 712 2675 3290 4394 231 5 669 C ATOM 801 O HIS A 712 13.142 19.438 20.056 1.00 32.14 O ANISOU 801 O HIS A 712 3093 4110 5009 829 -238 -111 O ATOM 802 CB HIS A 712 15.431 18.977 18.177 1.00 31.87 C ANISOU 802 CB HIS A 712 3540 3539 5030 259 410 932 C ATOM 803 CG HIS A 712 16.351 20.078 18.619 1.00 33.07 C ANISOU 803 CG HIS A 712 3451 3760 5353 -147 -18 1093 C ATOM 804 ND1 HIS A 712 17.714 19.903 18.768 1.00 35.57 N ANISOU 804 ND1 HIS A 712 4286 3762 5469 -423 113 1086 N ATOM 805 CD2 HIS A 712 16.093 21.351 18.994 1.00 34.50 C ANISOU 805 CD2 HIS A 712 3657 3780 5672 -434 340 1094 C ATOM 806 CE1 HIS A 712 18.253 21.034 19.196 1.00 36.34 C ANISOU 806 CE1 HIS A 712 4150 3793 5865 -594 178 1157 C ATOM 807 NE2 HIS A 712 17.288 21.927 19.340 1.00 35.48 N ANISOU 807 NE2 HIS A 712 3981 3627 5871 -261 187 852 N ATOM 0 H HIS A 712 13.541 17.179 18.320 1.00 26.92 H new ATOM 0 HA HIS A 712 15.776 17.697 19.723 1.00 27.80 H new ATOM 0 HB2 HIS A 712 15.880 18.434 17.511 1.00 31.87 H new ATOM 0 HB3 HIS A 712 14.652 19.365 17.749 1.00 31.87 H new ATOM 0 HD1 HIS A 712 18.144 19.175 18.608 1.00 35.57 H new ATOM 0 HD2 HIS A 712 15.258 21.761 19.014 1.00 34.50 H new ATOM 0 HE1 HIS A 712 19.156 21.176 19.366 1.00 36.34 H new ATOM 815 N PHE A 713 14.830 19.113 21.506 1.00 26.29 N ANISOU 815 N PHE A 713 2532 3185 4272 230 442 800 N ATOM 816 CA PHE A 713 14.280 19.943 22.567 1.00 26.46 C ANISOU 816 CA PHE A 713 2601 3017 4433 453 319 608 C ATOM 817 C PHE A 713 15.126 21.195 22.640 1.00 30.19 C ANISOU 817 C PHE A 713 2828 3470 5172 544 358 737 C ATOM 818 O PHE A 713 16.325 21.130 22.909 1.00 31.69 O ANISOU 818 O PHE A 713 3146 3422 5471 491 153 278 O ATOM 819 CB PHE A 713 14.283 19.218 23.910 1.00 28.36 C ANISOU 819 CB PHE A 713 2694 3572 4512 443 518 461 C ATOM 820 CG PHE A 713 13.424 17.996 23.938 1.00 30.89 C ANISOU 820 CG PHE A 713 3146 4162 4427 21 341 345 C ATOM 821 CD1 PHE A 713 12.056 18.095 24.131 1.00 31.17 C ANISOU 821 CD1 PHE A 713 2996 4316 4531 266 220 592 C ATOM 822 CD2 PHE A 713 13.982 16.747 23.763 1.00 30.45 C ANISOU 822 CD2 PHE A 713 3341 4095 4135 154 386 729 C ATOM 823 CE1 PHE A 713 11.277 16.967 24.172 1.00 31.31 C ANISOU 823 CE1 PHE A 713 3477 4184 4235 -49 590 735 C ATOM 824 CE2 PHE A 713 13.200 15.602 23.799 1.00 30.61 C ANISOU 824 CE2 PHE A 713 3388 4231 4011 -164 518 911 C ATOM 825 CZ PHE A 713 11.843 15.720 23.988 1.00 31.54 C ANISOU 825 CZ PHE A 713 3600 4140 4245 -265 992 1135 C ATOM 0 H PHE A 713 15.584 18.752 21.707 1.00 26.29 H new ATOM 0 HA PHE A 713 13.355 20.158 22.371 1.00 26.46 H new ATOM 0 HB2 PHE A 713 15.194 18.968 24.131 1.00 28.36 H new ATOM 0 HB3 PHE A 713 13.982 19.831 24.599 1.00 28.36 H new ATOM 0 HD1 PHE A 713 11.663 18.932 24.233 1.00 31.17 H new ATOM 0 HD2 PHE A 713 14.898 16.671 23.618 1.00 30.45 H new ATOM 0 HE1 PHE A 713 10.363 17.042 24.325 1.00 31.31 H new ATOM 0 HE2 PHE A 713 13.589 14.764 23.696 1.00 30.61 H new ATOM 0 HZ PHE A 713 11.306 14.961 23.992 1.00 31.54 H new ATOM 835 N GLY A 714 14.507 22.333 22.386 1.00 35.47 N ANISOU 835 N GLY A 714 3652 3864 5959 342 823 959 N ATOM 836 CA GLY A 714 15.208 23.593 22.384 1.00 40.21 C ANISOU 836 CA GLY A 714 5000 3688 6589 209 1000 983 C ATOM 837 C GLY A 714 15.003 24.345 23.678 1.00 47.94 C ANISOU 837 C GLY A 714 6542 4396 7279 -296 1315 796 C ATOM 838 O GLY A 714 14.476 23.829 24.665 1.00 50.65 O ANISOU 838 O GLY A 714 7194 4367 7683 -618 1441 616 O ATOM 0 H GLY A 714 13.667 22.394 22.210 1.00 35.47 H new ATOM 0 HA2 GLY A 714 16.155 23.437 22.246 1.00 40.21 H new ATOM 0 HA3 GLY A 714 14.899 24.135 21.641 1.00 40.21 H new ATOM 842 N LYS A 715 15.449 25.592 23.661 1.00 53.37 N ANISOU 842 N LYS A 715 7387 5039 7853 -552 1694 282 N ATOM 843 CA LYS A 715 14.992 26.564 24.632 1.00 55.95 C ANISOU 843 CA LYS A 715 7633 5439 8187 76 1760 -11 C ATOM 844 C LYS A 715 13.473 26.619 24.611 1.00 58.53 C ANISOU 844 C LYS A 715 8208 5637 8396 415 1775 -218 C ATOM 845 O LYS A 715 12.862 26.694 23.541 1.00 59.99 O ANISOU 845 O LYS A 715 8582 5808 8402 637 1623 -293 O ATOM 846 CB LYS A 715 15.582 27.928 24.287 1.00 58.01 C ANISOU 846 CB LYS A 715 7832 5865 8343 98 2040 -8 C ATOM 847 CG LYS A 715 15.449 28.953 25.374 1.00 59.89 C ANISOU 847 CG LYS A 715 8043 6220 8494 320 2243 197 C ATOM 848 CD LYS A 715 16.239 30.205 25.029 1.00 60.35 C ANISOU 848 CD LYS A 715 7971 6359 8599 430 2461 336 C ATOM 849 CE LYS A 715 16.491 31.045 26.270 1.00 61.45 C ANISOU 849 CE LYS A 715 8075 6616 8656 611 2527 469 C ATOM 850 NZ LYS A 715 15.218 31.306 27.018 1.00 62.18 N ANISOU 850 NZ LYS A 715 8079 6847 8701 742 2411 587 N ATOM 0 H LYS A 715 16.019 25.894 23.092 1.00 53.37 H new ATOM 0 HA LYS A 715 15.282 26.311 25.522 1.00 55.95 H new ATOM 0 HB2 LYS A 715 16.522 27.817 24.075 1.00 58.01 H new ATOM 0 HB3 LYS A 715 15.148 28.263 23.487 1.00 58.01 H new ATOM 0 HG2 LYS A 715 14.514 29.179 25.500 1.00 59.89 H new ATOM 0 HG3 LYS A 715 15.767 28.585 26.213 1.00 59.89 H new ATOM 0 HD2 LYS A 715 17.085 29.957 24.624 1.00 60.35 H new ATOM 0 HD3 LYS A 715 15.753 30.728 24.373 1.00 60.35 H new ATOM 0 HE2 LYS A 715 17.121 30.589 26.849 1.00 61.45 H new ATOM 0 HE3 LYS A 715 16.898 31.888 26.016 1.00 61.45 H new ATOM 0 HZ1 LYS A 715 15.343 31.974 27.593 1.00 62.18 H new ATOM 0 HZ2 LYS A 715 14.575 31.526 26.443 1.00 62.18 H new ATOM 0 HZ3 LYS A 715 14.979 30.573 27.463 1.00 62.18 H new ATOM 864 N GLY A 716 12.858 26.559 25.792 1.00 58.24 N ANISOU 864 N GLY A 716 7925 5720 8485 485 1934 -195 N ATOM 865 CA GLY A 716 11.420 26.686 25.904 1.00 59.23 C ANISOU 865 CA GLY A 716 7905 6008 8593 583 1983 -212 C ATOM 866 C GLY A 716 10.651 25.385 25.835 1.00 59.68 C ANISOU 866 C GLY A 716 7737 6191 8746 869 2037 -147 C ATOM 867 O GLY A 716 9.458 25.367 26.173 1.00 61.28 O ANISOU 867 O GLY A 716 8229 6174 8880 827 2109 -384 O ATOM 0 H GLY A 716 13.265 26.444 26.541 1.00 58.24 H new ATOM 0 HA2 GLY A 716 11.213 27.123 26.745 1.00 59.23 H new ATOM 0 HA3 GLY A 716 11.105 27.269 25.196 1.00 59.23 H new ATOM 871 N ASP A 717 11.280 24.300 25.399 1.00 58.25 N ANISOU 871 N ASP A 717 7291 6285 8556 1110 1853 300 N ATOM 872 CA ASP A 717 10.640 22.998 25.468 1.00 56.40 C ANISOU 872 CA ASP A 717 6588 6517 8325 1632 1484 869 C ATOM 873 C ASP A 717 10.868 22.415 26.858 1.00 55.22 C ANISOU 873 C ASP A 717 6273 6483 8225 1586 1209 808 C ATOM 874 O ASP A 717 11.995 22.416 27.360 1.00 56.83 O ANISOU 874 O ASP A 717 6424 6812 8358 1055 1365 565 O ATOM 875 CB ASP A 717 11.189 22.076 24.375 1.00 55.68 C ANISOU 875 CB ASP A 717 6190 6664 8300 2210 1229 1537 C ATOM 876 CG ASP A 717 10.900 22.596 22.966 1.00 56.88 C ANISOU 876 CG ASP A 717 5952 7104 8556 2543 1289 1753 C ATOM 877 OD1 ASP A 717 9.914 23.350 22.799 1.00 57.94 O ANISOU 877 OD1 ASP A 717 5894 7356 8763 2509 1684 1986 O ATOM 878 OD2 ASP A 717 11.651 22.263 22.021 1.00 56.52 O1- ANISOU 878 OD2 ASP A 717 5772 7235 8469 2633 976 1734 O1- ATOM 0 H ASP A 717 12.071 24.298 25.063 1.00 58.25 H new ATOM 0 HA ASP A 717 9.686 23.086 25.316 1.00 56.40 H new ATOM 0 HB2 ASP A 717 12.147 21.979 24.490 1.00 55.68 H new ATOM 0 HB3 ASP A 717 10.800 21.193 24.476 1.00 55.68 H new ATOM 883 N ASP A 718 9.791 21.974 27.507 1.00 53.15 N ANISOU 883 N ASP A 718 6150 6182 7861 1633 961 686 N ATOM 884 CA ASP A 718 9.926 21.202 28.734 1.00 51.01 C ANISOU 884 CA ASP A 718 6000 5915 7467 1193 770 220 C ATOM 885 C ASP A 718 10.365 19.787 28.380 1.00 45.57 C ANISOU 885 C ASP A 718 5503 5456 6353 1047 334 3 C ATOM 886 O ASP A 718 9.989 19.249 27.335 1.00 45.66 O ANISOU 886 O ASP A 718 5555 5664 6131 1235 145 123 O ATOM 887 CB ASP A 718 8.611 21.161 29.518 1.00 52.50 C ANISOU 887 CB ASP A 718 6138 5831 7978 1179 643 -19 C ATOM 888 CG ASP A 718 8.216 22.520 30.092 1.00 55.06 C ANISOU 888 CG ASP A 718 6248 5990 8681 935 877 -172 C ATOM 889 OD1 ASP A 718 9.113 23.322 30.442 1.00 54.72 O ANISOU 889 OD1 ASP A 718 6074 5800 8918 636 1000 -349 O ATOM 890 OD2 ASP A 718 6.997 22.777 30.203 1.00 56.22 O1- ANISOU 890 OD2 ASP A 718 6369 6089 8903 977 875 -33 O1- ATOM 0 H ASP A 718 8.981 22.111 27.254 1.00 53.15 H new ATOM 0 HA ASP A 718 10.590 21.628 29.298 1.00 51.01 H new ATOM 0 HB2 ASP A 718 7.903 20.843 28.936 1.00 52.50 H new ATOM 0 HB3 ASP A 718 8.692 20.521 30.242 1.00 52.50 H new ATOM 895 N LEU A 719 11.175 19.181 29.249 1.00 41.12 N ANISOU 895 N LEU A 719 5134 5098 5393 364 347 -349 N ATOM 896 CA LEU A 719 11.717 17.858 28.954 1.00 35.87 C ANISOU 896 CA LEU A 719 4273 4596 4760 444 323 -113 C ATOM 897 C LEU A 719 10.874 16.782 29.614 1.00 34.57 C ANISOU 897 C LEU A 719 4118 4651 4366 433 677 35 C ATOM 898 O LEU A 719 10.682 16.820 30.839 1.00 36.58 O ANISOU 898 O LEU A 719 4476 4935 4490 182 1082 -372 O ATOM 899 CB LEU A 719 13.162 17.744 29.422 1.00 35.88 C ANISOU 899 CB LEU A 719 4280 4492 4861 6 302 -211 C ATOM 900 CG LEU A 719 14.134 18.701 28.754 1.00 36.77 C ANISOU 900 CG LEU A 719 4371 4560 5039 -237 198 -63 C ATOM 901 CD1 LEU A 719 15.528 18.457 29.325 1.00 38.45 C ANISOU 901 CD1 LEU A 719 4970 4637 5002 -224 550 80 C ATOM 902 CD2 LEU A 719 14.118 18.539 27.247 1.00 37.70 C ANISOU 902 CD2 LEU A 719 4415 4663 5249 -930 216 -274 C ATOM 0 H LEU A 719 11.419 19.514 30.003 1.00 41.12 H new ATOM 0 HA LEU A 719 11.695 17.733 27.992 1.00 35.87 H new ATOM 0 HB2 LEU A 719 13.190 17.894 30.380 1.00 35.88 H new ATOM 0 HB3 LEU A 719 13.466 16.836 29.268 1.00 35.88 H new ATOM 0 HG LEU A 719 13.866 19.615 28.938 1.00 36.77 H new ATOM 0 HD11 LEU A 719 16.160 19.062 28.907 1.00 38.45 H new ATOM 0 HD12 LEU A 719 15.517 18.612 30.282 1.00 38.45 H new ATOM 0 HD13 LEU A 719 15.794 17.541 29.150 1.00 38.45 H new ATOM 0 HD21 LEU A 719 14.746 19.161 26.848 1.00 37.70 H new ATOM 0 HD22 LEU A 719 14.371 17.631 27.016 1.00 37.70 H new ATOM 0 HD23 LEU A 719 13.226 18.721 26.911 1.00 37.70 H new ATOM 914 N PRO A 720 10.369 15.810 28.870 1.00 31.72 N ANISOU 914 N PRO A 720 3816 4259 3979 531 962 468 N ATOM 915 CA PRO A 720 9.592 14.740 29.483 1.00 34.46 C ANISOU 915 CA PRO A 720 4071 4506 4517 217 1085 299 C ATOM 916 C PRO A 720 10.503 13.690 30.094 1.00 35.46 C ANISOU 916 C PRO A 720 3723 4926 4824 67 1131 864 C ATOM 917 O PRO A 720 11.710 13.663 29.867 1.00 37.55 O ANISOU 917 O PRO A 720 3715 5120 5432 227 733 1277 O ATOM 918 CB PRO A 720 8.820 14.169 28.299 1.00 34.57 C ANISOU 918 CB PRO A 720 4194 4479 4460 419 1207 516 C ATOM 919 CG PRO A 720 9.724 14.328 27.187 1.00 33.08 C ANISOU 919 CG PRO A 720 4122 4197 4251 199 665 861 C ATOM 920 CD PRO A 720 10.470 15.620 27.416 1.00 33.08 C ANISOU 920 CD PRO A 720 4089 4180 4299 267 896 616 C ATOM 0 HA PRO A 720 9.021 15.042 30.207 1.00 34.46 H new ATOM 0 HB2 PRO A 720 8.590 13.237 28.440 1.00 34.57 H new ATOM 0 HB3 PRO A 720 7.989 14.647 28.153 1.00 34.57 H new ATOM 0 HG2 PRO A 720 10.339 13.580 27.134 1.00 33.08 H new ATOM 0 HG3 PRO A 720 9.237 14.355 26.348 1.00 33.08 H new ATOM 0 HD2 PRO A 720 11.393 15.557 27.126 1.00 33.08 H new ATOM 0 HD3 PRO A 720 10.069 16.357 26.929 1.00 33.08 H new ATOM 928 N PHE A 721 9.888 12.788 30.841 1.00 37.28 N ANISOU 928 N PHE A 721 3923 5026 5218 -245 1010 519 N ATOM 929 CA PHE A 721 10.554 11.564 31.245 1.00 36.40 C ANISOU 929 CA PHE A 721 3804 4925 5101 -418 580 1148 C ATOM 930 C PHE A 721 10.801 10.705 30.005 1.00 33.80 C ANISOU 930 C PHE A 721 3111 4695 5036 -336 -55 955 C ATOM 931 O PHE A 721 9.927 10.593 29.149 1.00 34.57 O ANISOU 931 O PHE A 721 3260 4830 5045 -64 141 891 O ATOM 932 CB PHE A 721 9.692 10.797 32.248 1.00 40.67 C ANISOU 932 CB PHE A 721 4640 5229 5583 -713 1046 1380 C ATOM 933 CG PHE A 721 10.199 9.415 32.556 1.00 46.47 C ANISOU 933 CG PHE A 721 5937 5813 5908 -667 1008 1282 C ATOM 934 CD1 PHE A 721 11.036 9.194 33.639 1.00 48.76 C ANISOU 934 CD1 PHE A 721 6398 6018 6112 -876 953 1191 C ATOM 935 CD2 PHE A 721 9.828 8.330 31.769 1.00 47.77 C ANISOU 935 CD2 PHE A 721 6444 5877 5830 -490 941 1382 C ATOM 936 CE1 PHE A 721 11.499 7.920 33.929 1.00 49.94 C ANISOU 936 CE1 PHE A 721 6783 6049 6144 -882 801 1146 C ATOM 937 CE2 PHE A 721 10.292 7.062 32.050 1.00 49.61 C ANISOU 937 CE2 PHE A 721 6878 5973 6000 -630 947 1200 C ATOM 938 CZ PHE A 721 11.131 6.858 33.129 1.00 50.32 C ANISOU 938 CZ PHE A 721 7016 6025 6078 -630 802 1301 C ATOM 0 H PHE A 721 9.080 12.867 31.126 1.00 37.28 H new ATOM 0 HA PHE A 721 11.399 11.780 31.670 1.00 36.40 H new ATOM 0 HB2 PHE A 721 9.642 11.305 33.073 1.00 40.67 H new ATOM 0 HB3 PHE A 721 8.789 10.731 31.901 1.00 40.67 H new ATOM 0 HD1 PHE A 721 11.290 9.909 34.177 1.00 48.76 H new ATOM 0 HD2 PHE A 721 9.260 8.461 31.044 1.00 47.77 H new ATOM 0 HE1 PHE A 721 12.056 7.782 34.661 1.00 49.94 H new ATOM 0 HE2 PHE A 721 10.041 6.345 31.514 1.00 49.61 H new ATOM 0 HZ PHE A 721 11.448 6.004 33.316 1.00 50.32 H new ATOM 948 N PRO A 722 11.967 10.049 29.906 1.00 33.98 N ANISOU 948 N PRO A 722 3422 4276 5215 -499 10 831 N ATOM 949 CA PRO A 722 13.098 10.030 30.828 1.00 32.62 C ANISOU 949 CA PRO A 722 2946 4217 5231 496 -26 1410 C ATOM 950 C PRO A 722 14.157 11.043 30.454 1.00 31.66 C ANISOU 950 C PRO A 722 2972 4164 4894 105 0 1181 C ATOM 951 O PRO A 722 15.250 11.012 31.022 1.00 31.90 O ANISOU 951 O PRO A 722 2871 4512 4736 -164 -19 1135 O ATOM 952 CB PRO A 722 13.632 8.619 30.649 1.00 34.92 C ANISOU 952 CB PRO A 722 3636 4075 5556 515 422 1362 C ATOM 953 CG PRO A 722 13.501 8.438 29.166 1.00 37.05 C ANISOU 953 CG PRO A 722 4072 4170 5834 -23 606 1095 C ATOM 954 CD PRO A 722 12.194 9.108 28.794 1.00 35.48 C ANISOU 954 CD PRO A 722 3881 4108 5491 -536 494 1087 C ATOM 0 HA PRO A 722 12.846 10.254 31.737 1.00 32.62 H new ATOM 0 HB2 PRO A 722 14.551 8.536 30.947 1.00 34.92 H new ATOM 0 HB3 PRO A 722 13.113 7.966 31.144 1.00 34.92 H new ATOM 0 HG2 PRO A 722 14.247 8.843 28.697 1.00 37.05 H new ATOM 0 HG3 PRO A 722 13.492 7.498 28.928 1.00 37.05 H new ATOM 0 HD2 PRO A 722 12.257 9.568 27.943 1.00 35.48 H new ATOM 0 HD3 PRO A 722 11.472 8.465 28.716 1.00 35.48 H new ATOM 962 N VAL A 723 13.835 11.925 29.504 1.00 29.55 N ANISOU 962 N VAL A 723 2854 3926 4448 -169 -232 945 N ATOM 963 CA VAL A 723 14.825 12.857 28.967 1.00 28.54 C ANISOU 963 CA VAL A 723 2757 3738 4348 -252 -73 902 C ATOM 964 C VAL A 723 15.345 13.773 30.060 1.00 28.49 C ANISOU 964 C VAL A 723 3031 3680 4116 -384 485 736 C ATOM 965 O VAL A 723 16.550 14.037 30.148 1.00 27.33 O ANISOU 965 O VAL A 723 2724 3557 4103 -284 294 122 O ATOM 966 CB VAL A 723 14.214 13.660 27.806 1.00 30.69 C ANISOU 966 CB VAL A 723 3283 3893 4487 -210 21 997 C ATOM 967 CG1 VAL A 723 15.229 14.599 27.199 1.00 31.75 C ANISOU 967 CG1 VAL A 723 3575 4001 4488 -106 196 919 C ATOM 968 CG2 VAL A 723 13.669 12.724 26.733 1.00 33.64 C ANISOU 968 CG2 VAL A 723 3682 4234 4865 -354 -26 1248 C ATOM 0 H VAL A 723 13.051 11.998 29.159 1.00 29.55 H new ATOM 0 HA VAL A 723 15.580 12.354 28.624 1.00 28.54 H new ATOM 0 HB VAL A 723 13.484 14.187 28.166 1.00 30.69 H new ATOM 0 HG11 VAL A 723 14.819 15.092 26.471 1.00 31.75 H new ATOM 0 HG12 VAL A 723 15.540 15.221 27.875 1.00 31.75 H new ATOM 0 HG13 VAL A 723 15.981 14.088 26.860 1.00 31.75 H new ATOM 0 HG21 VAL A 723 13.288 13.247 26.010 1.00 33.64 H new ATOM 0 HG22 VAL A 723 14.389 12.173 26.388 1.00 33.64 H new ATOM 0 HG23 VAL A 723 12.983 12.156 27.117 1.00 33.64 H new ATOM 978 N ARG A 724 14.453 14.312 30.884 1.00 30.63 N ANISOU 978 N ARG A 724 3405 3924 4310 -87 319 940 N ATOM 979 CA ARG A 724 14.884 15.302 31.874 1.00 31.79 C ANISOU 979 CA ARG A 724 3612 3963 4505 13 66 586 C ATOM 980 C ARG A 724 15.967 14.745 32.806 1.00 29.49 C ANISOU 980 C ARG A 724 3422 3653 4132 -235 -142 91 C ATOM 981 O ARG A 724 17.003 15.387 33.029 1.00 29.57 O ANISOU 981 O ARG A 724 3444 3914 3879 230 -31 324 O ATOM 982 CB ARG A 724 13.661 15.782 32.658 1.00 36.73 C ANISOU 982 CB ARG A 724 4300 4586 5069 488 38 577 C ATOM 983 CG ARG A 724 13.930 16.782 33.744 1.00 41.07 C ANISOU 983 CG ARG A 724 4868 5247 5491 604 -268 123 C ATOM 984 CD ARG A 724 12.615 17.323 34.294 1.00 46.75 C ANISOU 984 CD ARG A 724 5728 5957 6078 585 115 -205 C ATOM 985 NE ARG A 724 12.807 18.339 35.331 1.00 52.67 N ANISOU 985 NE ARG A 724 6772 6544 6696 516 488 -248 N ATOM 986 CZ ARG A 724 12.756 18.115 36.647 1.00 56.95 C ANISOU 986 CZ ARG A 724 7490 6987 7160 382 966 -491 C ATOM 987 NH1 ARG A 724 12.511 16.895 37.127 1.00 57.83 N ANISOU 987 NH1 ARG A 724 7720 7099 7155 368 899 -487 N ATOM 988 NH2 ARG A 724 12.954 19.125 37.493 1.00 58.60 N ANISOU 988 NH2 ARG A 724 7580 7225 7462 424 1145 -554 N ATOM 0 H ARG A 724 13.613 14.127 30.891 1.00 30.63 H new ATOM 0 HA ARG A 724 15.286 16.055 31.413 1.00 31.79 H new ATOM 0 HB2 ARG A 724 13.030 16.171 32.033 1.00 36.73 H new ATOM 0 HB3 ARG A 724 13.228 15.009 33.054 1.00 36.73 H new ATOM 0 HG2 ARG A 724 14.441 16.367 34.457 1.00 41.07 H new ATOM 0 HG3 ARG A 724 14.468 17.511 33.397 1.00 41.07 H new ATOM 0 HD2 ARG A 724 12.097 17.703 33.567 1.00 46.75 H new ATOM 0 HD3 ARG A 724 12.096 16.589 34.659 1.00 46.75 H new ATOM 0 HE ARG A 724 12.965 19.144 35.072 1.00 52.67 H new ATOM 0 HH11 ARG A 724 12.383 16.238 36.587 1.00 57.83 H new ATOM 0 HH12 ARG A 724 12.481 16.765 37.977 1.00 57.83 H new ATOM 0 HH21 ARG A 724 13.113 19.914 37.191 1.00 58.60 H new ATOM 0 HH22 ARG A 724 12.923 18.988 38.341 1.00 58.60 H new ATOM 1002 N ASP A 725 15.730 13.570 33.388 1.00 30.08 N ANISOU 1002 N ASP A 725 3683 3813 3934 198 94 244 N ATOM 1003 CA ASP A 725 16.693 12.968 34.308 1.00 30.41 C ANISOU 1003 CA ASP A 725 3841 3781 3930 267 -459 271 C ATOM 1004 C ASP A 725 17.999 12.619 33.595 1.00 29.62 C ANISOU 1004 C ASP A 725 3761 3606 3889 73 -512 587 C ATOM 1005 O ASP A 725 19.092 12.812 34.142 1.00 31.02 O ANISOU 1005 O ASP A 725 4214 3588 3984 63 -40 529 O ATOM 1006 CB ASP A 725 16.044 11.734 34.935 1.00 34.91 C ANISOU 1006 CB ASP A 725 4699 4226 4338 340 -429 415 C ATOM 1007 CG ASP A 725 16.622 11.356 36.300 1.00 38.79 C ANISOU 1007 CG ASP A 725 5616 4371 4753 -557 -422 -452 C ATOM 1008 OD1 ASP A 725 17.379 12.143 36.928 1.00 41.82 O ANISOU 1008 OD1 ASP A 725 6327 4442 5122 -563 29 -534 O ATOM 1009 OD2 ASP A 725 16.252 10.249 36.766 1.00 42.08 O1- ANISOU 1009 OD2 ASP A 725 6377 4621 4989 -204 -55 -341 O1- ATOM 0 H ASP A 725 15.017 13.105 33.263 1.00 30.08 H new ATOM 0 HA ASP A 725 16.926 13.602 35.005 1.00 30.41 H new ATOM 0 HB2 ASP A 725 15.092 11.893 35.030 1.00 34.91 H new ATOM 0 HB3 ASP A 725 16.147 10.983 34.330 1.00 34.91 H new ATOM 1014 N ARG A 726 17.906 12.107 32.374 1.00 27.62 N ANISOU 1014 N ARG A 726 3271 3265 3959 -135 -357 339 N ATOM 1015 CA ARG A 726 19.098 11.759 31.610 1.00 28.32 C ANISOU 1015 CA ARG A 726 3390 3046 4323 -37 121 398 C ATOM 1016 C ARG A 726 19.919 12.989 31.243 1.00 27.90 C ANISOU 1016 C ARG A 726 3152 3143 4305 10 -15 165 C ATOM 1017 O ARG A 726 21.147 12.980 31.352 1.00 28.58 O ANISOU 1017 O ARG A 726 3178 3311 4369 175 5 135 O ATOM 1018 CB ARG A 726 18.688 10.997 30.365 1.00 26.31 C ANISOU 1018 CB ARG A 726 3144 2994 3860 -241 66 548 C ATOM 1019 CG ARG A 726 18.223 9.587 30.720 1.00 25.48 C ANISOU 1019 CG ARG A 726 3238 2869 3573 -301 -420 545 C ATOM 1020 CD ARG A 726 17.724 8.802 29.548 1.00 26.77 C ANISOU 1020 CD ARG A 726 3393 3192 3587 -493 -217 639 C ATOM 1021 NE ARG A 726 17.498 7.433 29.975 1.00 27.18 N ANISOU 1021 NE ARG A 726 3862 3382 3082 -293 -183 590 N ATOM 1022 CZ ARG A 726 17.375 6.404 29.163 1.00 28.75 C ANISOU 1022 CZ ARG A 726 3862 3699 3362 -754 311 306 C ATOM 1023 NH1 ARG A 726 17.385 6.570 27.852 1.00 30.79 N ANISOU 1023 NH1 ARG A 726 3941 3994 3763 -1040 132 318 N ATOM 1024 NH2 ARG A 726 17.227 5.203 29.687 1.00 29.39 N ANISOU 1024 NH2 ARG A 726 4138 3587 3443 -700 684 -11 N ATOM 0 H ARG A 726 17.163 11.953 31.969 1.00 27.62 H new ATOM 0 HA ARG A 726 19.664 11.199 32.164 1.00 28.32 H new ATOM 0 HB2 ARG A 726 17.975 11.472 29.910 1.00 26.31 H new ATOM 0 HB3 ARG A 726 19.436 10.950 29.749 1.00 26.31 H new ATOM 0 HG2 ARG A 726 18.959 9.107 31.130 1.00 25.48 H new ATOM 0 HG3 ARG A 726 17.518 9.646 31.383 1.00 25.48 H new ATOM 0 HD2 ARG A 726 16.902 9.189 29.208 1.00 26.77 H new ATOM 0 HD3 ARG A 726 18.370 8.828 28.825 1.00 26.77 H new ATOM 0 HE ARG A 726 17.440 7.283 30.820 1.00 27.18 H new ATOM 0 HH11 ARG A 726 17.473 7.358 27.519 1.00 30.79 H new ATOM 0 HH12 ARG A 726 17.304 5.890 27.332 1.00 30.79 H new ATOM 0 HH21 ARG A 726 17.213 5.105 30.541 1.00 29.39 H new ATOM 0 HH22 ARG A 726 17.145 4.517 29.174 1.00 29.39 H new ATOM 1038 N VAL A 727 19.275 14.044 30.782 1.00 29.26 N ANISOU 1038 N VAL A 727 3231 3329 4559 88 -25 71 N ATOM 1039 CA VAL A 727 20.007 15.278 30.513 1.00 29.40 C ANISOU 1039 CA VAL A 727 3109 3443 4618 42 -374 8 C ATOM 1040 C VAL A 727 20.650 15.818 31.782 1.00 30.52 C ANISOU 1040 C VAL A 727 3349 3271 4977 224 -317 137 C ATOM 1041 O VAL A 727 21.717 16.434 31.726 1.00 31.92 O ANISOU 1041 O VAL A 727 3625 3415 5087 169 -145 142 O ATOM 1042 CB VAL A 727 19.052 16.306 29.861 1.00 31.20 C ANISOU 1042 CB VAL A 727 3325 3652 4879 -232 -368 295 C ATOM 1043 CG1 VAL A 727 19.646 17.685 29.848 1.00 30.64 C ANISOU 1043 CG1 VAL A 727 3037 3663 4941 -323 -1153 106 C ATOM 1044 CG2 VAL A 727 18.713 15.894 28.437 1.00 33.28 C ANISOU 1044 CG2 VAL A 727 3676 3942 5025 -339 -367 543 C ATOM 0 H VAL A 727 18.431 14.074 30.619 1.00 29.26 H new ATOM 0 HA VAL A 727 20.730 15.097 29.893 1.00 29.40 H new ATOM 0 HB VAL A 727 18.244 16.323 30.397 1.00 31.20 H new ATOM 0 HG11 VAL A 727 19.023 18.302 29.434 1.00 30.64 H new ATOM 0 HG12 VAL A 727 19.825 17.969 30.758 1.00 30.64 H new ATOM 0 HG13 VAL A 727 20.475 17.676 29.344 1.00 30.64 H new ATOM 0 HG21 VAL A 727 18.114 16.549 28.044 1.00 33.28 H new ATOM 0 HG22 VAL A 727 19.527 15.845 27.912 1.00 33.28 H new ATOM 0 HG23 VAL A 727 18.281 15.026 28.445 1.00 33.28 H new ATOM 1054 N GLY A 728 20.015 15.601 32.936 1.00 30.14 N ANISOU 1054 N GLY A 728 3626 3195 4630 -36 183 -352 N ATOM 1055 CA GLY A 728 20.551 15.999 34.217 1.00 32.63 C ANISOU 1055 CA GLY A 728 4291 3488 4621 -261 239 -230 C ATOM 1056 C GLY A 728 21.871 15.362 34.561 1.00 31.58 C ANISOU 1056 C GLY A 728 4139 3512 4346 -17 111 -477 C ATOM 1057 O GLY A 728 22.589 15.879 35.427 1.00 34.15 O ANISOU 1057 O GLY A 728 4744 3737 4494 -54 237 -314 O ATOM 0 H GLY A 728 19.250 15.212 32.987 1.00 30.14 H new ATOM 0 HA2 GLY A 728 20.657 16.963 34.226 1.00 32.63 H new ATOM 0 HA3 GLY A 728 19.907 15.778 34.908 1.00 32.63 H new ATOM 1061 N GLN A 729 22.201 14.237 33.930 1.00 28.31 N ANISOU 1061 N GLN A 729 3689 3356 3712 151 75 -38 N ATOM 1062 CA GLN A 729 23.471 13.556 34.146 1.00 27.51 C ANISOU 1062 CA GLN A 729 3507 3199 3748 -126 -209 -123 C ATOM 1063 C GLN A 729 24.599 14.071 33.260 1.00 27.22 C ANISOU 1063 C GLN A 729 3852 3186 3305 -159 -156 -68 C ATOM 1064 O GLN A 729 25.770 13.741 33.506 1.00 27.70 O ANISOU 1064 O GLN A 729 3745 3324 3457 -357 -177 -14 O ATOM 1065 CB GLN A 729 23.285 12.059 33.888 1.00 28.53 C ANISOU 1065 CB GLN A 729 3713 3051 4077 189 -229 217 C ATOM 1066 CG GLN A 729 22.324 11.432 34.865 1.00 31.61 C ANISOU 1066 CG GLN A 729 4088 3413 4509 -382 28 316 C ATOM 1067 CD GLN A 729 22.889 11.390 36.261 1.00 34.47 C ANISOU 1067 CD GLN A 729 4606 3870 4623 -134 -3 463 C ATOM 1068 OE1 GLN A 729 23.962 10.830 36.493 1.00 37.72 O ANISOU 1068 OE1 GLN A 729 5126 4534 4673 -52 -73 355 O ATOM 1069 NE2 GLN A 729 22.171 11.976 37.201 1.00 36.67 N ANISOU 1069 NE2 GLN A 729 5172 3856 4903 -201 542 573 N ATOM 0 H GLN A 729 21.689 13.846 33.360 1.00 28.31 H new ATOM 0 HA GLN A 729 23.730 13.733 35.064 1.00 27.51 H new ATOM 0 HB2 GLN A 729 22.959 11.926 32.984 1.00 28.53 H new ATOM 0 HB3 GLN A 729 24.144 11.612 33.949 1.00 28.53 H new ATOM 0 HG2 GLN A 729 21.493 11.933 34.868 1.00 31.61 H new ATOM 0 HG3 GLN A 729 22.111 10.531 34.576 1.00 31.61 H new ATOM 0 HE21 GLN A 729 21.427 12.357 36.999 1.00 36.67 H new ATOM 0 HE22 GLN A 729 22.448 11.977 38.015 1.00 36.67 H new ATOM 1078 N ILE A 730 24.288 14.838 32.227 1.00 27.08 N ANISOU 1078 N ILE A 730 4080 3096 3113 -308 -67 -407 N ATOM 1079 CA ILE A 730 25.304 15.208 31.253 1.00 29.26 C ANISOU 1079 CA ILE A 730 3947 3826 3344 -463 70 -405 C ATOM 1080 C ILE A 730 26.347 16.135 31.867 1.00 28.93 C ANISOU 1080 C ILE A 730 4275 3610 3107 -581 409 -353 C ATOM 1081 O ILE A 730 27.527 15.959 31.572 1.00 29.53 O ANISOU 1081 O ILE A 730 4396 3706 3118 -1088 504 -484 O ATOM 1082 CB ILE A 730 24.685 15.854 30.008 1.00 31.50 C ANISOU 1082 CB ILE A 730 4136 4324 3511 -959 -168 -532 C ATOM 1083 CG1 ILE A 730 23.724 14.893 29.305 1.00 34.18 C ANISOU 1083 CG1 ILE A 730 4621 4300 4065 -875 -38 -1054 C ATOM 1084 CG2 ILE A 730 25.796 16.300 29.078 1.00 34.03 C ANISOU 1084 CG2 ILE A 730 4062 5116 3754 -544 -324 -349 C ATOM 1085 CD1 ILE A 730 24.375 13.644 28.814 1.00 38.23 C ANISOU 1085 CD1 ILE A 730 5223 4528 4774 -619 312 -1218 C ATOM 0 H ILE A 730 23.503 15.153 32.071 1.00 27.08 H new ATOM 0 HA ILE A 730 25.745 14.389 30.978 1.00 29.26 H new ATOM 0 HB ILE A 730 24.164 16.627 30.275 1.00 31.50 H new ATOM 0 HG12 ILE A 730 23.010 14.657 29.918 1.00 34.18 H new ATOM 0 HG13 ILE A 730 23.314 15.351 28.555 1.00 34.18 H new ATOM 0 HG21 ILE A 730 25.411 16.710 28.287 1.00 34.03 H new ATOM 0 HG22 ILE A 730 26.361 16.944 29.534 1.00 34.03 H new ATOM 0 HG23 ILE A 730 26.328 15.532 28.817 1.00 34.03 H new ATOM 0 HD11 ILE A 730 23.713 13.083 28.381 1.00 38.23 H new ATOM 0 HD12 ILE A 730 25.072 13.870 28.178 1.00 38.23 H new ATOM 0 HD13 ILE A 730 24.764 13.166 29.563 1.00 38.23 H new ATOM 1097 N PRO A 731 25.996 17.126 32.699 1.00 25.69 N ANISOU 1097 N PRO A 731 3820 3148 2793 -440 -18 -349 N ATOM 1098 CA PRO A 731 27.064 17.968 33.264 1.00 26.35 C ANISOU 1098 CA PRO A 731 3982 3386 2642 -149 -134 -329 C ATOM 1099 C PRO A 731 28.130 17.182 33.984 1.00 27.99 C ANISOU 1099 C PRO A 731 4191 3429 3013 -386 65 -253 C ATOM 1100 O PRO A 731 29.305 17.509 33.848 1.00 28.90 O ANISOU 1100 O PRO A 731 4128 3553 3302 -648 -17 -279 O ATOM 1101 CB PRO A 731 26.312 18.900 34.208 1.00 27.61 C ANISOU 1101 CB PRO A 731 4380 3490 2621 -134 -113 -386 C ATOM 1102 CG PRO A 731 25.020 19.119 33.484 1.00 27.34 C ANISOU 1102 CG PRO A 731 4051 3533 2804 275 -335 -59 C ATOM 1103 CD PRO A 731 24.676 17.770 32.839 1.00 28.87 C ANISOU 1103 CD PRO A 731 4441 3340 3190 174 279 -113 C ATOM 0 HA PRO A 731 27.559 18.435 32.573 1.00 26.35 H new ATOM 0 HB2 PRO A 731 26.174 18.497 35.080 1.00 27.61 H new ATOM 0 HB3 PRO A 731 26.791 19.731 34.352 1.00 27.61 H new ATOM 0 HG2 PRO A 731 24.321 19.402 34.095 1.00 27.34 H new ATOM 0 HG3 PRO A 731 25.109 19.814 32.813 1.00 27.34 H new ATOM 0 HD2 PRO A 731 24.078 17.247 33.396 1.00 28.87 H new ATOM 0 HD3 PRO A 731 24.238 17.883 31.981 1.00 28.87 H new ATOM 1111 N ASN A 732 27.771 16.169 34.769 1.00 28.59 N ANISOU 1111 N ASN A 732 4492 3406 2966 -134 189 -155 N ATOM 1112 CA ASN A 732 28.821 15.412 35.424 1.00 31.94 C ANISOU 1112 CA ASN A 732 4766 4073 3296 155 334 -360 C ATOM 1113 C ASN A 732 29.645 14.648 34.406 1.00 31.33 C ANISOU 1113 C ASN A 732 4404 3862 3638 164 409 -356 C ATOM 1114 O ASN A 732 30.856 14.511 34.574 1.00 30.53 O ANISOU 1114 O ASN A 732 4018 3941 3640 63 -186 -861 O ATOM 1115 CB ASN A 732 28.233 14.460 36.470 1.00 37.16 C ANISOU 1115 CB ASN A 732 5630 4788 3701 320 288 -57 C ATOM 1116 CG ASN A 732 27.876 15.175 37.765 1.00 45.83 C ANISOU 1116 CG ASN A 732 6812 5927 4672 344 745 177 C ATOM 1117 OD1 ASN A 732 26.836 14.919 38.349 1.00 50.61 O ANISOU 1117 OD1 ASN A 732 7388 6591 5252 687 1014 300 O ATOM 1118 ND2 ASN A 732 28.749 16.067 38.220 1.00 49.67 N ANISOU 1118 ND2 ASN A 732 7716 6217 4940 511 1062 369 N ATOM 0 H ASN A 732 26.965 15.916 34.928 1.00 28.59 H new ATOM 0 HA ASN A 732 29.406 16.037 35.880 1.00 31.94 H new ATOM 0 HB2 ASN A 732 27.440 14.035 36.108 1.00 37.16 H new ATOM 0 HB3 ASN A 732 28.872 13.755 36.658 1.00 37.16 H new ATOM 0 HD21 ASN A 732 28.591 16.489 38.952 1.00 49.67 H new ATOM 0 HD22 ASN A 732 29.473 16.223 37.782 1.00 49.67 H new ATOM 1125 N ILE A 733 29.015 14.197 33.326 1.00 28.61 N ANISOU 1125 N ILE A 733 3803 3661 3406 56 281 -448 N ATOM 1126 CA ILE A 733 29.735 13.480 32.286 1.00 28.99 C ANISOU 1126 CA ILE A 733 4121 3578 3315 -34 342 -458 C ATOM 1127 C ILE A 733 30.642 14.410 31.505 1.00 28.05 C ANISOU 1127 C ILE A 733 4046 3569 3041 -145 372 -418 C ATOM 1128 O ILE A 733 31.728 14.000 31.078 1.00 27.37 O ANISOU 1128 O ILE A 733 3695 3661 3045 -284 297 -551 O ATOM 1129 CB ILE A 733 28.713 12.753 31.398 1.00 27.74 C ANISOU 1129 CB ILE A 733 3911 3521 3106 109 202 -768 C ATOM 1130 CG1 ILE A 733 28.168 11.581 32.196 1.00 28.99 C ANISOU 1130 CG1 ILE A 733 4273 3600 3142 233 -232 -747 C ATOM 1131 CG2 ILE A 733 29.325 12.314 30.097 1.00 29.70 C ANISOU 1131 CG2 ILE A 733 4244 3774 3267 96 327 -1372 C ATOM 1132 CD1 ILE A 733 26.995 10.921 31.594 1.00 31.81 C ANISOU 1132 CD1 ILE A 733 4891 3968 3227 -220 -189 -1311 C ATOM 0 H ILE A 733 28.174 14.296 33.178 1.00 28.61 H new ATOM 0 HA ILE A 733 30.323 12.817 32.681 1.00 28.99 H new ATOM 0 HB ILE A 733 27.989 13.352 31.157 1.00 27.74 H new ATOM 0 HG12 ILE A 733 28.873 10.924 32.306 1.00 28.99 H new ATOM 0 HG13 ILE A 733 27.929 11.892 33.083 1.00 28.99 H new ATOM 0 HG21 ILE A 733 28.656 11.860 29.561 1.00 29.70 H new ATOM 0 HG22 ILE A 733 29.652 13.090 29.615 1.00 29.70 H new ATOM 0 HG23 ILE A 733 30.062 11.709 30.274 1.00 29.70 H new ATOM 0 HD11 ILE A 733 26.710 10.188 32.161 1.00 31.81 H new ATOM 0 HD12 ILE A 733 26.272 11.562 31.507 1.00 31.81 H new ATOM 0 HD13 ILE A 733 27.230 10.579 30.717 1.00 31.81 H new ATOM 1144 N GLN A 734 30.242 15.676 31.329 1.00 27.07 N ANISOU 1144 N GLN A 734 4171 3091 3021 -128 724 -174 N ATOM 1145 CA GLN A 734 31.115 16.636 30.661 1.00 27.71 C ANISOU 1145 CA GLN A 734 4214 3149 3165 -32 800 -23 C ATOM 1146 C GLN A 734 32.410 16.821 31.428 1.00 30.03 C ANISOU 1146 C GLN A 734 4246 3555 3610 -199 588 -239 C ATOM 1147 O GLN A 734 33.490 16.941 30.833 1.00 29.92 O ANISOU 1147 O GLN A 734 3824 3911 3633 -96 44 -307 O ATOM 1148 CB GLN A 734 30.393 17.977 30.503 1.00 29.15 C ANISOU 1148 CB GLN A 734 4578 3594 2902 -132 558 294 C ATOM 1149 CG GLN A 734 29.296 17.932 29.454 1.00 30.39 C ANISOU 1149 CG GLN A 734 4854 3808 2886 -361 213 -150 C ATOM 1150 CD GLN A 734 28.518 19.218 29.377 1.00 33.42 C ANISOU 1150 CD GLN A 734 5497 4142 3058 -190 144 82 C ATOM 1151 OE1 GLN A 734 27.580 19.430 30.132 1.00 35.85 O ANISOU 1151 OE1 GLN A 734 5660 4534 3428 113 89 141 O ATOM 1152 NE2 GLN A 734 28.914 20.093 28.471 1.00 35.62 N ANISOU 1152 NE2 GLN A 734 6224 4133 3175 -218 122 280 N ATOM 0 H GLN A 734 29.483 15.990 31.585 1.00 27.07 H new ATOM 0 HA GLN A 734 31.335 16.289 29.782 1.00 27.71 H new ATOM 0 HB2 GLN A 734 30.010 18.236 31.356 1.00 29.15 H new ATOM 0 HB3 GLN A 734 31.038 18.661 30.262 1.00 29.15 H new ATOM 0 HG2 GLN A 734 29.689 17.743 28.588 1.00 30.39 H new ATOM 0 HG3 GLN A 734 28.690 17.202 29.656 1.00 30.39 H new ATOM 0 HE21 GLN A 734 29.578 19.909 27.957 1.00 35.62 H new ATOM 0 HE22 GLN A 734 28.508 20.847 28.395 1.00 35.62 H new ATOM 1161 N LEU A 735 32.326 16.860 32.751 1.00 31.03 N ANISOU 1161 N LEU A 735 4127 4005 3659 -636 367 -302 N ATOM 1162 CA LEU A 735 33.530 16.993 33.550 1.00 34.38 C ANISOU 1162 CA LEU A 735 4601 4771 3692 -841 62 -519 C ATOM 1163 C LEU A 735 34.398 15.741 33.456 1.00 33.36 C ANISOU 1163 C LEU A 735 3990 4903 3783 -722 -610 -347 C ATOM 1164 O LEU A 735 35.632 15.831 33.448 1.00 35.40 O ANISOU 1164 O LEU A 735 4260 5231 3960 -979 -66 -354 O ATOM 1165 CB LEU A 735 33.120 17.293 34.984 1.00 37.23 C ANISOU 1165 CB LEU A 735 5124 5341 3682 -1354 -87 -931 C ATOM 1166 CG LEU A 735 34.040 18.156 35.813 1.00 41.58 C ANISOU 1166 CG LEU A 735 5990 5414 4396 -1456 670 -1076 C ATOM 1167 CD1 LEU A 735 34.259 19.516 35.153 1.00 42.45 C ANISOU 1167 CD1 LEU A 735 6269 5155 4706 -1477 713 -1235 C ATOM 1168 CD2 LEU A 735 33.380 18.300 37.152 1.00 42.45 C ANISOU 1168 CD2 LEU A 735 6345 5482 4303 -1276 895 -1345 C ATOM 0 H LEU A 735 31.593 16.812 33.198 1.00 31.03 H new ATOM 0 HA LEU A 735 34.072 17.723 33.212 1.00 34.38 H new ATOM 0 HB2 LEU A 735 32.250 17.721 34.962 1.00 37.23 H new ATOM 0 HB3 LEU A 735 33.009 16.447 35.445 1.00 37.23 H new ATOM 0 HG LEU A 735 34.919 17.754 35.899 1.00 41.58 H new ATOM 0 HD11 LEU A 735 34.852 20.051 35.703 1.00 42.45 H new ATOM 0 HD12 LEU A 735 34.657 19.391 34.277 1.00 42.45 H new ATOM 0 HD13 LEU A 735 33.408 19.971 35.059 1.00 42.45 H new ATOM 0 HD21 LEU A 735 33.934 18.850 37.728 1.00 42.45 H new ATOM 0 HD22 LEU A 735 32.512 18.719 37.042 1.00 42.45 H new ATOM 0 HD23 LEU A 735 33.267 17.424 37.553 1.00 42.45 H new ATOM 1180 N LYS A 736 33.770 14.561 33.380 1.00 31.87 N ANISOU 1180 N LYS A 736 3844 4409 3856 -194 -578 -340 N ATOM 1181 CA LYS A 736 34.511 13.318 33.181 1.00 33.10 C ANISOU 1181 CA LYS A 736 3993 4730 3853 113 -504 -189 C ATOM 1182 C LYS A 736 35.191 13.293 31.821 1.00 32.53 C ANISOU 1182 C LYS A 736 3947 4517 3894 335 -245 58 C ATOM 1183 O LYS A 736 36.306 12.788 31.698 1.00 33.88 O ANISOU 1183 O LYS A 736 4072 4723 4078 22 -277 265 O ATOM 1184 CB LYS A 736 33.577 12.118 33.336 1.00 34.55 C ANISOU 1184 CB LYS A 736 4287 4811 4030 543 -557 -156 C ATOM 1185 CG LYS A 736 33.170 11.823 34.772 1.00 39.44 C ANISOU 1185 CG LYS A 736 4992 5227 4766 347 -127 -115 C ATOM 1186 CD LYS A 736 32.200 10.647 34.854 1.00 44.28 C ANISOU 1186 CD LYS A 736 5795 5722 5308 656 395 382 C ATOM 1187 CE LYS A 736 31.908 10.280 36.297 1.00 47.46 C ANISOU 1187 CE LYS A 736 6336 5975 5721 595 697 430 C ATOM 1188 NZ LYS A 736 30.524 9.773 36.468 1.00 51.45 N ANISOU 1188 NZ LYS A 736 7232 6209 6109 426 1193 477 N ATOM 0 H LYS A 736 32.918 14.463 33.442 1.00 31.87 H new ATOM 0 HA LYS A 736 35.203 13.267 33.858 1.00 33.10 H new ATOM 0 HB2 LYS A 736 32.777 12.274 32.810 1.00 34.55 H new ATOM 0 HB3 LYS A 736 34.011 11.333 32.966 1.00 34.55 H new ATOM 0 HG2 LYS A 736 33.961 11.628 35.299 1.00 39.44 H new ATOM 0 HG3 LYS A 736 32.758 12.611 35.160 1.00 39.44 H new ATOM 0 HD2 LYS A 736 31.373 10.874 34.401 1.00 44.28 H new ATOM 0 HD3 LYS A 736 32.576 9.881 34.392 1.00 44.28 H new ATOM 0 HE2 LYS A 736 32.539 9.605 36.593 1.00 47.46 H new ATOM 0 HE3 LYS A 736 32.040 11.058 36.861 1.00 47.46 H new ATOM 0 HZ1 LYS A 736 30.386 9.568 37.323 1.00 51.45 H new ATOM 0 HZ2 LYS A 736 29.945 10.400 36.217 1.00 51.45 H new ATOM 0 HZ3 LYS A 736 30.410 9.046 35.967 1.00 51.45 H new ATOM 1202 N LEU A 737 34.546 13.841 30.785 1.00 30.30 N ANISOU 1202 N LEU A 737 3629 4066 3817 318 -379 -117 N ATOM 1203 CA LEU A 737 35.189 13.871 29.475 1.00 28.82 C ANISOU 1203 CA LEU A 737 3127 3784 4041 11 -244 -411 C ATOM 1204 C LEU A 737 36.402 14.789 29.477 1.00 32.59 C ANISOU 1204 C LEU A 737 3349 4459 4576 189 -404 -489 C ATOM 1205 O LEU A 737 37.397 14.511 28.807 1.00 34.56 O ANISOU 1205 O LEU A 737 3505 4729 4897 59 -204 -869 O ATOM 1206 CB LEU A 737 34.203 14.303 28.395 1.00 27.72 C ANISOU 1206 CB LEU A 737 3118 3559 3857 109 117 -177 C ATOM 1207 CG LEU A 737 33.230 13.216 27.956 1.00 26.69 C ANISOU 1207 CG LEU A 737 2936 3535 3672 370 198 -130 C ATOM 1208 CD1 LEU A 737 32.019 13.840 27.274 1.00 28.93 C ANISOU 1208 CD1 LEU A 737 2986 4183 3823 222 315 -55 C ATOM 1209 CD2 LEU A 737 33.919 12.229 27.031 1.00 27.76 C ANISOU 1209 CD2 LEU A 737 3180 3592 3774 218 557 82 C ATOM 0 H LEU A 737 33.761 14.189 30.820 1.00 30.30 H new ATOM 0 HA LEU A 737 35.490 12.970 29.277 1.00 28.82 H new ATOM 0 HB2 LEU A 737 33.696 15.063 28.721 1.00 27.72 H new ATOM 0 HB3 LEU A 737 34.702 14.607 27.620 1.00 27.72 H new ATOM 0 HG LEU A 737 32.926 12.733 28.741 1.00 26.69 H new ATOM 0 HD11 LEU A 737 31.406 13.140 26.999 1.00 28.93 H new ATOM 0 HD12 LEU A 737 31.570 14.437 27.893 1.00 28.93 H new ATOM 0 HD13 LEU A 737 32.308 14.341 26.495 1.00 28.93 H new ATOM 0 HD21 LEU A 737 33.288 11.544 26.760 1.00 27.76 H new ATOM 0 HD22 LEU A 737 34.246 12.695 26.246 1.00 27.76 H new ATOM 0 HD23 LEU A 737 34.664 11.816 27.495 1.00 27.76 H new ATOM 1221 N LYS A 738 36.337 15.896 30.206 1.00 32.24 N ANISOU 1221 N LYS A 738 3239 4491 4521 -109 -574 -353 N ATOM 1222 CA LYS A 738 37.486 16.786 30.245 1.00 36.30 C ANISOU 1222 CA LYS A 738 3764 5038 4989 -313 54 -548 C ATOM 1223 C LYS A 738 38.685 16.096 30.865 1.00 37.74 C ANISOU 1223 C LYS A 738 3867 5396 5079 -179 62 -841 C ATOM 1224 O LYS A 738 39.818 16.298 30.423 1.00 40.28 O ANISOU 1224 O LYS A 738 4208 5777 5321 -200 653 -1039 O ATOM 1225 CB LYS A 738 37.133 18.053 31.006 1.00 37.59 C ANISOU 1225 CB LYS A 738 4009 5111 5161 -402 533 -776 C ATOM 1226 CG LYS A 738 36.144 18.883 30.241 1.00 42.98 C ANISOU 1226 CG LYS A 738 4899 5591 5841 -153 1009 -940 C ATOM 1227 CD LYS A 738 35.927 20.199 30.936 1.00 47.84 C ANISOU 1227 CD LYS A 738 5834 6057 6285 321 1199 -573 C ATOM 1228 CE LYS A 738 34.600 20.835 30.549 1.00 50.92 C ANISOU 1228 CE LYS A 738 6353 6491 6503 397 1274 -398 C ATOM 1229 NZ LYS A 738 34.473 21.054 29.084 1.00 53.68 N ANISOU 1229 NZ LYS A 738 6863 6761 6772 324 1323 -240 N ATOM 0 H LYS A 738 35.658 16.144 30.672 1.00 32.24 H new ATOM 0 HA LYS A 738 37.724 17.026 29.336 1.00 36.30 H new ATOM 0 HB2 LYS A 738 36.764 17.821 31.873 1.00 37.59 H new ATOM 0 HB3 LYS A 738 37.937 18.571 31.169 1.00 37.59 H new ATOM 0 HG2 LYS A 738 36.467 19.035 29.339 1.00 42.98 H new ATOM 0 HG3 LYS A 738 35.302 18.407 30.164 1.00 42.98 H new ATOM 0 HD2 LYS A 738 35.953 20.065 31.896 1.00 47.84 H new ATOM 0 HD3 LYS A 738 36.652 20.804 30.715 1.00 47.84 H new ATOM 0 HE2 LYS A 738 33.874 20.268 30.851 1.00 50.92 H new ATOM 0 HE3 LYS A 738 34.507 21.684 31.008 1.00 50.92 H new ATOM 0 HZ1 LYS A 738 33.747 21.541 28.918 1.00 53.68 H new ATOM 0 HZ2 LYS A 738 35.193 21.483 28.784 1.00 53.68 H new ATOM 0 HZ3 LYS A 738 34.403 20.269 28.671 1.00 53.68 H new ATOM 1243 N THR A 739 38.466 15.293 31.901 1.00 36.78 N ANISOU 1243 N THR A 739 3677 5394 4905 -304 -309 -922 N ATOM 1244 CA THR A 739 39.568 14.591 32.552 1.00 39.71 C ANISOU 1244 CA THR A 739 4020 5899 5170 37 -81 -596 C ATOM 1245 C THR A 739 39.786 13.222 31.961 1.00 39.39 C ANISOU 1245 C THR A 739 3829 5857 5281 63 -253 -521 C ATOM 1246 O THR A 739 40.578 12.448 32.496 1.00 41.91 O ANISOU 1246 O THR A 739 4455 6290 5179 -46 -580 -247 O ATOM 1247 CB THR A 739 39.314 14.451 34.046 1.00 42.11 C ANISOU 1247 CB THR A 739 4634 6274 5091 137 -100 -114 C ATOM 1248 OG1 THR A 739 38.105 13.708 34.239 1.00 42.52 O ANISOU 1248 OG1 THR A 739 4659 6520 4977 166 -126 298 O ATOM 1249 CG2 THR A 739 39.188 15.829 34.696 1.00 43.49 C ANISOU 1249 CG2 THR A 739 4934 6546 5045 10 162 -405 C ATOM 0 H THR A 739 37.691 15.141 32.241 1.00 36.78 H new ATOM 0 HA THR A 739 40.365 15.124 32.405 1.00 39.71 H new ATOM 0 HB THR A 739 40.058 13.986 34.459 1.00 42.11 H new ATOM 0 HG1 THR A 739 37.956 13.624 35.061 1.00 42.52 H new ATOM 0 HG21 THR A 739 39.026 15.725 35.647 1.00 43.49 H new ATOM 0 HG22 THR A 739 40.009 16.327 34.561 1.00 43.49 H new ATOM 0 HG23 THR A 739 38.448 16.310 34.294 1.00 43.49 H new ATOM 1257 N ALA A 740 39.116 12.923 30.858 1.00 39.41 N ANISOU 1257 N ALA A 740 3696 5571 5706 -392 253 -957 N ATOM 1258 CA ALA A 740 39.261 11.635 30.213 1.00 39.20 C ANISOU 1258 CA ALA A 740 3584 5431 5879 -195 637 -925 C ATOM 1259 C ALA A 740 40.694 11.455 29.732 1.00 38.32 C ANISOU 1259 C ALA A 740 3325 5359 5875 -303 734 -371 C ATOM 1260 O ALA A 740 41.357 12.431 29.369 1.00 39.42 O ANISOU 1260 O ALA A 740 3400 5445 6131 -216 834 262 O ATOM 1261 CB ALA A 740 38.309 11.525 29.027 1.00 38.35 C ANISOU 1261 CB ALA A 740 3656 5232 5684 -375 294 -1803 C ATOM 0 H ALA A 740 38.569 13.459 30.467 1.00 39.41 H new ATOM 0 HA ALA A 740 39.046 10.941 30.856 1.00 39.20 H new ATOM 0 HB1 ALA A 740 38.417 10.658 28.605 1.00 38.35 H new ATOM 0 HB2 ALA A 740 37.395 11.623 29.336 1.00 38.35 H new ATOM 0 HB3 ALA A 740 38.509 12.224 28.385 1.00 38.35 H new ATOM 1267 N PRO A 741 41.190 10.218 29.709 1.00 38.77 N ANISOU 1267 N PRO A 741 3629 5233 5869 -336 1402 -247 N ATOM 1268 CA PRO A 741 42.503 9.978 29.116 1.00 39.53 C ANISOU 1268 CA PRO A 741 3891 5201 5929 218 1043 -131 C ATOM 1269 C PRO A 741 42.491 10.342 27.640 1.00 37.43 C ANISOU 1269 C PRO A 741 3311 5075 5836 253 652 -291 C ATOM 1270 O PRO A 741 41.447 10.412 26.993 1.00 36.57 O ANISOU 1270 O PRO A 741 2981 5178 5734 577 161 -480 O ATOM 1271 CB PRO A 741 42.730 8.471 29.327 1.00 42.00 C ANISOU 1271 CB PRO A 741 4430 5280 6249 289 1667 135 C ATOM 1272 CG PRO A 741 41.761 8.061 30.367 1.00 43.68 C ANISOU 1272 CG PRO A 741 4820 5427 6351 97 1958 121 C ATOM 1273 CD PRO A 741 40.580 8.975 30.220 1.00 41.71 C ANISOU 1273 CD PRO A 741 4347 5347 6155 -68 1813 -139 C ATOM 0 HA PRO A 741 43.208 10.513 29.513 1.00 39.53 H new ATOM 0 HB2 PRO A 741 42.586 7.979 28.504 1.00 42.00 H new ATOM 0 HB3 PRO A 741 43.641 8.292 29.609 1.00 42.00 H new ATOM 0 HG2 PRO A 741 41.499 7.134 30.251 1.00 43.68 H new ATOM 0 HG3 PRO A 741 42.150 8.137 31.252 1.00 43.68 H new ATOM 0 HD2 PRO A 741 39.922 8.617 29.603 1.00 41.71 H new ATOM 0 HD3 PRO A 741 40.128 9.117 31.066 1.00 41.71 H new ATOM 1281 N LEU A 742 43.680 10.622 27.122 1.00 36.40 N ANISOU 1281 N LEU A 742 3173 4920 5736 -50 412 -356 N ATOM 1282 CA LEU A 742 43.859 10.742 25.689 1.00 35.15 C ANISOU 1282 CA LEU A 742 2981 5119 5254 86 -180 -153 C ATOM 1283 C LEU A 742 43.189 9.559 25.014 1.00 36.22 C ANISOU 1283 C LEU A 742 3227 5042 5493 199 -130 -243 C ATOM 1284 O LEU A 742 43.360 8.406 25.434 1.00 37.38 O ANISOU 1284 O LEU A 742 3628 4873 5701 517 219 -2 O ATOM 1285 CB LEU A 742 45.360 10.787 25.369 1.00 37.99 C ANISOU 1285 CB LEU A 742 3419 5866 5151 97 390 194 C ATOM 1286 CG LEU A 742 45.813 11.103 23.946 1.00 39.27 C ANISOU 1286 CG LEU A 742 3655 6622 4645 -82 310 -21 C ATOM 1287 CD1 LEU A 742 45.357 12.485 23.534 1.00 42.24 C ANISOU 1287 CD1 LEU A 742 4697 6670 4680 -126 698 -293 C ATOM 1288 CD2 LEU A 742 47.329 11.004 23.905 1.00 38.47 C ANISOU 1288 CD2 LEU A 742 2895 7100 4620 -689 101 71 C ATOM 0 H LEU A 742 44.394 10.746 27.586 1.00 36.40 H new ATOM 0 HA LEU A 742 43.454 11.559 25.359 1.00 35.15 H new ATOM 0 HB2 LEU A 742 45.763 11.446 25.956 1.00 37.99 H new ATOM 0 HB3 LEU A 742 45.735 9.925 25.609 1.00 37.99 H new ATOM 0 HG LEU A 742 45.420 10.472 23.323 1.00 39.27 H new ATOM 0 HD11 LEU A 742 45.654 12.667 22.629 1.00 42.24 H new ATOM 0 HD12 LEU A 742 44.389 12.531 23.572 1.00 42.24 H new ATOM 0 HD13 LEU A 742 45.736 13.144 24.137 1.00 42.24 H new ATOM 0 HD21 LEU A 742 47.642 11.201 23.008 1.00 38.47 H new ATOM 0 HD22 LEU A 742 47.712 11.641 24.528 1.00 38.47 H new ATOM 0 HD23 LEU A 742 47.602 10.107 24.152 1.00 38.47 H new ATOM 1300 N LEU A 743 42.396 9.845 23.991 1.00 37.14 N ANISOU 1300 N LEU A 743 3174 5251 5685 397 -294 -475 N ATOM 1301 CA LEU A 743 41.661 8.778 23.318 1.00 39.92 C ANISOU 1301 CA LEU A 743 4054 5195 5918 192 374 -477 C ATOM 1302 C LEU A 743 42.602 7.665 22.873 1.00 40.01 C ANISOU 1302 C LEU A 743 4184 5380 5638 -38 585 -655 C ATOM 1303 O LEU A 743 43.493 7.887 22.055 1.00 38.37 O ANISOU 1303 O LEU A 743 3734 5589 5255 -436 294 -574 O ATOM 1304 CB LEU A 743 40.922 9.348 22.112 1.00 40.33 C ANISOU 1304 CB LEU A 743 4132 5231 5961 317 216 -296 C ATOM 1305 CG LEU A 743 39.926 8.444 21.406 1.00 42.19 C ANISOU 1305 CG LEU A 743 4528 5154 6349 38 641 -297 C ATOM 1306 CD1 LEU A 743 38.825 8.076 22.360 1.00 41.99 C ANISOU 1306 CD1 LEU A 743 4363 5140 6452 102 672 -509 C ATOM 1307 CD2 LEU A 743 39.350 9.146 20.192 1.00 43.64 C ANISOU 1307 CD2 LEU A 743 4727 5415 6440 -353 227 -291 C ATOM 0 H LEU A 743 42.269 10.634 23.674 1.00 37.14 H new ATOM 0 HA LEU A 743 41.022 8.402 23.943 1.00 39.92 H new ATOM 0 HB2 LEU A 743 40.450 10.145 22.400 1.00 40.33 H new ATOM 0 HB3 LEU A 743 41.584 9.629 21.461 1.00 40.33 H new ATOM 0 HG LEU A 743 40.379 7.639 21.110 1.00 42.19 H new ATOM 0 HD11 LEU A 743 38.187 7.499 21.912 1.00 41.99 H new ATOM 0 HD12 LEU A 743 39.200 7.611 23.124 1.00 41.99 H new ATOM 0 HD13 LEU A 743 38.375 8.881 22.661 1.00 41.99 H new ATOM 0 HD21 LEU A 743 38.716 8.560 19.750 1.00 43.64 H new ATOM 0 HD22 LEU A 743 38.899 9.958 20.471 1.00 43.64 H new ATOM 0 HD23 LEU A 743 40.066 9.370 19.577 1.00 43.64 H new ATOM 1319 N GLY A 744 42.407 6.465 23.420 1.00 42.40 N ANISOU 1319 N GLY A 744 4777 5456 5875 65 872 -796 N ATOM 1320 CA GLY A 744 43.187 5.291 23.014 1.00 42.15 C ANISOU 1320 CA GLY A 744 4647 5624 5744 24 424 -710 C ATOM 1321 C GLY A 744 44.128 4.728 24.071 1.00 42.17 C ANISOU 1321 C GLY A 744 4589 5924 5510 -387 52 -140 C ATOM 1322 O GLY A 744 44.605 5.470 24.935 1.00 43.48 O ANISOU 1322 O GLY A 744 4590 6191 5740 -37 167 326 O ATOM 0 H GLY A 744 41.824 6.307 24.032 1.00 42.40 H new ATOM 0 HA2 GLY A 744 42.572 4.591 22.746 1.00 42.15 H new ATOM 0 HA3 GLY A 744 43.709 5.525 22.231 1.00 42.15 H new TER 1326 GLY A 744 ATOM 1327 N PRO B 660 9.163 -18.404 37.256 1.00 47.28 N ANISOU 1327 N PRO B 660 6642 4452 6871 -841 -549 891 N ATOM 1328 CA PRO B 660 8.926 -17.480 36.145 1.00 47.13 C ANISOU 1328 CA PRO B 660 6525 4543 6839 -1013 -227 447 C ATOM 1329 C PRO B 660 7.685 -17.876 35.394 1.00 45.16 C ANISOU 1329 C PRO B 660 6394 4258 6508 -1441 152 -36 C ATOM 1330 O PRO B 660 7.548 -19.014 34.927 1.00 46.35 O ANISOU 1330 O PRO B 660 6408 4379 6824 -992 191 -30 O ATOM 1331 CB PRO B 660 10.176 -17.627 35.259 1.00 48.24 C ANISOU 1331 CB PRO B 660 6687 4650 6993 -1085 -252 494 C ATOM 1332 CG PRO B 660 11.087 -18.555 35.983 1.00 49.04 C ANISOU 1332 CG PRO B 660 6708 4837 7087 -1138 -377 469 C ATOM 1333 CD PRO B 660 10.211 -19.368 36.904 1.00 49.72 C ANISOU 1333 CD PRO B 660 6949 4860 7084 -890 -262 669 C ATOM 0 HA PRO B 660 8.789 -16.565 36.437 1.00 47.13 H new ATOM 0 HB2 PRO B 660 9.943 -17.980 34.386 1.00 48.24 H new ATOM 0 HB3 PRO B 660 10.601 -16.767 35.113 1.00 48.24 H new ATOM 0 HG2 PRO B 660 11.563 -19.128 35.362 1.00 49.04 H new ATOM 0 HG3 PRO B 660 11.756 -18.063 36.485 1.00 49.04 H new ATOM 0 HD2 PRO B 660 9.850 -20.153 36.463 1.00 49.72 H new ATOM 0 HD3 PRO B 660 10.695 -19.679 37.685 1.00 49.72 H new ATOM 1341 N ILE B 661 6.765 -16.930 35.302 1.00 43.13 N ANISOU 1341 N ILE B 661 6301 4020 6066 -1748 506 -173 N ATOM 1342 CA ILE B 661 5.473 -17.188 34.702 1.00 43.63 C ANISOU 1342 CA ILE B 661 6208 4523 5844 -1699 544 -257 C ATOM 1343 C ILE B 661 5.405 -16.596 33.305 1.00 38.43 C ANISOU 1343 C ILE B 661 5602 3912 5086 -2337 113 -111 C ATOM 1344 O ILE B 661 4.688 -17.130 32.451 1.00 38.92 O ANISOU 1344 O ILE B 661 5668 4313 4806 -2390 -29 -68 O ATOM 1345 CB ILE B 661 4.328 -16.676 35.588 1.00 48.71 C ANISOU 1345 CB ILE B 661 6824 5461 6222 -1180 1131 -185 C ATOM 1346 CG1 ILE B 661 4.367 -15.167 35.722 1.00 50.00 C ANISOU 1346 CG1 ILE B 661 6509 5846 6642 -1273 1096 -331 C ATOM 1347 CG2 ILE B 661 4.405 -17.335 36.961 1.00 50.23 C ANISOU 1347 CG2 ILE B 661 7134 5731 6221 -1078 1164 -94 C ATOM 1348 CD1 ILE B 661 3.071 -14.607 36.259 1.00 52.19 C ANISOU 1348 CD1 ILE B 661 6629 6106 7094 -1110 1216 -152 C ATOM 0 H ILE B 661 6.873 -16.125 35.584 1.00 43.13 H new ATOM 0 HA ILE B 661 5.364 -18.149 34.626 1.00 43.63 H new ATOM 0 HB ILE B 661 3.487 -16.912 35.166 1.00 48.71 H new ATOM 0 HG12 ILE B 661 5.095 -14.915 36.312 1.00 50.00 H new ATOM 0 HG13 ILE B 661 4.554 -14.772 34.856 1.00 50.00 H new ATOM 0 HG21 ILE B 661 3.680 -17.009 37.518 1.00 50.23 H new ATOM 0 HG22 ILE B 661 4.330 -18.297 36.863 1.00 50.23 H new ATOM 0 HG23 ILE B 661 5.254 -17.118 37.377 1.00 50.23 H new ATOM 0 HD11 ILE B 661 3.139 -13.642 36.329 1.00 52.19 H new ATOM 0 HD12 ILE B 661 2.345 -14.837 35.658 1.00 52.19 H new ATOM 0 HD13 ILE B 661 2.895 -14.982 37.136 1.00 52.19 H new ATOM 1360 N LYS B 662 6.151 -15.512 33.052 1.00 36.40 N ANISOU 1360 N LYS B 662 5281 3766 4784 -1667 511 251 N ATOM 1361 CA LYS B 662 6.227 -14.912 31.726 1.00 34.51 C ANISOU 1361 CA LYS B 662 4868 3695 4549 -1323 203 11 C ATOM 1362 C LYS B 662 7.640 -14.427 31.489 1.00 31.23 C ANISOU 1362 C LYS B 662 4101 3517 4248 -1187 -148 161 C ATOM 1363 O LYS B 662 8.341 -14.055 32.427 1.00 30.92 O ANISOU 1363 O LYS B 662 4143 3688 3918 -1194 -212 227 O ATOM 1364 CB LYS B 662 5.295 -13.718 31.563 1.00 36.89 C ANISOU 1364 CB LYS B 662 5141 3986 4888 -1522 656 -117 C ATOM 1365 CG LYS B 662 3.837 -14.053 31.616 1.00 39.37 C ANISOU 1365 CG LYS B 662 5428 4193 5340 -1575 902 -292 C ATOM 1366 CD LYS B 662 3.034 -12.821 31.235 1.00 41.35 C ANISOU 1366 CD LYS B 662 5480 4577 5653 -1482 1029 3 C ATOM 1367 CE LYS B 662 1.608 -13.187 30.877 1.00 44.14 C ANISOU 1367 CE LYS B 662 5757 5020 5995 -1142 1487 241 C ATOM 1368 NZ LYS B 662 0.901 -12.016 30.290 1.00 44.52 N ANISOU 1368 NZ LYS B 662 5611 5133 6171 -346 1494 429 N ATOM 0 H LYS B 662 6.624 -15.110 33.647 1.00 36.40 H new ATOM 0 HA LYS B 662 5.961 -15.594 31.090 1.00 34.51 H new ATOM 0 HB2 LYS B 662 5.492 -13.072 32.259 1.00 36.89 H new ATOM 0 HB3 LYS B 662 5.485 -13.288 30.715 1.00 36.89 H new ATOM 0 HG2 LYS B 662 3.639 -14.783 31.009 1.00 39.37 H new ATOM 0 HG3 LYS B 662 3.593 -14.350 32.507 1.00 39.37 H new ATOM 0 HD2 LYS B 662 3.034 -12.191 31.973 1.00 41.35 H new ATOM 0 HD3 LYS B 662 3.455 -12.377 30.483 1.00 41.35 H new ATOM 0 HE2 LYS B 662 1.606 -13.923 30.245 1.00 44.14 H new ATOM 0 HE3 LYS B 662 1.138 -13.492 31.669 1.00 44.14 H new ATOM 0 HZ1 LYS B 662 0.336 -12.295 29.661 1.00 44.52 H new ATOM 0 HZ2 LYS B 662 0.449 -11.592 30.928 1.00 44.52 H new ATOM 0 HZ3 LYS B 662 1.495 -11.461 29.929 1.00 44.52 H new ATOM 1382 N ARG B 663 8.048 -14.432 30.226 1.00 29.10 N ANISOU 1382 N ARG B 663 3614 3247 4194 -1282 -280 17 N ATOM 1383 CA ARG B 663 9.370 -13.922 29.873 1.00 29.56 C ANISOU 1383 CA ARG B 663 3686 3353 4193 -1135 -463 -326 C ATOM 1384 C ARG B 663 9.308 -13.391 28.447 1.00 28.26 C ANISOU 1384 C ARG B 663 3636 3345 3755 -961 -311 -416 C ATOM 1385 O ARG B 663 8.752 -14.055 27.565 1.00 30.73 O ANISOU 1385 O ARG B 663 4195 3689 3793 -1033 -50 -407 O ATOM 1386 CB ARG B 663 10.431 -15.010 29.988 1.00 32.27 C ANISOU 1386 CB ARG B 663 4240 3828 4192 -999 -379 87 C ATOM 1387 CG ARG B 663 11.829 -14.525 29.681 1.00 33.44 C ANISOU 1387 CG ARG B 663 4346 4177 4184 -536 -612 309 C ATOM 1388 CD ARG B 663 12.829 -15.650 29.660 1.00 39.26 C ANISOU 1388 CD ARG B 663 5006 5093 4817 -590 -388 380 C ATOM 1389 NE ARG B 663 13.016 -16.250 30.969 1.00 45.08 N ANISOU 1389 NE ARG B 663 5811 5661 5655 -681 249 248 N ATOM 1390 CZ ARG B 663 12.617 -17.464 31.328 1.00 47.82 C ANISOU 1390 CZ ARG B 663 6415 5584 6172 -401 502 419 C ATOM 1391 NH1 ARG B 663 11.967 -18.261 30.478 1.00 50.07 N ANISOU 1391 NH1 ARG B 663 6814 5802 6409 -95 418 974 N ATOM 1392 NH2 ARG B 663 12.879 -17.879 32.561 1.00 48.29 N ANISOU 1392 NH2 ARG B 663 6565 5446 6337 -503 868 283 N ATOM 0 H ARG B 663 7.582 -14.722 29.564 1.00 29.10 H new ATOM 0 HA ARG B 663 9.618 -13.213 30.487 1.00 29.56 H new ATOM 0 HB2 ARG B 663 10.413 -15.375 30.886 1.00 32.27 H new ATOM 0 HB3 ARG B 663 10.208 -15.735 29.383 1.00 32.27 H new ATOM 0 HG2 ARG B 663 11.832 -14.075 28.821 1.00 33.44 H new ATOM 0 HG3 ARG B 663 12.095 -13.870 30.345 1.00 33.44 H new ATOM 0 HD2 ARG B 663 12.534 -16.330 29.035 1.00 39.26 H new ATOM 0 HD3 ARG B 663 13.680 -15.317 29.335 1.00 39.26 H new ATOM 0 HE ARG B 663 13.420 -15.778 31.563 1.00 45.08 H new ATOM 0 HH11 ARG B 663 11.799 -17.991 29.679 1.00 50.07 H new ATOM 0 HH12 ARG B 663 11.717 -19.044 30.729 1.00 50.07 H new ATOM 0 HH21 ARG B 663 13.299 -17.365 33.108 1.00 48.29 H new ATOM 0 HH22 ARG B 663 12.629 -18.662 32.813 1.00 48.29 H new ATOM 1406 N ILE B 664 9.876 -12.210 28.212 1.00 26.67 N ANISOU 1406 N ILE B 664 3208 3378 3549 -717 -567 -606 N ATOM 1407 CA ILE B 664 9.884 -11.635 26.875 1.00 27.71 C ANISOU 1407 CA ILE B 664 3263 3534 3731 -393 -335 -467 C ATOM 1408 C ILE B 664 11.196 -10.901 26.628 1.00 27.67 C ANISOU 1408 C ILE B 664 3297 3623 3595 -432 -145 -464 C ATOM 1409 O ILE B 664 11.714 -10.200 27.507 1.00 28.02 O ANISOU 1409 O ILE B 664 3800 3506 3340 -746 98 -126 O ATOM 1410 CB ILE B 664 8.668 -10.707 26.661 1.00 30.15 C ANISOU 1410 CB ILE B 664 3602 3525 4330 153 240 -284 C ATOM 1411 CG1 ILE B 664 8.504 -10.356 25.191 1.00 31.99 C ANISOU 1411 CG1 ILE B 664 3754 3518 4883 173 708 -306 C ATOM 1412 CG2 ILE B 664 8.757 -9.447 27.511 1.00 31.92 C ANISOU 1412 CG2 ILE B 664 3869 3796 4463 -103 283 62 C ATOM 1413 CD1 ILE B 664 7.126 -9.721 24.869 1.00 34.65 C ANISOU 1413 CD1 ILE B 664 4065 4010 5091 1 788 -306 C ATOM 0 H ILE B 664 10.260 -11.729 28.813 1.00 26.67 H new ATOM 0 HA ILE B 664 9.812 -12.354 26.228 1.00 27.71 H new ATOM 0 HB ILE B 664 7.881 -11.195 26.949 1.00 30.15 H new ATOM 0 HG12 ILE B 664 9.207 -9.740 24.930 1.00 31.99 H new ATOM 0 HG13 ILE B 664 8.617 -11.158 24.658 1.00 31.99 H new ATOM 0 HG21 ILE B 664 7.978 -8.892 27.349 1.00 31.92 H new ATOM 0 HG22 ILE B 664 8.791 -9.691 28.449 1.00 31.92 H new ATOM 0 HG23 ILE B 664 9.559 -8.954 27.277 1.00 31.92 H new ATOM 0 HD11 ILE B 664 7.076 -9.518 23.922 1.00 34.65 H new ATOM 0 HD12 ILE B 664 6.420 -10.343 25.103 1.00 34.65 H new ATOM 0 HD13 ILE B 664 7.019 -8.904 25.380 1.00 34.65 H new ATOM 1425 N ASN B 665 11.735 -11.104 25.429 1.00 26.20 N ANISOU 1425 N ASN B 665 2545 3701 3709 -468 -156 -490 N ATOM 1426 CA ASN B 665 12.914 -10.398 24.955 1.00 26.13 C ANISOU 1426 CA ASN B 665 2828 3706 3393 -472 -513 -514 C ATOM 1427 C ASN B 665 12.433 -9.076 24.396 1.00 24.56 C ANISOU 1427 C ASN B 665 2835 3610 2888 -373 -340 -350 C ATOM 1428 O ASN B 665 11.487 -9.046 23.606 1.00 26.49 O ANISOU 1428 O ASN B 665 3225 3657 3182 -188 -17 -415 O ATOM 1429 CB ASN B 665 13.620 -11.172 23.838 1.00 28.91 C ANISOU 1429 CB ASN B 665 3288 3843 3854 -26 -367 -790 C ATOM 1430 CG ASN B 665 14.328 -12.432 24.305 1.00 35.13 C ANISOU 1430 CG ASN B 665 4470 4385 4493 379 -60 -1106 C ATOM 1431 OD1 ASN B 665 14.814 -12.531 25.417 1.00 40.33 O ANISOU 1431 OD1 ASN B 665 5537 4805 4981 916 114 -813 O ATOM 1432 ND2 ASN B 665 14.412 -13.403 23.409 1.00 39.68 N ANISOU 1432 ND2 ASN B 665 4822 4752 5503 90 747 -757 N ATOM 0 H ASN B 665 11.418 -11.666 24.861 1.00 26.20 H new ATOM 0 HA ASN B 665 13.544 -10.287 25.684 1.00 26.13 H new ATOM 0 HB2 ASN B 665 12.967 -11.412 23.162 1.00 28.91 H new ATOM 0 HB3 ASN B 665 14.267 -10.588 23.413 1.00 28.91 H new ATOM 0 HD21 ASN B 665 14.820 -14.134 23.604 1.00 39.68 H new ATOM 0 HD22 ASN B 665 14.058 -13.303 22.632 1.00 39.68 H new ATOM 1439 N VAL B 666 13.072 -7.997 24.811 1.00 26.51 N ANISOU 1439 N VAL B 666 3060 3909 3103 -521 19 -335 N ATOM 1440 CA VAL B 666 12.767 -6.656 24.340 1.00 26.44 C ANISOU 1440 CA VAL B 666 2971 3814 3260 -376 -52 -512 C ATOM 1441 C VAL B 666 14.015 -6.096 23.662 1.00 28.24 C ANISOU 1441 C VAL B 666 3104 4291 3335 -1024 -101 -283 C ATOM 1442 O VAL B 666 14.954 -5.656 24.330 1.00 28.98 O ANISOU 1442 O VAL B 666 3293 4339 3380 -1200 172 205 O ATOM 1443 CB VAL B 666 12.301 -5.750 25.491 1.00 29.01 C ANISOU 1443 CB VAL B 666 3452 3937 3633 -39 612 -681 C ATOM 1444 CG1 VAL B 666 11.899 -4.391 24.929 1.00 31.98 C ANISOU 1444 CG1 VAL B 666 4146 3857 4149 -229 1093 -929 C ATOM 1445 CG2 VAL B 666 11.141 -6.398 26.227 1.00 31.44 C ANISOU 1445 CG2 VAL B 666 4271 3813 3861 -191 907 -611 C ATOM 0 H VAL B 666 13.710 -8.022 25.387 1.00 26.51 H new ATOM 0 HA VAL B 666 12.035 -6.690 23.704 1.00 26.44 H new ATOM 0 HB VAL B 666 13.025 -5.625 26.124 1.00 29.01 H new ATOM 0 HG11 VAL B 666 11.604 -3.816 25.652 1.00 31.98 H new ATOM 0 HG12 VAL B 666 12.660 -3.986 24.485 1.00 31.98 H new ATOM 0 HG13 VAL B 666 11.176 -4.505 24.292 1.00 31.98 H new ATOM 0 HG21 VAL B 666 10.854 -5.820 26.951 1.00 31.44 H new ATOM 0 HG22 VAL B 666 10.404 -6.536 25.612 1.00 31.44 H new ATOM 0 HG23 VAL B 666 11.424 -7.252 26.589 1.00 31.44 H new ATOM 1455 N PRO B 667 14.057 -6.100 22.328 1.00 31.05 N ANISOU 1455 N PRO B 667 3544 4946 3308 -1106 219 -60 N ATOM 1456 CA PRO B 667 15.266 -5.688 21.608 1.00 34.14 C ANISOU 1456 CA PRO B 667 4199 5341 3430 -1112 610 58 C ATOM 1457 C PRO B 667 15.819 -4.366 22.110 1.00 34.52 C ANISOU 1457 C PRO B 667 4373 5295 3449 -1153 611 152 C ATOM 1458 O PRO B 667 15.074 -3.421 22.374 1.00 33.11 O ANISOU 1458 O PRO B 667 4313 4986 3282 -978 243 -183 O ATOM 1459 CB PRO B 667 14.782 -5.576 20.160 1.00 36.22 C ANISOU 1459 CB PRO B 667 4363 5754 3644 -1279 915 -85 C ATOM 1460 CG PRO B 667 13.631 -6.488 20.073 1.00 36.65 C ANISOU 1460 CG PRO B 667 4463 5707 3754 -1364 920 -150 C ATOM 1461 CD PRO B 667 12.961 -6.441 21.399 1.00 34.08 C ANISOU 1461 CD PRO B 667 4111 5435 3404 -1289 375 -396 C ATOM 0 HA PRO B 667 15.998 -6.313 21.725 1.00 34.14 H new ATOM 0 HB2 PRO B 667 14.526 -4.666 19.944 1.00 36.22 H new ATOM 0 HB3 PRO B 667 15.480 -5.830 19.536 1.00 36.22 H new ATOM 0 HG2 PRO B 667 13.024 -6.213 19.368 1.00 36.65 H new ATOM 0 HG3 PRO B 667 13.919 -7.390 19.863 1.00 36.65 H new ATOM 0 HD2 PRO B 667 12.256 -5.775 21.419 1.00 34.08 H new ATOM 0 HD3 PRO B 667 12.554 -7.292 21.624 1.00 34.08 H new ATOM 1469 N GLU B 668 17.147 -4.319 22.241 1.00 36.57 N ANISOU 1469 N GLU B 668 4637 5445 3812 -1276 437 215 N ATOM 1470 CA GLU B 668 17.898 -3.145 22.680 1.00 38.72 C ANISOU 1470 CA GLU B 668 5034 5310 4368 -1148 691 -24 C ATOM 1471 C GLU B 668 17.834 -2.928 24.186 1.00 34.33 C ANISOU 1471 C GLU B 668 4465 4495 4084 -989 325 168 C ATOM 1472 O GLU B 668 18.719 -2.272 24.759 1.00 32.11 O ANISOU 1472 O GLU B 668 4031 3993 4177 -495 272 -60 O ATOM 1473 CB GLU B 668 17.428 -1.863 21.973 1.00 44.05 C ANISOU 1473 CB GLU B 668 5669 5902 5168 -1161 850 -164 C ATOM 1474 CG GLU B 668 17.744 -1.827 20.478 1.00 50.81 C ANISOU 1474 CG GLU B 668 6671 6497 6136 -1126 1250 -321 C ATOM 1475 CD GLU B 668 19.246 -1.774 20.216 1.00 57.44 C ANISOU 1475 CD GLU B 668 8011 6826 6989 -991 1908 -671 C ATOM 1476 OE1 GLU B 668 19.893 -0.828 20.721 1.00 59.42 O ANISOU 1476 OE1 GLU B 668 8412 6879 7284 -1115 2042 -730 O ATOM 1477 OE2 GLU B 668 19.782 -2.683 19.536 1.00 59.83 O1- ANISOU 1477 OE2 GLU B 668 8659 6818 7256 -657 2279 -713 O1- ATOM 0 H GLU B 668 17.651 -4.995 22.070 1.00 36.57 H new ATOM 0 HA GLU B 668 18.818 -3.330 22.436 1.00 38.72 H new ATOM 0 HB2 GLU B 668 16.470 -1.770 22.094 1.00 44.05 H new ATOM 0 HB3 GLU B 668 17.843 -1.098 22.401 1.00 44.05 H new ATOM 0 HG2 GLU B 668 17.369 -2.612 20.049 1.00 50.81 H new ATOM 0 HG3 GLU B 668 17.318 -1.054 20.076 1.00 50.81 H new ATOM 1484 N ILE B 669 16.825 -3.467 24.861 1.00 31.04 N ANISOU 1484 N ILE B 669 4064 4053 3677 -1295 -337 297 N ATOM 1485 CA ILE B 669 16.654 -3.212 26.280 1.00 31.53 C ANISOU 1485 CA ILE B 669 4315 4226 3439 -1202 -75 462 C ATOM 1486 C ILE B 669 17.077 -4.415 27.129 1.00 29.99 C ANISOU 1486 C ILE B 669 3835 4250 3308 -1279 86 204 C ATOM 1487 O ILE B 669 18.038 -4.328 27.891 1.00 30.11 O ANISOU 1487 O ILE B 669 3500 4308 3634 -1053 -37 349 O ATOM 1488 CB ILE B 669 15.222 -2.733 26.591 1.00 35.23 C ANISOU 1488 CB ILE B 669 5143 4807 3434 -575 -189 984 C ATOM 1489 CG1 ILE B 669 15.003 -1.464 25.759 1.00 39.72 C ANISOU 1489 CG1 ILE B 669 5851 5424 3816 -84 -170 985 C ATOM 1490 CG2 ILE B 669 15.087 -2.405 28.073 1.00 36.94 C ANISOU 1490 CG2 ILE B 669 5054 5230 3753 -520 -205 772 C ATOM 1491 CD1 ILE B 669 13.713 -0.747 25.966 1.00 42.19 C ANISOU 1491 CD1 ILE B 669 6377 5722 3933 245 267 1141 C ATOM 0 H ILE B 669 16.230 -3.982 24.514 1.00 31.04 H new ATOM 0 HA ILE B 669 17.250 -2.488 26.527 1.00 31.53 H new ATOM 0 HB ILE B 669 14.569 -3.418 26.378 1.00 35.23 H new ATOM 0 HG12 ILE B 669 15.727 -0.847 25.950 1.00 39.72 H new ATOM 0 HG13 ILE B 669 15.072 -1.701 24.821 1.00 39.72 H new ATOM 0 HG21 ILE B 669 14.183 -2.105 28.257 1.00 36.94 H new ATOM 0 HG22 ILE B 669 15.278 -3.198 28.599 1.00 36.94 H new ATOM 0 HG23 ILE B 669 15.714 -1.703 28.308 1.00 36.94 H new ATOM 0 HD11 ILE B 669 13.682 0.035 25.393 1.00 42.19 H new ATOM 0 HD12 ILE B 669 12.975 -1.338 25.747 1.00 42.19 H new ATOM 0 HD13 ILE B 669 13.641 -0.471 26.893 1.00 42.19 H new ATOM 1502 N GLY B 670 16.433 -5.566 26.950 1.00 27.32 N ANISOU 1502 N GLY B 670 3420 3913 3047 -1119 -2 -74 N ATOM 1503 CA GLY B 670 16.883 -6.737 27.674 1.00 27.20 C ANISOU 1503 CA GLY B 670 3178 3801 3356 -726 87 -372 C ATOM 1504 C GLY B 670 15.812 -7.808 27.711 1.00 27.97 C ANISOU 1504 C GLY B 670 3533 3617 3478 -549 -15 76 C ATOM 1505 O GLY B 670 14.904 -7.831 26.879 1.00 29.31 O ANISOU 1505 O GLY B 670 3915 3740 3481 -864 -283 282 O ATOM 0 H GLY B 670 15.757 -5.684 26.432 1.00 27.32 H new ATOM 0 HA2 GLY B 670 17.683 -7.091 27.255 1.00 27.20 H new ATOM 0 HA3 GLY B 670 17.124 -6.487 28.580 1.00 27.20 H new ATOM 1509 N ILE B 671 15.931 -8.673 28.712 1.00 26.94 N ANISOU 1509 N ILE B 671 3468 3355 3413 -598 -426 14 N ATOM 1510 CA ILE B 671 15.005 -9.785 28.903 1.00 27.11 C ANISOU 1510 CA ILE B 671 3381 3337 3582 -664 -163 -394 C ATOM 1511 C ILE B 671 14.220 -9.503 30.159 1.00 25.92 C ANISOU 1511 C ILE B 671 3286 3003 3560 -191 21 -588 C ATOM 1512 O ILE B 671 14.798 -9.365 31.239 1.00 27.41 O ANISOU 1512 O ILE B 671 3112 3516 3787 -435 90 -666 O ATOM 1513 CB ILE B 671 15.745 -11.120 29.024 1.00 29.74 C ANISOU 1513 CB ILE B 671 3577 3480 4244 -711 -76 -539 C ATOM 1514 CG1 ILE B 671 16.632 -11.324 27.808 1.00 32.57 C ANISOU 1514 CG1 ILE B 671 3914 3577 4885 -343 231 -926 C ATOM 1515 CG2 ILE B 671 14.755 -12.253 29.201 1.00 30.68 C ANISOU 1515 CG2 ILE B 671 4106 3079 4474 -267 330 -583 C ATOM 1516 CD1 ILE B 671 17.621 -12.413 28.008 1.00 35.55 C ANISOU 1516 CD1 ILE B 671 4079 3949 5480 139 730 -653 C ATOM 0 H ILE B 671 16.554 -8.632 29.303 1.00 26.94 H new ATOM 0 HA ILE B 671 14.418 -9.861 28.135 1.00 27.11 H new ATOM 0 HB ILE B 671 16.314 -11.109 29.809 1.00 29.74 H new ATOM 0 HG12 ILE B 671 16.079 -11.529 27.038 1.00 32.57 H new ATOM 0 HG13 ILE B 671 17.100 -10.498 27.609 1.00 32.57 H new ATOM 0 HG21 ILE B 671 15.234 -13.093 29.276 1.00 30.68 H new ATOM 0 HG22 ILE B 671 14.234 -12.105 30.006 1.00 30.68 H new ATOM 0 HG23 ILE B 671 14.162 -12.287 28.434 1.00 30.68 H new ATOM 0 HD11 ILE B 671 18.164 -12.508 27.210 1.00 35.55 H new ATOM 0 HD12 ILE B 671 18.191 -12.198 28.763 1.00 35.55 H new ATOM 0 HD13 ILE B 671 17.155 -13.246 28.182 1.00 35.55 H new ATOM 1528 N ALA B 672 12.906 -9.479 30.036 1.00 24.15 N ANISOU 1528 N ALA B 672 3216 2763 3195 -244 -243 -244 N ATOM 1529 CA ALA B 672 12.024 -9.208 31.156 1.00 24.74 C ANISOU 1529 CA ALA B 672 3077 2953 3372 -469 -19 -188 C ATOM 1530 C ALA B 672 11.341 -10.496 31.569 1.00 24.19 C ANISOU 1530 C ALA B 672 2784 2915 3492 -143 -69 -271 C ATOM 1531 O ALA B 672 10.828 -11.215 30.716 1.00 25.37 O ANISOU 1531 O ALA B 672 3328 2919 3392 -225 -329 -578 O ATOM 1532 CB ALA B 672 10.961 -8.189 30.781 1.00 25.62 C ANISOU 1532 CB ALA B 672 3512 2765 3457 -285 286 282 C ATOM 0 H ALA B 672 12.496 -9.621 29.294 1.00 24.15 H new ATOM 0 HA ALA B 672 12.554 -8.850 31.885 1.00 24.74 H new ATOM 0 HB1 ALA B 672 10.386 -8.025 31.545 1.00 25.62 H new ATOM 0 HB2 ALA B 672 11.387 -7.360 30.514 1.00 25.62 H new ATOM 0 HB3 ALA B 672 10.431 -8.531 30.044 1.00 25.62 H new ATOM 1538 N THR B 673 11.326 -10.766 32.866 1.00 27.08 N ANISOU 1538 N THR B 673 3317 3193 3778 -345 303 -243 N ATOM 1539 CA THR B 673 10.674 -11.944 33.418 1.00 28.73 C ANISOU 1539 CA THR B 673 3599 3352 3967 -768 780 -102 C ATOM 1540 C THR B 673 9.723 -11.538 34.533 1.00 29.81 C ANISOU 1540 C THR B 673 3721 3366 4241 -1372 106 -563 C ATOM 1541 O THR B 673 10.070 -10.734 35.403 1.00 32.63 O ANISOU 1541 O THR B 673 4337 3573 4489 -1285 123 -664 O ATOM 1542 CB THR B 673 11.717 -12.932 33.940 1.00 32.14 C ANISOU 1542 CB THR B 673 4245 3885 4082 -621 1045 661 C ATOM 1543 OG1 THR B 673 12.577 -13.336 32.870 1.00 34.64 O ANISOU 1543 OG1 THR B 673 4880 4004 4277 -368 658 648 O ATOM 1544 CG2 THR B 673 11.059 -14.162 34.490 1.00 34.20 C ANISOU 1544 CG2 THR B 673 4678 4069 4247 -670 830 408 C ATOM 0 H THR B 673 11.698 -10.265 33.458 1.00 27.08 H new ATOM 0 HA THR B 673 10.164 -12.378 32.716 1.00 28.73 H new ATOM 0 HB THR B 673 12.221 -12.490 34.641 1.00 32.14 H new ATOM 0 HG1 THR B 673 13.261 -12.849 32.861 1.00 34.64 H new ATOM 0 HG21 THR B 673 11.737 -14.774 34.815 1.00 34.20 H new ATOM 0 HG22 THR B 673 10.470 -13.915 35.220 1.00 34.20 H new ATOM 0 HG23 THR B 673 10.543 -14.593 33.791 1.00 34.20 H new ATOM 1552 N GLU B 674 8.520 -12.089 34.500 1.00 31.86 N ANISOU 1552 N GLU B 674 3767 3839 4499 -1176 -27 -206 N ATOM 1553 CA GLU B 674 7.577 -11.959 35.590 1.00 35.09 C ANISOU 1553 CA GLU B 674 4443 4258 4632 -1395 77 -135 C ATOM 1554 C GLU B 674 7.651 -13.247 36.394 1.00 37.15 C ANISOU 1554 C GLU B 674 5003 4405 4706 -1417 305 -47 C ATOM 1555 O GLU B 674 7.591 -14.340 35.818 1.00 35.97 O ANISOU 1555 O GLU B 674 4760 4404 4502 -1552 121 -183 O ATOM 1556 CB GLU B 674 6.173 -11.737 35.034 1.00 39.81 C ANISOU 1556 CB GLU B 674 4962 4979 5186 -1421 289 -296 C ATOM 1557 CG GLU B 674 5.122 -11.439 36.054 1.00 44.82 C ANISOU 1557 CG GLU B 674 5540 5820 5668 -1423 347 -356 C ATOM 1558 CD GLU B 674 3.785 -11.191 35.399 1.00 50.39 C ANISOU 1558 CD GLU B 674 6308 6619 6220 -946 707 -85 C ATOM 1559 OE1 GLU B 674 3.745 -11.100 34.147 1.00 51.48 O ANISOU 1559 OE1 GLU B 674 6480 6910 6168 -1018 614 -339 O ATOM 1560 OE2 GLU B 674 2.776 -11.097 36.131 1.00 53.75 O1- ANISOU 1560 OE2 GLU B 674 6971 6896 6555 -601 827 136 O1- ATOM 0 H GLU B 674 8.228 -12.553 33.837 1.00 31.86 H new ATOM 0 HA GLU B 674 7.788 -11.199 36.155 1.00 35.09 H new ATOM 0 HB2 GLU B 674 6.204 -11.004 34.400 1.00 39.81 H new ATOM 0 HB3 GLU B 674 5.908 -12.528 34.540 1.00 39.81 H new ATOM 0 HG2 GLU B 674 5.049 -12.181 36.674 1.00 44.82 H new ATOM 0 HG3 GLU B 674 5.381 -10.661 36.572 1.00 44.82 H new ATOM 1567 N LEU B 675 7.849 -13.128 37.695 1.00 40.21 N ANISOU 1567 N LEU B 675 5794 4490 4994 -1387 316 -44 N ATOM 1568 CA LEU B 675 8.058 -14.301 38.523 1.00 45.49 C ANISOU 1568 CA LEU B 675 6636 5176 5472 -1256 353 -169 C ATOM 1569 C LEU B 675 6.801 -14.599 39.313 1.00 50.04 C ANISOU 1569 C LEU B 675 7326 5622 6065 -1321 554 -124 C ATOM 1570 O LEU B 675 6.020 -13.700 39.636 1.00 50.08 O ANISOU 1570 O LEU B 675 7486 5568 5973 -1641 635 -249 O ATOM 1571 CB LEU B 675 9.250 -14.103 39.456 1.00 45.67 C ANISOU 1571 CB LEU B 675 6403 5360 5588 -1167 5 -96 C ATOM 1572 CG LEU B 675 10.542 -13.905 38.673 1.00 47.85 C ANISOU 1572 CG LEU B 675 6469 5795 5917 -776 -42 -132 C ATOM 1573 CD1 LEU B 675 11.634 -13.375 39.567 1.00 49.19 C ANISOU 1573 CD1 LEU B 675 6495 6084 6109 -472 -30 -247 C ATOM 1574 CD2 LEU B 675 10.979 -15.188 38.024 1.00 47.93 C ANISOU 1574 CD2 LEU B 675 6404 5769 6037 -922 -38 -192 C ATOM 0 H LEU B 675 7.866 -12.379 38.118 1.00 40.21 H new ATOM 0 HA LEU B 675 8.255 -15.058 37.949 1.00 45.49 H new ATOM 0 HB2 LEU B 675 9.093 -13.333 40.025 1.00 45.67 H new ATOM 0 HB3 LEU B 675 9.338 -14.873 40.039 1.00 45.67 H new ATOM 0 HG LEU B 675 10.369 -13.253 37.976 1.00 47.85 H new ATOM 0 HD11 LEU B 675 12.446 -13.256 39.050 1.00 49.19 H new ATOM 0 HD12 LEU B 675 11.361 -12.522 39.941 1.00 49.19 H new ATOM 0 HD13 LEU B 675 11.798 -14.005 40.286 1.00 49.19 H new ATOM 0 HD21 LEU B 675 11.802 -15.038 37.532 1.00 47.93 H new ATOM 0 HD22 LEU B 675 11.129 -15.861 38.706 1.00 47.93 H new ATOM 0 HD23 LEU B 675 10.289 -15.494 37.414 1.00 47.93 H new ATOM 1586 N SER B 676 6.610 -15.891 39.601 1.00 55.75 N ANISOU 1586 N SER B 676 7982 6486 6715 -716 792 216 N ATOM 1587 CA SER B 676 5.379 -16.366 40.221 1.00 58.92 C ANISOU 1587 CA SER B 676 8209 7002 7176 -321 669 623 C ATOM 1588 C SER B 676 5.036 -15.570 41.474 1.00 62.29 C ANISOU 1588 C SER B 676 8408 7690 7569 -143 1101 596 C ATOM 1589 O SER B 676 3.859 -15.307 41.754 1.00 63.83 O ANISOU 1589 O SER B 676 8413 8039 7799 37 1410 636 O ATOM 1590 CB SER B 676 5.526 -17.849 40.557 1.00 58.54 C ANISOU 1590 CB SER B 676 8205 6785 7251 -135 196 993 C ATOM 1591 OG SER B 676 6.814 -18.106 41.107 1.00 58.11 O ANISOU 1591 OG SER B 676 8221 6507 7352 -139 147 1407 O ATOM 0 H SER B 676 7.188 -16.508 39.442 1.00 55.75 H new ATOM 0 HA SER B 676 4.651 -16.241 39.593 1.00 58.92 H new ATOM 0 HB2 SER B 676 4.839 -18.113 41.189 1.00 58.54 H new ATOM 0 HB3 SER B 676 5.397 -18.383 39.757 1.00 58.54 H new ATOM 0 HG SER B 676 7.347 -18.308 40.490 1.00 58.11 H new ATOM 1597 N HIS B 677 6.054 -15.167 42.232 1.00 62.89 N ANISOU 1597 N HIS B 677 8512 7836 7547 -242 1167 551 N ATOM 1598 CA HIS B 677 5.860 -14.636 43.574 1.00 63.59 C ANISOU 1598 CA HIS B 677 8562 7901 7698 -136 1149 511 C ATOM 1599 C HIS B 677 5.489 -13.149 43.595 1.00 62.22 C ANISOU 1599 C HIS B 677 8595 7601 7447 -33 1430 360 C ATOM 1600 O HIS B 677 5.116 -12.639 44.658 1.00 62.67 O ANISOU 1600 O HIS B 677 8591 7764 7455 181 1644 163 O ATOM 1601 CB HIS B 677 7.137 -14.905 44.391 1.00 64.89 C ANISOU 1601 CB HIS B 677 8421 8261 7973 -27 722 616 C ATOM 1602 CG HIS B 677 7.577 -16.347 44.380 1.00 66.25 C ANISOU 1602 CG HIS B 677 8228 8610 8332 161 438 761 C ATOM 1603 ND1 HIS B 677 6.690 -17.403 44.303 1.00 66.66 N ANISOU 1603 ND1 HIS B 677 8227 8705 8396 138 352 730 N ATOM 1604 CD2 HIS B 677 8.813 -16.905 44.439 1.00 66.62 C ANISOU 1604 CD2 HIS B 677 8066 8726 8520 209 340 767 C ATOM 1605 CE1 HIS B 677 7.358 -18.545 44.317 1.00 66.31 C ANISOU 1605 CE1 HIS B 677 8093 8662 8441 240 330 774 C ATOM 1606 NE2 HIS B 677 8.648 -18.271 44.399 1.00 66.07 N ANISOU 1606 NE2 HIS B 677 8035 8628 8441 119 254 677 N ATOM 0 H HIS B 677 6.876 -15.195 41.980 1.00 62.89 H new ATOM 0 HA HIS B 677 5.101 -15.090 43.972 1.00 63.59 H new ATOM 0 HB2 HIS B 677 7.855 -14.354 44.042 1.00 64.89 H new ATOM 0 HB3 HIS B 677 6.987 -14.629 45.309 1.00 64.89 H new ATOM 0 HD2 HIS B 677 9.621 -16.449 44.496 1.00 66.62 H new ATOM 0 HE1 HIS B 677 6.984 -19.395 44.276 1.00 66.31 H new ATOM 0 HE2 HIS B 677 9.282 -18.852 44.423 1.00 66.07 H new ATOM 1614 N GLY B 678 5.551 -12.453 42.459 1.00 59.09 N ANISOU 1614 N GLY B 678 8332 7011 7111 -286 1333 292 N ATOM 1615 CA GLY B 678 5.191 -11.043 42.381 1.00 54.55 C ANISOU 1615 CA GLY B 678 7714 6343 6670 -382 1118 237 C ATOM 1616 C GLY B 678 6.315 -10.117 41.940 1.00 50.41 C ANISOU 1616 C GLY B 678 7222 5594 6339 -631 983 84 C ATOM 1617 O GLY B 678 6.094 -8.903 41.860 1.00 50.35 O ANISOU 1617 O GLY B 678 6969 5406 6754 -885 977 393 O ATOM 0 H GLY B 678 5.805 -12.790 41.710 1.00 59.09 H new ATOM 0 HA2 GLY B 678 4.449 -10.946 41.764 1.00 54.55 H new ATOM 0 HA3 GLY B 678 4.875 -10.755 43.252 1.00 54.55 H new ATOM 1621 N VAL B 679 7.500 -10.608 41.639 1.00 46.24 N ANISOU 1621 N VAL B 679 6691 5123 5753 -882 893 -268 N ATOM 1622 CA VAL B 679 8.613 -9.772 41.212 1.00 43.16 C ANISOU 1622 CA VAL B 679 6450 4775 5174 -595 1164 -526 C ATOM 1623 C VAL B 679 8.618 -9.671 39.690 1.00 40.59 C ANISOU 1623 C VAL B 679 5993 4404 5027 -1129 1520 -907 C ATOM 1624 O VAL B 679 8.315 -10.641 38.980 1.00 41.42 O ANISOU 1624 O VAL B 679 6224 4319 5194 -1145 1811 -1160 O ATOM 1625 CB VAL B 679 9.938 -10.354 41.744 1.00 45.66 C ANISOU 1625 CB VAL B 679 7128 5228 4993 -351 1061 -431 C ATOM 1626 CG1 VAL B 679 11.141 -9.678 41.109 1.00 46.62 C ANISOU 1626 CG1 VAL B 679 7205 5509 4999 -30 733 -299 C ATOM 1627 CG2 VAL B 679 9.990 -10.244 43.286 1.00 47.31 C ANISOU 1627 CG2 VAL B 679 7317 5346 5311 -121 1144 -263 C ATOM 0 H VAL B 679 7.688 -11.446 41.676 1.00 46.24 H new ATOM 0 HA VAL B 679 8.514 -8.878 41.575 1.00 43.16 H new ATOM 0 HB VAL B 679 9.973 -11.292 41.499 1.00 45.66 H new ATOM 0 HG11 VAL B 679 11.956 -10.066 41.464 1.00 46.62 H new ATOM 0 HG12 VAL B 679 11.115 -9.806 40.148 1.00 46.62 H new ATOM 0 HG13 VAL B 679 11.122 -8.729 41.309 1.00 46.62 H new ATOM 0 HG21 VAL B 679 10.827 -10.613 43.609 1.00 47.31 H new ATOM 0 HG22 VAL B 679 9.926 -9.312 43.546 1.00 47.31 H new ATOM 0 HG23 VAL B 679 9.250 -10.738 43.671 1.00 47.31 H new ATOM 1637 N VAL B 680 8.949 -8.487 39.181 1.00 35.82 N ANISOU 1637 N VAL B 680 4801 4169 4637 -1307 1502 -1141 N ATOM 1638 CA VAL B 680 9.320 -8.299 37.781 1.00 31.62 C ANISOU 1638 CA VAL B 680 3807 4243 3966 -1303 497 -1125 C ATOM 1639 C VAL B 680 10.811 -8.016 37.731 1.00 29.87 C ANISOU 1639 C VAL B 680 3729 3917 3705 -1105 624 -684 C ATOM 1640 O VAL B 680 11.308 -7.141 38.450 1.00 29.07 O ANISOU 1640 O VAL B 680 3741 3709 3595 -832 463 -546 O ATOM 1641 CB VAL B 680 8.531 -7.162 37.114 1.00 34.17 C ANISOU 1641 CB VAL B 680 3703 4845 4436 -853 724 -901 C ATOM 1642 CG1 VAL B 680 9.030 -6.903 35.696 1.00 33.56 C ANISOU 1642 CG1 VAL B 680 3652 4833 4266 -805 362 -890 C ATOM 1643 CG2 VAL B 680 7.059 -7.504 37.089 1.00 35.79 C ANISOU 1643 CG2 VAL B 680 3703 5157 4740 -581 393 -722 C ATOM 0 H VAL B 680 8.965 -7.762 39.644 1.00 35.82 H new ATOM 0 HA VAL B 680 9.104 -9.104 37.285 1.00 31.62 H new ATOM 0 HB VAL B 680 8.666 -6.354 37.633 1.00 34.17 H new ATOM 0 HG11 VAL B 680 8.516 -6.182 35.299 1.00 33.56 H new ATOM 0 HG12 VAL B 680 9.967 -6.655 35.723 1.00 33.56 H new ATOM 0 HG13 VAL B 680 8.924 -7.707 35.164 1.00 33.56 H new ATOM 0 HG21 VAL B 680 6.566 -6.783 36.667 1.00 35.79 H new ATOM 0 HG22 VAL B 680 6.925 -8.323 36.587 1.00 35.79 H new ATOM 0 HG23 VAL B 680 6.739 -7.626 37.997 1.00 35.79 H new ATOM 1653 N GLN B 681 11.512 -8.756 36.885 1.00 29.39 N ANISOU 1653 N GLN B 681 3517 3976 3674 -1109 769 -399 N ATOM 1654 CA GLN B 681 12.958 -8.710 36.776 1.00 30.44 C ANISOU 1654 CA GLN B 681 3859 4087 3618 -930 635 -409 C ATOM 1655 C GLN B 681 13.320 -8.396 35.333 1.00 28.34 C ANISOU 1655 C GLN B 681 3621 3839 3306 -1120 434 -328 C ATOM 1656 O GLN B 681 12.758 -8.976 34.401 1.00 29.74 O ANISOU 1656 O GLN B 681 4106 3939 3255 -1331 808 -697 O ATOM 1657 CB GLN B 681 13.570 -10.059 37.207 1.00 34.99 C ANISOU 1657 CB GLN B 681 4534 4623 4136 -516 760 -45 C ATOM 1658 CG GLN B 681 15.074 -10.234 36.971 1.00 39.40 C ANISOU 1658 CG GLN B 681 5306 5074 4589 -152 796 -58 C ATOM 1659 CD GLN B 681 15.519 -11.693 37.104 1.00 43.17 C ANISOU 1659 CD GLN B 681 5861 5689 4854 526 194 602 C ATOM 1660 OE1 GLN B 681 15.645 -12.217 38.208 1.00 45.62 O ANISOU 1660 OE1 GLN B 681 6354 6046 4933 587 -51 870 O ATOM 1661 NE2 GLN B 681 15.742 -12.353 35.972 1.00 42.40 N ANISOU 1661 NE2 GLN B 681 5668 5550 4893 997 -305 631 N ATOM 0 H GLN B 681 11.147 -9.315 36.343 1.00 29.39 H new ATOM 0 HA GLN B 681 13.314 -8.022 37.360 1.00 30.44 H new ATOM 0 HB2 GLN B 681 13.395 -10.184 38.153 1.00 34.99 H new ATOM 0 HB3 GLN B 681 13.104 -10.768 36.736 1.00 34.99 H new ATOM 0 HG2 GLN B 681 15.300 -9.909 36.085 1.00 39.40 H new ATOM 0 HG3 GLN B 681 15.564 -9.690 37.607 1.00 39.40 H new ATOM 0 HE21 GLN B 681 15.644 -11.955 35.216 1.00 42.40 H new ATOM 0 HE22 GLN B 681 15.984 -13.178 35.996 1.00 42.40 H new ATOM 1670 N VAL B 682 14.265 -7.485 35.149 1.00 25.52 N ANISOU 1670 N VAL B 682 2682 3936 3080 -451 188 -190 N ATOM 1671 CA VAL B 682 14.773 -7.158 33.831 1.00 24.81 C ANISOU 1671 CA VAL B 682 2640 3766 3021 -218 -57 175 C ATOM 1672 C VAL B 682 16.270 -7.384 33.846 1.00 23.40 C ANISOU 1672 C VAL B 682 2740 3552 2597 -135 -21 -107 C ATOM 1673 O VAL B 682 16.980 -6.787 34.656 1.00 24.19 O ANISOU 1673 O VAL B 682 2678 3638 2875 -366 -18 -5 O ATOM 1674 CB VAL B 682 14.457 -5.714 33.434 1.00 24.86 C ANISOU 1674 CB VAL B 682 2736 3536 3172 -109 -194 184 C ATOM 1675 CG1 VAL B 682 15.014 -5.440 32.056 1.00 26.65 C ANISOU 1675 CG1 VAL B 682 2947 3597 3582 -153 -20 157 C ATOM 1676 CG2 VAL B 682 12.954 -5.446 33.492 1.00 26.17 C ANISOU 1676 CG2 VAL B 682 3189 3388 3365 199 -118 -89 C ATOM 0 H VAL B 682 14.629 -7.039 35.788 1.00 25.52 H new ATOM 0 HA VAL B 682 14.342 -7.725 33.173 1.00 24.81 H new ATOM 0 HB VAL B 682 14.878 -5.110 34.066 1.00 24.86 H new ATOM 0 HG11 VAL B 682 14.815 -4.525 31.802 1.00 26.65 H new ATOM 0 HG12 VAL B 682 15.975 -5.571 32.063 1.00 26.65 H new ATOM 0 HG13 VAL B 682 14.610 -6.048 31.417 1.00 26.65 H new ATOM 0 HG21 VAL B 682 12.779 -4.527 33.237 1.00 26.17 H new ATOM 0 HG22 VAL B 682 12.495 -6.044 32.881 1.00 26.17 H new ATOM 0 HG23 VAL B 682 12.633 -5.597 34.395 1.00 26.17 H new ATOM 1686 N GLN B 683 16.736 -8.222 32.944 1.00 23.62 N ANISOU 1686 N GLN B 683 2684 3179 3113 76 703 -325 N ATOM 1687 CA GLN B 683 18.151 -8.433 32.709 1.00 25.56 C ANISOU 1687 CA GLN B 683 3130 3291 3292 -18 375 -197 C ATOM 1688 C GLN B 683 18.499 -7.598 31.500 1.00 23.71 C ANISOU 1688 C GLN B 683 2849 3350 2810 -153 237 -216 C ATOM 1689 O GLN B 683 18.159 -7.956 30.374 1.00 25.54 O ANISOU 1689 O GLN B 683 3022 3843 2839 -340 -15 -539 O ATOM 1690 CB GLN B 683 18.449 -9.894 32.444 1.00 28.69 C ANISOU 1690 CB GLN B 683 3528 3309 4063 -59 448 -151 C ATOM 1691 CG GLN B 683 18.170 -10.786 33.603 1.00 33.80 C ANISOU 1691 CG GLN B 683 4062 3656 5126 138 45 -139 C ATOM 1692 CD GLN B 683 18.173 -12.241 33.189 1.00 37.65 C ANISOU 1692 CD GLN B 683 4555 3844 5905 166 -10 -288 C ATOM 1693 OE1 GLN B 683 17.294 -12.710 32.450 1.00 38.60 O ANISOU 1693 OE1 GLN B 683 4735 3972 5958 -12 450 -116 O ATOM 1694 NE2 GLN B 683 19.168 -12.960 33.652 1.00 40.70 N ANISOU 1694 NE2 GLN B 683 4734 4057 6674 554 147 -249 N ATOM 0 H GLN B 683 16.228 -8.697 32.438 1.00 23.62 H new ATOM 0 HA GLN B 683 18.674 -8.179 33.485 1.00 25.56 H new ATOM 0 HB2 GLN B 683 17.922 -10.190 31.685 1.00 28.69 H new ATOM 0 HB3 GLN B 683 19.382 -9.985 32.194 1.00 28.69 H new ATOM 0 HG2 GLN B 683 18.837 -10.642 34.293 1.00 33.80 H new ATOM 0 HG3 GLN B 683 17.310 -10.559 33.989 1.00 33.80 H new ATOM 0 HE21 GLN B 683 19.759 -12.599 34.162 1.00 40.70 H new ATOM 0 HE22 GLN B 683 19.230 -13.792 33.445 1.00 40.70 H new ATOM 1703 N PHE B 684 19.163 -6.475 31.741 1.00 23.40 N ANISOU 1703 N PHE B 684 2333 3247 3310 -289 371 -127 N ATOM 1704 CA PHE B 684 19.493 -5.562 30.664 1.00 24.06 C ANISOU 1704 CA PHE B 684 2784 3250 3106 8 329 -472 C ATOM 1705 C PHE B 684 20.645 -6.132 29.853 1.00 24.90 C ANISOU 1705 C PHE B 684 2654 3627 3182 40 304 -283 C ATOM 1706 O PHE B 684 21.478 -6.879 30.359 1.00 26.03 O ANISOU 1706 O PHE B 684 2948 3648 3294 192 259 -250 O ATOM 1707 CB PHE B 684 19.837 -4.172 31.236 1.00 24.52 C ANISOU 1707 CB PHE B 684 2813 3355 3150 100 -30 -492 C ATOM 1708 CG PHE B 684 18.663 -3.501 31.895 1.00 23.84 C ANISOU 1708 CG PHE B 684 2600 3354 3104 -11 -48 -419 C ATOM 1709 CD1 PHE B 684 17.726 -2.851 31.134 1.00 23.10 C ANISOU 1709 CD1 PHE B 684 2844 3095 2839 16 69 -157 C ATOM 1710 CD2 PHE B 684 18.456 -3.589 33.255 1.00 23.87 C ANISOU 1710 CD2 PHE B 684 2618 3401 3051 96 -27 -774 C ATOM 1711 CE1 PHE B 684 16.625 -2.278 31.720 1.00 24.77 C ANISOU 1711 CE1 PHE B 684 3006 3330 3074 -111 284 -444 C ATOM 1712 CE2 PHE B 684 17.353 -2.999 33.842 1.00 24.75 C ANISOU 1712 CE2 PHE B 684 2792 3491 3122 281 -7 -222 C ATOM 1713 CZ PHE B 684 16.443 -2.358 33.061 1.00 23.14 C ANISOU 1713 CZ PHE B 684 2778 3250 2766 238 34 -413 C ATOM 0 H PHE B 684 19.430 -6.226 32.520 1.00 23.40 H new ATOM 0 HA PHE B 684 18.729 -5.457 30.076 1.00 24.06 H new ATOM 0 HB2 PHE B 684 20.556 -4.262 31.881 1.00 24.52 H new ATOM 0 HB3 PHE B 684 20.167 -3.606 30.521 1.00 24.52 H new ATOM 0 HD1 PHE B 684 17.837 -2.798 30.212 1.00 23.10 H new ATOM 0 HD2 PHE B 684 19.066 -4.051 33.784 1.00 23.87 H new ATOM 0 HE1 PHE B 684 16.000 -1.832 31.194 1.00 24.77 H new ATOM 0 HE2 PHE B 684 17.234 -3.040 34.763 1.00 24.75 H new ATOM 0 HZ PHE B 684 15.691 -1.972 33.449 1.00 23.14 H new ATOM 1723 N TYR B 685 20.698 -5.755 28.591 1.00 29.95 N ANISOU 1723 N TYR B 685 3554 4234 3593 505 840 -321 N ATOM 1724 CA TYR B 685 21.760 -6.256 27.735 1.00 30.32 C ANISOU 1724 CA TYR B 685 3336 4372 3812 709 839 -557 C ATOM 1725 C TYR B 685 23.138 -5.645 28.049 1.00 31.00 C ANISOU 1725 C TYR B 685 3341 4323 4116 592 1227 -248 C ATOM 1726 O TYR B 685 24.119 -6.136 27.493 1.00 32.50 O ANISOU 1726 O TYR B 685 3264 4839 4246 358 888 -426 O ATOM 1727 CB TYR B 685 21.341 -6.046 26.268 1.00 35.36 C ANISOU 1727 CB TYR B 685 3804 5039 4591 613 1165 -612 C ATOM 1728 CG TYR B 685 20.278 -7.056 25.781 1.00 37.11 C ANISOU 1728 CG TYR B 685 3600 5594 4908 94 742 -638 C ATOM 1729 CD1 TYR B 685 20.307 -8.388 26.195 1.00 36.97 C ANISOU 1729 CD1 TYR B 685 3134 5807 5105 -128 494 -947 C ATOM 1730 CD2 TYR B 685 19.249 -6.675 24.923 1.00 37.87 C ANISOU 1730 CD2 TYR B 685 3511 5814 5062 -248 598 -702 C ATOM 1731 CE1 TYR B 685 19.362 -9.317 25.751 1.00 38.99 C ANISOU 1731 CE1 TYR B 685 3677 6006 5130 -255 1194 -1240 C ATOM 1732 CE2 TYR B 685 18.294 -7.606 24.472 1.00 39.19 C ANISOU 1732 CE2 TYR B 685 3853 5993 5044 -307 707 -723 C ATOM 1733 CZ TYR B 685 18.349 -8.916 24.901 1.00 38.91 C ANISOU 1733 CZ TYR B 685 3663 6158 4963 -257 579 -1086 C ATOM 1734 OH TYR B 685 17.391 -9.837 24.476 1.00 41.53 O ANISOU 1734 OH TYR B 685 4093 6566 5119 -178 836 -844 O ATOM 0 H TYR B 685 20.141 -5.220 28.213 1.00 29.95 H new ATOM 0 HA TYR B 685 21.876 -7.203 27.907 1.00 30.32 H new ATOM 0 HB2 TYR B 685 20.994 -5.146 26.164 1.00 35.36 H new ATOM 0 HB3 TYR B 685 22.126 -6.115 25.702 1.00 35.36 H new ATOM 0 HD1 TYR B 685 20.973 -8.665 26.782 1.00 36.97 H new ATOM 0 HD2 TYR B 685 19.192 -5.790 24.643 1.00 37.87 H new ATOM 0 HE1 TYR B 685 19.415 -10.203 26.027 1.00 38.99 H new ATOM 0 HE2 TYR B 685 17.625 -7.338 23.884 1.00 39.19 H new ATOM 0 HH TYR B 685 16.841 -9.456 23.968 1.00 41.53 H new ATOM 1744 N ASP B 686 23.263 -4.682 28.974 1.00 29.51 N ANISOU 1744 N ASP B 686 3013 3930 4270 337 827 -181 N ATOM 1745 CA ASP B 686 24.569 -4.264 29.480 1.00 30.74 C ANISOU 1745 CA ASP B 686 3426 3987 4268 382 759 -96 C ATOM 1746 C ASP B 686 25.054 -5.117 30.648 1.00 31.63 C ANISOU 1746 C ASP B 686 3371 4154 4493 234 510 -231 C ATOM 1747 O ASP B 686 26.136 -4.852 31.179 1.00 32.56 O ANISOU 1747 O ASP B 686 3304 4426 4641 -186 490 -60 O ATOM 1748 CB ASP B 686 24.568 -2.791 29.911 1.00 30.99 C ANISOU 1748 CB ASP B 686 3753 3869 4152 52 789 85 C ATOM 1749 CG ASP B 686 23.785 -2.536 31.180 1.00 28.66 C ANISOU 1749 CG ASP B 686 3545 3646 3700 -138 312 -333 C ATOM 1750 OD1 ASP B 686 22.935 -3.363 31.508 1.00 28.12 O ANISOU 1750 OD1 ASP B 686 3457 3461 3768 -182 484 -288 O ATOM 1751 OD2 ASP B 686 23.993 -1.467 31.841 1.00 28.58 O1- ANISOU 1751 OD2 ASP B 686 3455 3680 3726 7 205 -353 O1- ATOM 0 H ASP B 686 22.598 -4.260 29.319 1.00 29.51 H new ATOM 0 HA ASP B 686 25.180 -4.386 28.737 1.00 30.74 H new ATOM 0 HB2 ASP B 686 25.484 -2.498 30.040 1.00 30.99 H new ATOM 0 HB3 ASP B 686 24.196 -2.252 29.196 1.00 30.99 H new ATOM 1756 N GLY B 687 24.305 -6.147 31.037 1.00 29.84 N ANISOU 1756 N GLY B 687 2802 3986 4551 620 338 -118 N ATOM 1757 CA GLY B 687 24.674 -6.989 32.144 1.00 29.07 C ANISOU 1757 CA GLY B 687 2836 4100 4108 215 -146 -113 C ATOM 1758 C GLY B 687 24.078 -6.606 33.476 1.00 28.16 C ANISOU 1758 C GLY B 687 2686 4020 3992 392 -111 455 C ATOM 1759 O GLY B 687 24.160 -7.403 34.423 1.00 31.78 O ANISOU 1759 O GLY B 687 3528 4362 4187 514 25 780 O ATOM 0 H GLY B 687 23.566 -6.369 30.657 1.00 29.84 H new ATOM 0 HA2 GLY B 687 24.411 -7.900 31.939 1.00 29.07 H new ATOM 0 HA3 GLY B 687 25.641 -6.984 32.226 1.00 29.07 H new ATOM 1763 N SER B 688 23.457 -5.435 33.581 1.00 26.75 N ANISOU 1763 N SER B 688 2724 3698 3742 49 158 207 N ATOM 1764 CA SER B 688 22.835 -5.039 34.825 1.00 24.60 C ANISOU 1764 CA SER B 688 2773 3419 3156 40 -222 306 C ATOM 1765 C SER B 688 21.467 -5.706 34.930 1.00 23.94 C ANISOU 1765 C SER B 688 2622 3309 3165 224 -610 429 C ATOM 1766 O SER B 688 20.912 -6.180 33.939 1.00 24.41 O ANISOU 1766 O SER B 688 2684 3246 3345 39 -500 214 O ATOM 1767 CB SER B 688 22.706 -3.519 34.889 1.00 24.60 C ANISOU 1767 CB SER B 688 2864 3503 2980 -262 -102 7 C ATOM 1768 OG SER B 688 21.748 -3.081 33.964 1.00 24.87 O ANISOU 1768 OG SER B 688 3237 3208 3006 -88 80 -77 O ATOM 0 H SER B 688 23.388 -4.862 32.943 1.00 26.75 H new ATOM 0 HA SER B 688 23.384 -5.323 35.572 1.00 24.60 H new ATOM 0 HB2 SER B 688 22.451 -3.246 35.784 1.00 24.60 H new ATOM 0 HB3 SER B 688 23.563 -3.106 34.699 1.00 24.60 H new ATOM 0 HG SER B 688 22.060 -3.144 33.186 1.00 24.87 H new ATOM 1774 N VAL B 689 20.931 -5.738 36.149 1.00 23.91 N ANISOU 1774 N VAL B 689 2566 3346 3172 -21 -343 481 N ATOM 1775 CA VAL B 689 19.643 -6.359 36.437 1.00 24.88 C ANISOU 1775 CA VAL B 689 2654 3436 3364 -360 -199 128 C ATOM 1776 C VAL B 689 18.894 -5.472 37.406 1.00 22.97 C ANISOU 1776 C VAL B 689 2477 3512 2738 -28 -293 46 C ATOM 1777 O VAL B 689 19.490 -4.913 38.333 1.00 25.98 O ANISOU 1777 O VAL B 689 2851 4114 2904 -67 -298 -92 O ATOM 1778 CB VAL B 689 19.812 -7.748 37.062 1.00 25.92 C ANISOU 1778 CB VAL B 689 2629 3245 3973 -249 -48 485 C ATOM 1779 CG1 VAL B 689 18.435 -8.425 37.282 1.00 27.17 C ANISOU 1779 CG1 VAL B 689 2851 3488 3985 -205 -426 916 C ATOM 1780 CG2 VAL B 689 20.737 -8.603 36.214 1.00 29.00 C ANISOU 1780 CG2 VAL B 689 3178 3251 4589 169 155 706 C ATOM 0 H VAL B 689 21.311 -5.395 36.840 1.00 23.91 H new ATOM 0 HA VAL B 689 19.156 -6.463 35.605 1.00 24.88 H new ATOM 0 HB VAL B 689 20.224 -7.649 37.934 1.00 25.92 H new ATOM 0 HG11 VAL B 689 18.564 -9.301 37.678 1.00 27.17 H new ATOM 0 HG12 VAL B 689 17.897 -7.879 37.876 1.00 27.17 H new ATOM 0 HG13 VAL B 689 17.981 -8.519 36.430 1.00 27.17 H new ATOM 0 HG21 VAL B 689 20.834 -9.478 36.622 1.00 29.00 H new ATOM 0 HG22 VAL B 689 20.362 -8.701 35.325 1.00 29.00 H new ATOM 0 HG23 VAL B 689 21.606 -8.177 36.153 1.00 29.00 H new ATOM 1790 N VAL B 690 17.594 -5.325 37.200 1.00 23.42 N ANISOU 1790 N VAL B 690 3139 3505 2254 -260 123 217 N ATOM 1791 CA VAL B 690 16.752 -4.691 38.206 1.00 23.75 C ANISOU 1791 CA VAL B 690 3329 3584 2109 -145 -42 144 C ATOM 1792 C VAL B 690 15.576 -5.614 38.482 1.00 25.04 C ANISOU 1792 C VAL B 690 3484 3676 2353 125 223 129 C ATOM 1793 O VAL B 690 15.076 -6.286 37.580 1.00 25.61 O ANISOU 1793 O VAL B 690 3072 3912 2748 25 283 149 O ATOM 1794 CB VAL B 690 16.283 -3.281 37.772 1.00 26.09 C ANISOU 1794 CB VAL B 690 3621 3961 2329 120 -213 81 C ATOM 1795 CG1 VAL B 690 15.147 -3.369 36.818 1.00 27.55 C ANISOU 1795 CG1 VAL B 690 3353 4248 2867 -111 -226 361 C ATOM 1796 CG2 VAL B 690 15.880 -2.467 38.989 1.00 29.20 C ANISOU 1796 CG2 VAL B 690 4410 4173 2513 -150 64 23 C ATOM 0 H VAL B 690 17.181 -5.582 36.491 1.00 23.42 H new ATOM 0 HA VAL B 690 17.265 -4.556 39.018 1.00 23.75 H new ATOM 0 HB VAL B 690 17.022 -2.840 37.325 1.00 26.09 H new ATOM 0 HG11 VAL B 690 14.871 -2.476 36.560 1.00 27.55 H new ATOM 0 HG12 VAL B 690 15.424 -3.861 36.029 1.00 27.55 H new ATOM 0 HG13 VAL B 690 14.404 -3.828 37.241 1.00 27.55 H new ATOM 0 HG21 VAL B 690 15.588 -1.586 38.707 1.00 29.20 H new ATOM 0 HG22 VAL B 690 15.155 -2.915 39.452 1.00 29.20 H new ATOM 0 HG23 VAL B 690 16.639 -2.380 39.586 1.00 29.20 H new ATOM 1805 N SER B 691 15.166 -5.672 39.740 1.00 25.49 N ANISOU 1805 N SER B 691 3306 3570 2807 -330 411 311 N ATOM 1806 CA SER B 691 14.017 -6.439 40.149 1.00 26.97 C ANISOU 1806 CA SER B 691 3198 3724 3324 -40 -33 90 C ATOM 1807 C SER B 691 13.172 -5.580 41.066 1.00 25.24 C ANISOU 1807 C SER B 691 3339 3400 2851 30 -163 141 C ATOM 1808 O SER B 691 13.687 -4.880 41.937 1.00 28.16 O ANISOU 1808 O SER B 691 3836 3727 3137 76 -5 193 O ATOM 1809 CB SER B 691 14.418 -7.712 40.873 1.00 29.13 C ANISOU 1809 CB SER B 691 3777 3935 3355 33 264 284 C ATOM 1810 OG SER B 691 15.222 -8.588 40.070 1.00 31.20 O ANISOU 1810 OG SER B 691 3933 3994 3928 166 557 495 O ATOM 0 H SER B 691 15.557 -5.259 40.385 1.00 25.49 H new ATOM 0 HA SER B 691 13.518 -6.698 39.358 1.00 26.97 H new ATOM 0 HB2 SER B 691 14.908 -7.479 41.677 1.00 29.13 H new ATOM 0 HB3 SER B 691 13.618 -8.183 41.154 1.00 29.13 H new ATOM 0 HG SER B 691 15.418 -9.274 40.514 1.00 31.20 H new ATOM 1816 N VAL B 692 11.871 -5.616 40.845 1.00 26.20 N ANISOU 1816 N VAL B 692 3096 3489 3371 -103 -37 -5 N ATOM 1817 CA VAL B 692 10.940 -4.754 41.555 1.00 27.92 C ANISOU 1817 CA VAL B 692 3017 3914 3678 -84 -81 -278 C ATOM 1818 C VAL B 692 9.704 -5.573 41.891 1.00 30.21 C ANISOU 1818 C VAL B 692 3535 4038 3905 -18 475 -140 C ATOM 1819 O VAL B 692 9.384 -6.545 41.219 1.00 32.58 O ANISOU 1819 O VAL B 692 3829 4471 4078 -604 737 -640 O ATOM 1820 CB VAL B 692 10.550 -3.541 40.697 1.00 32.93 C ANISOU 1820 CB VAL B 692 3972 4230 4310 175 455 361 C ATOM 1821 CG1 VAL B 692 11.793 -2.751 40.243 1.00 36.35 C ANISOU 1821 CG1 VAL B 692 4544 4332 4935 727 622 539 C ATOM 1822 CG2 VAL B 692 9.792 -3.999 39.494 1.00 34.32 C ANISOU 1822 CG2 VAL B 692 4418 4487 4136 328 157 1051 C ATOM 0 H VAL B 692 11.499 -6.143 40.276 1.00 26.20 H new ATOM 0 HA VAL B 692 11.358 -4.419 42.364 1.00 27.92 H new ATOM 0 HB VAL B 692 9.997 -2.957 41.239 1.00 32.93 H new ATOM 0 HG11 VAL B 692 11.516 -1.993 39.705 1.00 36.35 H new ATOM 0 HG12 VAL B 692 12.278 -2.434 41.021 1.00 36.35 H new ATOM 0 HG13 VAL B 692 12.369 -3.328 39.717 1.00 36.35 H new ATOM 0 HG21 VAL B 692 9.547 -3.231 38.954 1.00 34.32 H new ATOM 0 HG22 VAL B 692 10.347 -4.598 38.970 1.00 34.32 H new ATOM 0 HG23 VAL B 692 8.989 -4.465 39.775 1.00 34.32 H new ATOM 1832 N ILE B 693 8.992 -5.146 42.922 1.00 30.13 N ANISOU 1832 N ILE B 693 3371 4265 3810 708 232 -100 N ATOM 1833 CA ILE B 693 7.713 -5.747 43.279 1.00 33.63 C ANISOU 1833 CA ILE B 693 3968 4790 4018 846 286 -119 C ATOM 1834 C ILE B 693 6.587 -4.775 42.927 1.00 38.69 C ANISOU 1834 C ILE B 693 4785 5369 4547 1381 177 -203 C ATOM 1835 O ILE B 693 6.263 -3.893 43.725 1.00 41.19 O ANISOU 1835 O ILE B 693 5144 5589 4918 2089 39 436 O ATOM 1836 CB ILE B 693 7.707 -6.115 44.767 1.00 34.50 C ANISOU 1836 CB ILE B 693 4492 4917 3699 939 161 262 C ATOM 1837 CG1 ILE B 693 8.861 -7.070 45.089 1.00 34.60 C ANISOU 1837 CG1 ILE B 693 4811 4865 3472 912 344 403 C ATOM 1838 CG2 ILE B 693 6.394 -6.768 45.152 1.00 38.00 C ANISOU 1838 CG2 ILE B 693 4702 5415 4322 1046 827 355 C ATOM 1839 CD1 ILE B 693 9.081 -7.242 46.572 1.00 37.97 C ANISOU 1839 CD1 ILE B 693 5319 5143 3965 1060 773 371 C ATOM 0 H ILE B 693 9.234 -4.500 43.436 1.00 30.13 H new ATOM 0 HA ILE B 693 7.574 -6.565 42.777 1.00 33.63 H new ATOM 0 HB ILE B 693 7.816 -5.297 45.276 1.00 34.50 H new ATOM 0 HG12 ILE B 693 8.680 -7.936 44.691 1.00 34.60 H new ATOM 0 HG13 ILE B 693 9.675 -6.735 44.682 1.00 34.60 H new ATOM 0 HG21 ILE B 693 6.409 -6.993 46.095 1.00 38.00 H new ATOM 0 HG22 ILE B 693 5.664 -6.154 44.978 1.00 38.00 H new ATOM 0 HG23 ILE B 693 6.268 -7.575 44.629 1.00 38.00 H new ATOM 0 HD11 ILE B 693 9.819 -7.853 46.721 1.00 37.97 H new ATOM 0 HD12 ILE B 693 9.288 -6.382 46.970 1.00 37.97 H new ATOM 0 HD13 ILE B 693 8.277 -7.601 46.979 1.00 37.97 H new ATOM 1851 N PRO B 694 5.959 -4.887 41.757 1.00 41.10 N ANISOU 1851 N PRO B 694 4580 5949 5086 1923 -716 -326 N ATOM 1852 CA PRO B 694 4.987 -3.858 41.375 1.00 45.23 C ANISOU 1852 CA PRO B 694 5193 6538 5454 1702 -335 -407 C ATOM 1853 C PRO B 694 3.816 -3.767 42.325 1.00 47.65 C ANISOU 1853 C PRO B 694 5451 6899 5755 1923 375 -343 C ATOM 1854 O PRO B 694 3.309 -2.666 42.582 1.00 50.84 O ANISOU 1854 O PRO B 694 5774 7162 6382 1872 653 -259 O ATOM 1855 CB PRO B 694 4.559 -4.304 39.970 1.00 46.57 C ANISOU 1855 CB PRO B 694 5536 6556 5603 1541 -250 -735 C ATOM 1856 CG PRO B 694 5.728 -5.094 39.458 1.00 45.32 C ANISOU 1856 CG PRO B 694 5473 6377 5370 1595 -753 -657 C ATOM 1857 CD PRO B 694 6.227 -5.828 40.650 1.00 42.91 C ANISOU 1857 CD PRO B 694 4862 6330 5114 1688 -1100 -581 C ATOM 0 HA PRO B 694 5.362 -2.964 41.400 1.00 45.23 H new ATOM 0 HB2 PRO B 694 3.753 -4.843 40.000 1.00 46.57 H new ATOM 0 HB3 PRO B 694 4.369 -3.543 39.400 1.00 46.57 H new ATOM 0 HG2 PRO B 694 5.461 -5.704 38.753 1.00 45.32 H new ATOM 0 HG3 PRO B 694 6.412 -4.514 39.088 1.00 45.32 H new ATOM 0 HD2 PRO B 694 5.762 -6.670 40.774 1.00 42.91 H new ATOM 0 HD3 PRO B 694 7.172 -6.034 40.575 1.00 42.91 H new ATOM 1865 N SER B 695 3.376 -4.898 42.866 1.00 48.74 N ANISOU 1865 N SER B 695 5830 7142 5547 1743 489 -391 N ATOM 1866 CA SER B 695 2.096 -4.946 43.565 1.00 52.15 C ANISOU 1866 CA SER B 695 6556 7688 5571 1214 945 -444 C ATOM 1867 C SER B 695 2.164 -4.359 44.970 1.00 55.33 C ANISOU 1867 C SER B 695 7049 8028 5946 1060 1402 -613 C ATOM 1868 O SER B 695 1.155 -3.856 45.470 1.00 55.58 O ANISOU 1868 O SER B 695 7083 7989 6047 907 1857 -759 O ATOM 1869 CB SER B 695 1.600 -6.392 43.632 1.00 53.60 C ANISOU 1869 CB SER B 695 7037 7771 5559 897 1236 -441 C ATOM 1870 OG SER B 695 2.523 -7.221 44.327 1.00 54.78 O ANISOU 1870 OG SER B 695 7360 7952 5502 568 1230 -438 O ATOM 0 H SER B 695 3.801 -5.645 42.840 1.00 48.74 H new ATOM 0 HA SER B 695 1.475 -4.398 43.059 1.00 52.15 H new ATOM 0 HB2 SER B 695 0.738 -6.421 44.076 1.00 53.60 H new ATOM 0 HB3 SER B 695 1.468 -6.733 42.734 1.00 53.60 H new ATOM 0 HG SER B 695 2.229 -8.008 44.352 1.00 54.78 H new ATOM 1876 N MET B 696 3.317 -4.414 45.627 1.00 59.11 N ANISOU 1876 N MET B 696 7770 8536 6154 871 1694 -810 N ATOM 1877 CA MET B 696 3.433 -3.961 47.007 1.00 62.00 C ANISOU 1877 CA MET B 696 8000 9037 6519 521 1828 -666 C ATOM 1878 C MET B 696 4.040 -2.567 47.046 1.00 63.92 C ANISOU 1878 C MET B 696 8014 9266 7004 304 2202 -917 C ATOM 1879 O MET B 696 5.117 -2.335 46.477 1.00 64.14 O ANISOU 1879 O MET B 696 7781 9402 7188 -128 3115 -1148 O ATOM 1880 CB MET B 696 4.294 -4.913 47.842 1.00 62.43 C ANISOU 1880 CB MET B 696 8024 9446 6252 402 1319 -250 C ATOM 1881 CG MET B 696 3.778 -6.329 47.952 1.00 63.95 C ANISOU 1881 CG MET B 696 7974 10051 6271 297 1150 205 C ATOM 1882 SD MET B 696 5.022 -7.445 48.660 1.00 66.01 S ANISOU 1882 SD MET B 696 7989 10675 6418 94 997 492 S ATOM 1883 CE MET B 696 4.059 -8.953 48.787 1.00 68.31 C ANISOU 1883 CE MET B 696 8252 11176 6526 46 1119 622 C ATOM 0 H MET B 696 4.049 -4.713 45.288 1.00 59.11 H new ATOM 0 HA MET B 696 2.541 -3.945 47.388 1.00 62.00 H new ATOM 0 HB2 MET B 696 5.185 -4.939 47.459 1.00 62.43 H new ATOM 0 HB3 MET B 696 4.380 -4.546 48.736 1.00 62.43 H new ATOM 0 HG2 MET B 696 2.981 -6.341 48.504 1.00 63.95 H new ATOM 0 HG3 MET B 696 3.519 -6.648 47.073 1.00 63.95 H new ATOM 0 HE1 MET B 696 4.610 -9.658 49.161 1.00 68.31 H new ATOM 0 HE2 MET B 696 3.294 -8.801 49.364 1.00 68.31 H new ATOM 0 HE3 MET B 696 3.752 -9.216 47.905 1.00 68.31 H new ATOM 1893 N GLN B 697 3.342 -1.643 47.709 1.00 65.24 N ANISOU 1893 N GLN B 697 8142 9347 7298 556 1672 -600 N ATOM 1894 CA GLN B 697 3.992 -0.478 48.297 1.00 67.34 C ANISOU 1894 CA GLN B 697 8607 9377 7601 964 1272 -105 C ATOM 1895 C GLN B 697 5.087 -1.034 49.206 1.00 67.47 C ANISOU 1895 C GLN B 697 8720 9255 7660 1110 877 276 C ATOM 1896 O GLN B 697 5.103 -2.244 49.466 1.00 69.03 O ANISOU 1896 O GLN B 697 9048 9389 7793 1269 847 570 O ATOM 1897 CB GLN B 697 2.990 0.386 49.076 1.00 69.63 C ANISOU 1897 CB GLN B 697 9058 9461 7936 975 1247 52 C ATOM 1898 CG GLN B 697 2.062 1.223 48.207 1.00 71.95 C ANISOU 1898 CG GLN B 697 9503 9582 8251 616 1495 -3 C ATOM 1899 CD GLN B 697 2.509 2.679 48.099 1.00 72.57 C ANISOU 1899 CD GLN B 697 9555 9597 8422 241 1404 -67 C ATOM 1900 OE1 GLN B 697 3.554 3.063 48.637 1.00 73.26 O ANISOU 1900 OE1 GLN B 697 9653 9639 8543 73 1330 -103 O ATOM 1901 NE2 GLN B 697 1.712 3.497 47.403 1.00 71.94 N ANISOU 1901 NE2 GLN B 697 9379 9598 8356 250 1204 -62 N ATOM 0 H GLN B 697 2.491 -1.675 47.828 1.00 65.24 H new ATOM 0 HA GLN B 697 4.363 0.106 47.617 1.00 67.34 H new ATOM 0 HB2 GLN B 697 2.452 -0.192 49.639 1.00 69.63 H new ATOM 0 HB3 GLN B 697 3.482 0.978 49.666 1.00 69.63 H new ATOM 0 HG2 GLN B 697 2.019 0.835 47.319 1.00 71.95 H new ATOM 0 HG3 GLN B 697 1.165 1.191 48.574 1.00 71.95 H new ATOM 0 HE21 GLN B 697 0.993 3.193 47.043 1.00 71.94 H new ATOM 0 HE22 GLN B 697 1.919 4.327 47.316 1.00 71.94 H new ATOM 1910 N GLY B 698 6.016 -0.211 49.684 1.00 65.72 N ANISOU 1910 N GLY B 698 8387 8974 7611 1055 586 328 N ATOM 1911 CA GLY B 698 7.044 -0.735 50.573 1.00 63.38 C ANISOU 1911 CA GLY B 698 8183 8561 7338 880 578 434 C ATOM 1912 C GLY B 698 7.829 -1.912 50.014 1.00 60.74 C ANISOU 1912 C GLY B 698 7957 8055 7065 832 670 564 C ATOM 1913 O GLY B 698 8.630 -2.525 50.730 1.00 60.68 O ANISOU 1913 O GLY B 698 7923 8103 7029 608 720 474 O ATOM 0 H GLY B 698 6.069 0.630 49.512 1.00 65.72 H new ATOM 0 HA2 GLY B 698 7.664 -0.021 50.787 1.00 63.38 H new ATOM 0 HA3 GLY B 698 6.627 -1.007 51.405 1.00 63.38 H new ATOM 1917 N GLY B 699 7.629 -2.225 48.730 1.00 59.00 N ANISOU 1917 N GLY B 699 7862 7613 6941 827 846 655 N ATOM 1918 CA GLY B 699 8.139 -3.473 48.181 1.00 57.42 C ANISOU 1918 CA GLY B 699 7687 7300 6832 685 992 852 C ATOM 1919 C GLY B 699 9.634 -3.488 47.943 1.00 56.96 C ANISOU 1919 C GLY B 699 7821 6977 6844 819 1310 893 C ATOM 1920 O GLY B 699 10.269 -4.535 48.058 1.00 59.81 O ANISOU 1920 O GLY B 699 8313 7197 7215 792 1408 785 O ATOM 0 H GLY B 699 7.204 -1.730 48.169 1.00 59.00 H new ATOM 0 HA2 GLY B 699 7.912 -4.196 48.786 1.00 57.42 H new ATOM 0 HA3 GLY B 699 7.687 -3.653 47.342 1.00 57.42 H new ATOM 1924 N GLY B 700 10.219 -2.362 47.572 1.00 51.17 N ANISOU 1924 N GLY B 700 6660 6392 6390 621 1396 957 N ATOM 1925 CA GLY B 700 11.653 -2.303 47.400 1.00 45.68 C ANISOU 1925 CA GLY B 700 5688 6064 5605 1047 1728 1070 C ATOM 1926 C GLY B 700 12.116 -2.781 46.038 1.00 40.80 C ANISOU 1926 C GLY B 700 5164 5603 4734 917 1436 1290 C ATOM 1927 O GLY B 700 11.385 -3.368 45.240 1.00 39.91 O ANISOU 1927 O GLY B 700 4719 5487 4958 1116 1427 1637 O ATOM 0 H GLY B 700 9.804 -1.625 47.416 1.00 51.17 H new ATOM 0 HA2 GLY B 700 11.951 -1.389 47.533 1.00 45.68 H new ATOM 0 HA3 GLY B 700 12.077 -2.842 48.086 1.00 45.68 H new ATOM 1931 N ILE B 701 13.392 -2.536 45.802 1.00 36.17 N ANISOU 1931 N ILE B 701 4707 5249 3788 955 1252 1154 N ATOM 1932 CA ILE B 701 14.030 -2.681 44.506 1.00 33.00 C ANISOU 1932 CA ILE B 701 4408 4701 3428 685 698 1047 C ATOM 1933 C ILE B 701 15.379 -3.311 44.748 1.00 29.29 C ANISOU 1933 C ILE B 701 3857 4295 2979 181 168 540 C ATOM 1934 O ILE B 701 16.088 -2.910 45.669 1.00 30.48 O ANISOU 1934 O ILE B 701 4131 4345 3104 533 207 169 O ATOM 1935 CB ILE B 701 14.227 -1.315 43.834 1.00 33.52 C ANISOU 1935 CB ILE B 701 4729 4561 3446 767 750 1014 C ATOM 1936 CG1 ILE B 701 12.895 -0.661 43.539 1.00 35.42 C ANISOU 1936 CG1 ILE B 701 5172 4814 3471 743 753 1359 C ATOM 1937 CG2 ILE B 701 15.076 -1.428 42.562 1.00 33.43 C ANISOU 1937 CG2 ILE B 701 4478 4662 3560 389 451 732 C ATOM 1938 CD1 ILE B 701 13.039 0.817 43.461 1.00 36.30 C ANISOU 1938 CD1 ILE B 701 5461 4651 3681 416 1113 1075 C ATOM 0 H ILE B 701 13.933 -2.270 46.416 1.00 36.17 H new ATOM 0 HA ILE B 701 13.477 -3.224 43.922 1.00 33.00 H new ATOM 0 HB ILE B 701 14.711 -0.751 44.457 1.00 33.52 H new ATOM 0 HG12 ILE B 701 12.541 -1.000 42.702 1.00 35.42 H new ATOM 0 HG13 ILE B 701 12.256 -0.892 44.231 1.00 35.42 H new ATOM 0 HG21 ILE B 701 15.181 -0.550 42.164 1.00 33.43 H new ATOM 0 HG22 ILE B 701 15.949 -1.787 42.786 1.00 33.43 H new ATOM 0 HG23 ILE B 701 14.636 -2.019 41.931 1.00 33.43 H new ATOM 0 HD11 ILE B 701 12.176 1.217 43.272 1.00 36.30 H new ATOM 0 HD12 ILE B 701 13.373 1.155 44.307 1.00 36.30 H new ATOM 0 HD13 ILE B 701 13.663 1.045 42.754 1.00 36.30 H new ATOM 1950 N THR B 702 15.748 -4.270 43.917 1.00 28.88 N ANISOU 1950 N THR B 702 4032 4044 2897 -168 -19 434 N ATOM 1951 CA THR B 702 17.097 -4.806 43.919 1.00 27.15 C ANISOU 1951 CA THR B 702 3525 3936 2854 -312 -413 422 C ATOM 1952 C THR B 702 17.747 -4.502 42.582 1.00 27.64 C ANISOU 1952 C THR B 702 3743 3959 2798 -67 -93 359 C ATOM 1953 O THR B 702 17.154 -4.732 41.525 1.00 28.64 O ANISOU 1953 O THR B 702 3448 4808 2626 -53 -62 522 O ATOM 1954 CB THR B 702 17.103 -6.301 44.193 1.00 30.06 C ANISOU 1954 CB THR B 702 3749 4041 3631 -377 -114 955 C ATOM 1955 OG1 THR B 702 16.680 -6.492 45.547 1.00 33.03 O ANISOU 1955 OG1 THR B 702 4410 4035 4103 -559 432 1209 O ATOM 1956 CG2 THR B 702 18.524 -6.893 44.031 1.00 32.25 C ANISOU 1956 CG2 THR B 702 4484 4300 3470 -411 102 419 C ATOM 0 H THR B 702 15.225 -4.629 43.336 1.00 28.88 H new ATOM 0 HA THR B 702 17.602 -4.385 44.632 1.00 27.15 H new ATOM 0 HB THR B 702 16.514 -6.746 43.564 1.00 30.06 H new ATOM 0 HG1 THR B 702 16.673 -7.313 45.725 1.00 33.03 H new ATOM 0 HG21 THR B 702 18.500 -7.846 44.211 1.00 32.25 H new ATOM 0 HG22 THR B 702 18.836 -6.743 43.125 1.00 32.25 H new ATOM 0 HG23 THR B 702 19.128 -6.461 44.656 1.00 32.25 H new ATOM 1964 N TYR B 703 18.958 -3.981 42.641 1.00 25.52 N ANISOU 1964 N TYR B 703 3675 3522 2499 465 -124 204 N ATOM 1965 CA TYR B 703 19.702 -3.584 41.469 1.00 26.35 C ANISOU 1965 CA TYR B 703 3626 3602 2783 102 -247 324 C ATOM 1966 C TYR B 703 21.070 -4.228 41.513 1.00 24.83 C ANISOU 1966 C TYR B 703 3493 3461 2482 -87 -656 314 C ATOM 1967 O TYR B 703 21.760 -4.169 42.538 1.00 27.63 O ANISOU 1967 O TYR B 703 3764 3621 3113 -99 -544 478 O ATOM 1968 CB TYR B 703 19.838 -2.076 41.419 1.00 28.39 C ANISOU 1968 CB TYR B 703 3835 3563 3386 165 85 376 C ATOM 1969 CG TYR B 703 20.882 -1.526 40.477 1.00 29.07 C ANISOU 1969 CG TYR B 703 4080 3460 3507 -303 514 150 C ATOM 1970 CD1 TYR B 703 20.780 -1.697 39.104 1.00 29.68 C ANISOU 1970 CD1 TYR B 703 4177 3575 3527 -384 515 341 C ATOM 1971 CD2 TYR B 703 21.962 -0.814 40.965 1.00 31.50 C ANISOU 1971 CD2 TYR B 703 4332 3987 3650 -344 522 158 C ATOM 1972 CE1 TYR B 703 21.739 -1.160 38.239 1.00 30.22 C ANISOU 1972 CE1 TYR B 703 4126 3643 3714 -65 341 204 C ATOM 1973 CE2 TYR B 703 22.908 -0.262 40.117 1.00 31.50 C ANISOU 1973 CE2 TYR B 703 4397 3886 3684 -275 516 483 C ATOM 1974 CZ TYR B 703 22.804 -0.454 38.762 1.00 30.14 C ANISOU 1974 CZ TYR B 703 4105 3732 3615 132 226 641 C ATOM 1975 OH TYR B 703 23.749 0.090 37.930 1.00 33.24 O ANISOU 1975 OH TYR B 703 4474 4215 3939 382 388 967 O ATOM 0 H TYR B 703 19.378 -3.846 43.380 1.00 25.52 H new ATOM 0 HA TYR B 703 19.230 -3.874 40.673 1.00 26.35 H new ATOM 0 HB2 TYR B 703 18.978 -1.701 41.172 1.00 28.39 H new ATOM 0 HB3 TYR B 703 20.039 -1.759 42.314 1.00 28.39 H new ATOM 0 HD1 TYR B 703 20.064 -2.176 38.754 1.00 29.68 H new ATOM 0 HD2 TYR B 703 22.055 -0.703 41.884 1.00 31.50 H new ATOM 0 HE1 TYR B 703 21.660 -1.277 37.320 1.00 30.22 H new ATOM 0 HE2 TYR B 703 23.611 0.237 40.465 1.00 31.50 H new ATOM 0 HH TYR B 703 24.190 0.670 38.348 1.00 33.24 H new ATOM 1985 N THR B 704 21.449 -4.856 40.414 1.00 26.04 N ANISOU 1985 N THR B 704 3613 3684 2597 -280 -563 -46 N ATOM 1986 CA THR B 704 22.763 -5.452 40.269 1.00 26.57 C ANISOU 1986 CA THR B 704 3260 3814 3019 -30 -263 402 C ATOM 1987 C THR B 704 23.484 -4.726 39.154 1.00 28.32 C ANISOU 1987 C THR B 704 3247 4298 3214 -225 -249 148 C ATOM 1988 O THR B 704 22.981 -4.661 38.027 1.00 29.29 O ANISOU 1988 O THR B 704 3217 4806 3106 -295 -125 56 O ATOM 1989 CB THR B 704 22.650 -6.945 39.988 1.00 29.77 C ANISOU 1989 CB THR B 704 3673 3791 3847 516 428 159 C ATOM 1990 OG1 THR B 704 21.948 -7.537 41.070 1.00 28.88 O ANISOU 1990 OG1 THR B 704 3453 3450 4071 142 -22 223 O ATOM 1991 CG2 THR B 704 24.033 -7.565 39.896 1.00 33.21 C ANISOU 1991 CG2 THR B 704 4313 4118 4189 594 573 55 C ATOM 0 H THR B 704 20.945 -4.949 39.723 1.00 26.04 H new ATOM 0 HA THR B 704 23.268 -5.362 41.092 1.00 26.57 H new ATOM 0 HB THR B 704 22.186 -7.091 39.149 1.00 29.77 H new ATOM 0 HG1 THR B 704 21.872 -8.363 40.937 1.00 28.88 H new ATOM 0 HG21 THR B 704 23.951 -8.515 39.717 1.00 33.21 H new ATOM 0 HG22 THR B 704 24.530 -7.143 39.178 1.00 33.21 H new ATOM 0 HG23 THR B 704 24.503 -7.434 40.734 1.00 33.21 H new ATOM 1999 N GLN B 705 24.646 -4.166 39.478 1.00 30.98 N ANISOU 1999 N GLN B 705 3323 4730 3719 -1157 -520 315 N ATOM 2000 CA GLN B 705 25.398 -3.410 38.494 1.00 34.92 C ANISOU 2000 CA GLN B 705 3686 5346 4235 -1098 -107 185 C ATOM 2001 C GLN B 705 26.013 -4.358 37.476 1.00 36.06 C ANISOU 2001 C GLN B 705 3566 5856 4277 -728 211 -130 C ATOM 2002 O GLN B 705 26.108 -5.563 37.715 1.00 33.85 O ANISOU 2002 O GLN B 705 3188 5720 3952 -785 -50 -355 O ATOM 2003 CB GLN B 705 26.517 -2.608 39.147 1.00 37.60 C ANISOU 2003 CB GLN B 705 4052 5402 4832 -1271 160 346 C ATOM 2004 CG GLN B 705 26.088 -1.688 40.247 1.00 42.07 C ANISOU 2004 CG GLN B 705 4989 5413 5584 -1444 578 263 C ATOM 2005 CD GLN B 705 27.275 -1.057 40.937 1.00 45.49 C ANISOU 2005 CD GLN B 705 5318 5750 6214 -1476 1031 123 C ATOM 2006 OE1 GLN B 705 28.333 -0.856 40.330 1.00 45.66 O ANISOU 2006 OE1 GLN B 705 4986 5710 6654 -1614 962 -94 O ATOM 2007 NE2 GLN B 705 27.114 -0.743 42.213 1.00 47.68 N ANISOU 2007 NE2 GLN B 705 5822 6024 6272 -1472 1209 -59 N ATOM 0 H GLN B 705 25.010 -4.213 40.256 1.00 30.98 H new ATOM 0 HA GLN B 705 24.783 -2.798 38.061 1.00 34.92 H new ATOM 0 HB2 GLN B 705 27.174 -3.227 39.501 1.00 37.60 H new ATOM 0 HB3 GLN B 705 26.961 -2.084 38.462 1.00 37.60 H new ATOM 0 HG2 GLN B 705 25.516 -0.993 39.885 1.00 42.07 H new ATOM 0 HG3 GLN B 705 25.560 -2.181 40.895 1.00 42.07 H new ATOM 0 HE21 GLN B 705 26.363 -0.898 42.602 1.00 47.68 H new ATOM 0 HE22 GLN B 705 27.760 -0.384 42.652 1.00 47.68 H new ATOM 2016 N PRO B 706 26.460 -3.839 36.332 1.00 39.84 N ANISOU 2016 N PRO B 706 3886 6350 4901 -448 321 -333 N ATOM 2017 CA PRO B 706 27.112 -4.734 35.374 1.00 40.17 C ANISOU 2017 CA PRO B 706 3418 6699 5146 76 533 -313 C ATOM 2018 C PRO B 706 28.238 -5.542 35.989 1.00 42.57 C ANISOU 2018 C PRO B 706 3959 7034 5183 -23 541 -369 C ATOM 2019 O PRO B 706 28.486 -6.667 35.543 1.00 41.96 O ANISOU 2019 O PRO B 706 3800 6808 5336 317 778 -885 O ATOM 2020 CB PRO B 706 27.601 -3.772 34.289 1.00 40.59 C ANISOU 2020 CB PRO B 706 3604 6567 5253 199 446 -48 C ATOM 2021 CG PRO B 706 26.550 -2.669 34.307 1.00 40.66 C ANISOU 2021 CG PRO B 706 3583 6627 5237 -176 503 -150 C ATOM 2022 CD PRO B 706 26.217 -2.498 35.762 1.00 40.62 C ANISOU 2022 CD PRO B 706 3787 6570 5076 -520 561 -265 C ATOM 0 HA PRO B 706 26.515 -5.419 35.034 1.00 40.17 H new ATOM 0 HB2 PRO B 706 28.486 -3.428 34.487 1.00 40.59 H new ATOM 0 HB3 PRO B 706 27.652 -4.205 33.422 1.00 40.59 H new ATOM 0 HG2 PRO B 706 26.893 -1.847 33.923 1.00 40.66 H new ATOM 0 HG3 PRO B 706 25.767 -2.918 33.791 1.00 40.66 H new ATOM 0 HD2 PRO B 706 26.777 -1.825 36.180 1.00 40.62 H new ATOM 0 HD3 PRO B 706 25.297 -2.218 35.887 1.00 40.62 H new ATOM 2030 N ASN B 707 28.911 -5.031 37.019 1.00 44.07 N ANISOU 2030 N ASN B 707 4076 7392 5278 -326 697 -90 N ATOM 2031 CA ASN B 707 30.060 -5.738 37.569 1.00 45.79 C ANISOU 2031 CA ASN B 707 4110 7620 5668 -306 932 62 C ATOM 2032 C ASN B 707 29.698 -6.745 38.652 1.00 46.54 C ANISOU 2032 C ASN B 707 4400 7409 5872 -133 736 -110 C ATOM 2033 O ASN B 707 30.610 -7.317 39.257 1.00 47.87 O ANISOU 2033 O ASN B 707 4702 7476 6011 181 655 -313 O ATOM 2034 CB ASN B 707 31.087 -4.744 38.129 1.00 44.99 C ANISOU 2034 CB ASN B 707 3817 7951 5326 -683 300 143 C ATOM 2035 CG ASN B 707 30.615 -4.045 39.383 1.00 45.01 C ANISOU 2035 CG ASN B 707 3606 8127 5369 -1116 267 537 C ATOM 2036 OD1 ASN B 707 29.728 -4.515 40.085 1.00 44.61 O ANISOU 2036 OD1 ASN B 707 3418 8313 5220 -876 33 797 O ATOM 2037 ND2 ASN B 707 31.232 -2.917 39.684 1.00 46.42 N ANISOU 2037 ND2 ASN B 707 4037 8029 5572 -1514 740 726 N ATOM 0 H ASN B 707 28.721 -4.288 37.407 1.00 44.07 H new ATOM 0 HA ASN B 707 30.439 -6.237 36.829 1.00 45.79 H new ATOM 0 HB2 ASN B 707 31.914 -5.215 38.319 1.00 44.99 H new ATOM 0 HB3 ASN B 707 31.288 -4.080 37.452 1.00 44.99 H new ATOM 0 HD21 ASN B 707 31.015 -2.485 40.395 1.00 46.42 H new ATOM 0 HD22 ASN B 707 31.851 -2.615 39.169 1.00 46.42 H new ATOM 2044 N GLY B 708 28.406 -6.970 38.921 1.00 45.06 N ANISOU 2044 N GLY B 708 4099 7105 5918 -66 813 -184 N ATOM 2045 CA GLY B 708 27.984 -7.960 39.889 1.00 43.17 C ANISOU 2045 CA GLY B 708 3985 6692 5727 -98 387 156 C ATOM 2046 C GLY B 708 27.633 -7.416 41.259 1.00 40.30 C ANISOU 2046 C GLY B 708 3658 6296 5359 -33 97 571 C ATOM 2047 O GLY B 708 27.040 -8.146 42.069 1.00 41.00 O ANISOU 2047 O GLY B 708 4078 6348 5150 289 49 962 O ATOM 0 H GLY B 708 27.759 -6.548 38.543 1.00 45.06 H new ATOM 0 HA2 GLY B 708 27.212 -8.428 39.535 1.00 43.17 H new ATOM 0 HA3 GLY B 708 28.692 -8.616 39.989 1.00 43.17 H new ATOM 2051 N THR B 709 27.974 -6.166 41.541 1.00 38.39 N ANISOU 2051 N THR B 709 3460 6089 5038 59 116 870 N ATOM 2052 CA THR B 709 27.623 -5.557 42.817 1.00 36.21 C ANISOU 2052 CA THR B 709 3394 5769 4596 46 -200 837 C ATOM 2053 C THR B 709 26.119 -5.330 42.902 1.00 33.19 C ANISOU 2053 C THR B 709 3270 5222 4116 -21 -331 927 C ATOM 2054 O THR B 709 25.516 -4.713 42.019 1.00 31.67 O ANISOU 2054 O THR B 709 3193 4967 3871 -727 -230 823 O ATOM 2055 CB THR B 709 28.364 -4.236 43.001 1.00 37.92 C ANISOU 2055 CB THR B 709 3581 5957 4868 -234 -284 243 C ATOM 2056 OG1 THR B 709 29.767 -4.495 43.148 1.00 39.41 O ANISOU 2056 OG1 THR B 709 3676 5972 5326 -253 -130 286 O ATOM 2057 CG2 THR B 709 27.842 -3.473 44.235 1.00 38.52 C ANISOU 2057 CG2 THR B 709 3867 5821 4948 -589 87 -222 C ATOM 0 H THR B 709 28.410 -5.652 41.007 1.00 38.39 H new ATOM 0 HA THR B 709 27.888 -6.163 43.527 1.00 36.21 H new ATOM 0 HB THR B 709 28.210 -3.684 42.218 1.00 37.92 H new ATOM 0 HG1 THR B 709 30.120 -4.569 42.389 1.00 39.41 H new ATOM 0 HG21 THR B 709 28.328 -2.639 44.330 1.00 38.52 H new ATOM 0 HG22 THR B 709 26.897 -3.285 44.124 1.00 38.52 H new ATOM 0 HG23 THR B 709 27.972 -4.014 45.029 1.00 38.52 H new ATOM 2065 N SER B 710 25.524 -5.810 43.985 1.00 31.86 N ANISOU 2065 N SER B 710 3441 4704 3960 -261 -287 1110 N ATOM 2066 CA SER B 710 24.088 -5.755 44.164 1.00 32.08 C ANISOU 2066 CA SER B 710 3768 4497 3924 -480 -492 1346 C ATOM 2067 C SER B 710 23.724 -4.937 45.400 1.00 32.02 C ANISOU 2067 C SER B 710 4186 4357 3621 -708 -555 1198 C ATOM 2068 O SER B 710 24.421 -4.974 46.427 1.00 35.44 O ANISOU 2068 O SER B 710 4651 4773 4043 -442 -339 884 O ATOM 2069 CB SER B 710 23.526 -7.172 44.263 1.00 33.60 C ANISOU 2069 CB SER B 710 3478 4706 4584 -776 -487 1666 C ATOM 2070 OG SER B 710 22.133 -7.133 44.330 1.00 38.86 O ANISOU 2070 OG SER B 710 4643 5044 5077 -636 -189 1580 O ATOM 0 H SER B 710 25.946 -6.178 44.638 1.00 31.86 H new ATOM 0 HA SER B 710 23.693 -5.315 43.395 1.00 32.08 H new ATOM 0 HB2 SER B 710 23.805 -7.693 43.494 1.00 33.60 H new ATOM 0 HB3 SER B 710 23.882 -7.614 45.049 1.00 33.60 H new ATOM 0 HG SER B 710 21.833 -7.916 44.383 1.00 38.86 H new ATOM 2076 N THR B 711 22.608 -4.220 45.298 1.00 29.94 N ANISOU 2076 N THR B 711 4267 3730 3379 -1048 -677 847 N ATOM 2077 CA THR B 711 22.107 -3.359 46.353 1.00 30.08 C ANISOU 2077 CA THR B 711 4575 3661 3195 -723 -731 540 C ATOM 2078 C THR B 711 20.601 -3.492 46.436 1.00 29.62 C ANISOU 2078 C THR B 711 5061 3351 2845 -604 -180 69 C ATOM 2079 O THR B 711 19.926 -3.580 45.407 1.00 27.28 O ANISOU 2079 O THR B 711 4419 3623 2325 -577 -77 304 O ATOM 2080 CB THR B 711 22.440 -1.895 46.065 1.00 36.54 C ANISOU 2080 CB THR B 711 5501 4251 4129 -556 89 414 C ATOM 2081 OG1 THR B 711 23.853 -1.753 45.875 1.00 38.72 O ANISOU 2081 OG1 THR B 711 5520 5005 4188 -586 -76 89 O ATOM 2082 CG2 THR B 711 21.972 -0.985 47.227 1.00 38.80 C ANISOU 2082 CG2 THR B 711 6218 4097 4429 -253 256 633 C ATOM 0 H THR B 711 22.113 -4.224 44.595 1.00 29.94 H new ATOM 0 HA THR B 711 22.525 -3.627 47.186 1.00 30.08 H new ATOM 0 HB THR B 711 21.974 -1.624 45.259 1.00 36.54 H new ATOM 0 HG1 THR B 711 24.045 -1.905 45.071 1.00 38.72 H new ATOM 0 HG21 THR B 711 22.192 -0.062 47.025 1.00 38.80 H new ATOM 0 HG22 THR B 711 21.012 -1.071 47.339 1.00 38.80 H new ATOM 0 HG23 THR B 711 22.418 -1.251 48.046 1.00 38.80 H new ATOM 2090 N HIS B 712 20.085 -3.462 47.654 1.00 30.06 N ANISOU 2090 N HIS B 712 5536 3085 2799 -179 70 -8 N ATOM 2091 CA HIS B 712 18.657 -3.418 47.905 1.00 30.52 C ANISOU 2091 CA HIS B 712 5761 3310 2527 538 71 119 C ATOM 2092 C HIS B 712 18.237 -2.030 48.381 1.00 32.26 C ANISOU 2092 C HIS B 712 6351 3469 2437 570 207 -350 C ATOM 2093 O HIS B 712 18.874 -1.444 49.262 1.00 35.42 O ANISOU 2093 O HIS B 712 6932 3728 2799 470 34 -615 O ATOM 2094 CB HIS B 712 18.267 -4.448 48.947 1.00 31.15 C ANISOU 2094 CB HIS B 712 5779 3414 2642 656 509 520 C ATOM 2095 CG HIS B 712 16.801 -4.480 49.219 1.00 35.03 C ANISOU 2095 CG HIS B 712 5991 4089 3231 587 916 903 C ATOM 2096 ND1 HIS B 712 15.895 -5.036 48.344 1.00 37.51 N ANISOU 2096 ND1 HIS B 712 5902 4491 3858 506 1144 1402 N ATOM 2097 CD2 HIS B 712 16.081 -3.997 50.253 1.00 37.28 C ANISOU 2097 CD2 HIS B 712 5864 4861 3438 482 1292 1259 C ATOM 2098 CE1 HIS B 712 14.676 -4.904 48.834 1.00 39.56 C ANISOU 2098 CE1 HIS B 712 6150 4824 4058 158 1677 1074 C ATOM 2099 NE2 HIS B 712 14.761 -4.279 49.993 1.00 40.41 N ANISOU 2099 NE2 HIS B 712 6310 5136 3907 -71 1638 966 N ATOM 0 H HIS B 712 20.563 -3.467 48.369 1.00 30.06 H new ATOM 0 HA HIS B 712 18.201 -3.619 47.073 1.00 30.52 H new ATOM 0 HB2 HIS B 712 18.554 -5.325 48.650 1.00 31.15 H new ATOM 0 HB3 HIS B 712 18.740 -4.259 49.773 1.00 31.15 H new ATOM 0 HD1 HIS B 712 16.092 -5.411 47.595 1.00 37.51 H new ATOM 0 HD2 HIS B 712 16.415 -3.556 51.001 1.00 37.28 H new ATOM 0 HE1 HIS B 712 13.892 -5.201 48.431 1.00 39.56 H new ATOM 2107 N PHE B 713 17.145 -1.529 47.825 1.00 33.45 N ANISOU 2107 N PHE B 713 6640 3420 2651 1045 500 -26 N ATOM 2108 CA PHE B 713 16.581 -0.242 48.215 1.00 35.58 C ANISOU 2108 CA PHE B 713 6841 3694 2983 1515 337 155 C ATOM 2109 C PHE B 713 15.185 -0.461 48.762 1.00 41.58 C ANISOU 2109 C PHE B 713 7541 4422 3834 1595 586 157 C ATOM 2110 O PHE B 713 14.298 -0.930 48.039 1.00 42.13 O ANISOU 2110 O PHE B 713 7180 4654 4174 2022 678 39 O ATOM 2111 CB PHE B 713 16.526 0.715 47.029 1.00 34.80 C ANISOU 2111 CB PHE B 713 6700 3780 2743 1432 0 416 C ATOM 2112 CG PHE B 713 17.856 1.024 46.452 1.00 35.43 C ANISOU 2112 CG PHE B 713 6713 3784 2965 766 65 366 C ATOM 2113 CD1 PHE B 713 18.577 2.118 46.890 1.00 35.45 C ANISOU 2113 CD1 PHE B 713 6770 3727 2972 458 282 318 C ATOM 2114 CD2 PHE B 713 18.401 0.213 45.481 1.00 35.83 C ANISOU 2114 CD2 PHE B 713 6697 3887 3028 669 181 622 C ATOM 2115 CE1 PHE B 713 19.815 2.386 46.368 1.00 35.35 C ANISOU 2115 CE1 PHE B 713 6688 3743 2999 -53 472 139 C ATOM 2116 CE2 PHE B 713 19.635 0.482 44.958 1.00 35.24 C ANISOU 2116 CE2 PHE B 713 6467 3706 3216 125 320 502 C ATOM 2117 CZ PHE B 713 20.343 1.570 45.402 1.00 36.57 C ANISOU 2117 CZ PHE B 713 6606 3887 3400 147 565 429 C ATOM 0 H PHE B 713 16.704 -1.929 47.204 1.00 33.45 H new ATOM 0 HA PHE B 713 17.148 0.155 48.895 1.00 35.58 H new ATOM 0 HB2 PHE B 713 15.964 0.330 46.338 1.00 34.80 H new ATOM 0 HB3 PHE B 713 16.104 1.542 47.310 1.00 34.80 H new ATOM 0 HD1 PHE B 713 18.220 2.676 47.543 1.00 35.45 H new ATOM 0 HD2 PHE B 713 17.924 -0.526 45.178 1.00 35.83 H new ATOM 0 HE1 PHE B 713 20.297 3.122 46.669 1.00 35.35 H new ATOM 0 HE2 PHE B 713 19.994 -0.071 44.302 1.00 35.24 H new ATOM 0 HZ PHE B 713 21.183 1.754 45.047 1.00 36.57 H new ATOM 2127 N GLY B 714 14.993 -0.129 50.033 1.00 46.95 N ANISOU 2127 N GLY B 714 8181 4895 4762 1544 894 115 N ATOM 2128 CA GLY B 714 13.654 -0.057 50.570 1.00 50.41 C ANISOU 2128 CA GLY B 714 8482 4999 5671 1639 1124 538 C ATOM 2129 C GLY B 714 12.862 1.037 49.894 1.00 55.08 C ANISOU 2129 C GLY B 714 8779 5495 6653 1634 1518 581 C ATOM 2130 O GLY B 714 13.415 1.946 49.275 1.00 56.17 O ANISOU 2130 O GLY B 714 8865 5298 7179 1702 2029 591 O ATOM 0 H GLY B 714 15.621 0.055 50.591 1.00 46.95 H new ATOM 0 HA2 GLY B 714 13.206 -0.909 50.448 1.00 50.41 H new ATOM 0 HA3 GLY B 714 13.693 0.109 51.525 1.00 50.41 H new ATOM 2134 N LYS B 715 11.539 0.935 50.000 1.00 57.15 N ANISOU 2134 N LYS B 715 8847 5888 6982 1873 1485 666 N ATOM 2135 CA LYS B 715 10.684 1.905 49.334 1.00 59.18 C ANISOU 2135 CA LYS B 715 8775 6426 7287 2132 1355 552 C ATOM 2136 C LYS B 715 10.920 3.311 49.864 1.00 57.08 C ANISOU 2136 C LYS B 715 8474 6153 7060 2589 813 428 C ATOM 2137 O LYS B 715 10.568 4.278 49.188 1.00 56.23 O ANISOU 2137 O LYS B 715 8192 5902 7270 2908 902 325 O ATOM 2138 CB LYS B 715 9.222 1.491 49.497 1.00 60.52 C ANISOU 2138 CB LYS B 715 8755 6813 7428 2156 1491 553 C ATOM 2139 CG LYS B 715 8.202 2.471 48.955 1.00 61.71 C ANISOU 2139 CG LYS B 715 8978 7025 7445 2204 1616 369 C ATOM 2140 CD LYS B 715 8.263 2.691 47.458 1.00 62.06 C ANISOU 2140 CD LYS B 715 9104 7190 7286 2230 1526 97 C ATOM 2141 CE LYS B 715 7.245 3.756 47.038 1.00 62.65 C ANISOU 2141 CE LYS B 715 9341 7194 7271 2108 1557 -77 C ATOM 2142 NZ LYS B 715 7.514 4.361 45.689 1.00 63.17 N ANISOU 2142 NZ LYS B 715 9474 7234 7295 1984 1417 -121 N ATOM 0 H LYS B 715 11.126 0.324 50.443 1.00 57.15 H new ATOM 0 HA LYS B 715 10.905 1.919 48.390 1.00 59.18 H new ATOM 0 HB2 LYS B 715 9.093 0.637 49.056 1.00 60.52 H new ATOM 0 HB3 LYS B 715 9.045 1.352 50.441 1.00 60.52 H new ATOM 0 HG2 LYS B 715 7.315 2.155 49.187 1.00 61.71 H new ATOM 0 HG3 LYS B 715 8.325 3.324 49.400 1.00 61.71 H new ATOM 0 HD2 LYS B 715 9.156 2.969 47.201 1.00 62.06 H new ATOM 0 HD3 LYS B 715 8.080 1.859 46.994 1.00 62.06 H new ATOM 0 HE2 LYS B 715 6.360 3.360 47.034 1.00 62.65 H new ATOM 0 HE3 LYS B 715 7.237 4.462 47.703 1.00 62.65 H new ATOM 0 HZ1 LYS B 715 6.890 4.969 45.506 1.00 63.17 H new ATOM 0 HZ2 LYS B 715 8.314 4.750 45.692 1.00 63.17 H new ATOM 0 HZ3 LYS B 715 7.497 3.723 45.069 1.00 63.17 H new ATOM 2156 N GLY B 716 11.540 3.443 51.037 1.00 57.28 N ANISOU 2156 N GLY B 716 8592 6271 6899 2615 476 416 N ATOM 2157 CA GLY B 716 11.860 4.734 51.608 1.00 56.29 C ANISOU 2157 CA GLY B 716 8670 6326 6391 2514 298 349 C ATOM 2158 C GLY B 716 13.244 5.276 51.311 1.00 56.22 C ANISOU 2158 C GLY B 716 8965 6444 5953 2247 428 190 C ATOM 2159 O GLY B 716 13.533 6.416 51.683 1.00 57.53 O ANISOU 2159 O GLY B 716 9229 6658 5971 2215 399 -214 O ATOM 0 H GLY B 716 11.785 2.776 51.521 1.00 57.28 H new ATOM 0 HA2 GLY B 716 11.207 5.377 51.291 1.00 56.29 H new ATOM 0 HA3 GLY B 716 11.756 4.675 52.571 1.00 56.29 H new ATOM 2163 N ASP B 717 14.109 4.511 50.650 1.00 54.61 N ANISOU 2163 N ASP B 717 8751 6428 5571 2147 634 218 N ATOM 2164 CA ASP B 717 15.466 4.969 50.376 1.00 54.82 C ANISOU 2164 CA ASP B 717 8851 6699 5281 1459 835 28 C ATOM 2165 C ASP B 717 15.483 5.890 49.158 1.00 53.77 C ANISOU 2165 C ASP B 717 8761 6866 4803 873 898 283 C ATOM 2166 O ASP B 717 14.583 5.864 48.317 1.00 53.71 O ANISOU 2166 O ASP B 717 8698 7117 4592 842 1301 527 O ATOM 2167 CB ASP B 717 16.414 3.788 50.123 1.00 55.91 C ANISOU 2167 CB ASP B 717 8859 6947 5437 1534 690 -456 C ATOM 2168 CG ASP B 717 16.704 2.971 51.378 1.00 56.59 C ANISOU 2168 CG ASP B 717 8857 7048 5598 1558 472 -1054 C ATOM 2169 OD1 ASP B 717 16.531 3.503 52.492 1.00 55.90 O ANISOU 2169 OD1 ASP B 717 8850 7052 5339 1409 80 -1610 O ATOM 2170 OD2 ASP B 717 17.114 1.792 51.252 1.00 56.99 O1- ANISOU 2170 OD2 ASP B 717 8806 7058 5790 1856 574 -1056 O1- ATOM 0 H ASP B 717 13.929 3.724 50.352 1.00 54.61 H new ATOM 0 HA ASP B 717 15.771 5.454 51.159 1.00 54.82 H new ATOM 0 HB2 ASP B 717 16.026 3.208 49.449 1.00 55.91 H new ATOM 0 HB3 ASP B 717 17.250 4.123 49.762 1.00 55.91 H new ATOM 2175 N ASP B 718 16.523 6.718 49.080 1.00 53.31 N ANISOU 2175 N ASP B 718 8801 6722 4733 671 880 239 N ATOM 2176 CA ASP B 718 16.785 7.507 47.884 1.00 51.99 C ANISOU 2176 CA ASP B 718 8774 6256 4722 759 592 52 C ATOM 2177 C ASP B 718 17.385 6.616 46.807 1.00 46.87 C ANISOU 2177 C ASP B 718 8483 5286 4039 1023 593 -14 C ATOM 2178 O ASP B 718 18.269 5.799 47.081 1.00 46.24 O ANISOU 2178 O ASP B 718 8783 5223 3562 1100 179 -209 O ATOM 2179 CB ASP B 718 17.753 8.656 48.175 1.00 56.62 C ANISOU 2179 CB ASP B 718 9017 6855 5643 699 672 -197 C ATOM 2180 CG ASP B 718 17.199 9.667 49.166 1.00 60.29 C ANISOU 2180 CG ASP B 718 9119 7328 6460 661 551 -329 C ATOM 2181 OD1 ASP B 718 16.007 10.043 49.043 1.00 61.28 O ANISOU 2181 OD1 ASP B 718 9040 7526 6720 589 464 -408 O ATOM 2182 OD2 ASP B 718 17.968 10.095 50.063 1.00 61.30 O1- ANISOU 2182 OD2 ASP B 718 9184 7489 6617 771 385 -258 O1- ATOM 0 H ASP B 718 17.091 6.836 49.715 1.00 53.31 H new ATOM 0 HA ASP B 718 15.943 7.882 47.582 1.00 51.99 H new ATOM 0 HB2 ASP B 718 18.583 8.293 48.522 1.00 56.62 H new ATOM 0 HB3 ASP B 718 17.967 9.109 47.345 1.00 56.62 H new ATOM 2187 N LEU B 719 16.903 6.781 45.568 1.00 42.52 N ANISOU 2187 N LEU B 719 7897 4413 3846 1170 715 474 N ATOM 2188 CA LEU B 719 17.448 5.975 44.478 1.00 39.69 C ANISOU 2188 CA LEU B 719 7276 4267 3537 710 753 666 C ATOM 2189 C LEU B 719 18.449 6.786 43.678 1.00 37.43 C ANISOU 2189 C LEU B 719 7160 3853 3209 335 294 520 C ATOM 2190 O LEU B 719 18.101 7.861 43.176 1.00 39.26 O ANISOU 2190 O LEU B 719 7489 3895 3535 17 265 197 O ATOM 2191 CB LEU B 719 16.345 5.494 43.550 1.00 39.53 C ANISOU 2191 CB LEU B 719 6944 4290 3785 614 1039 1271 C ATOM 2192 CG LEU B 719 15.213 4.681 44.163 1.00 41.29 C ANISOU 2192 CG LEU B 719 6653 4722 4315 401 1146 1266 C ATOM 2193 CD1 LEU B 719 14.216 4.314 43.089 1.00 42.45 C ANISOU 2193 CD1 LEU B 719 6781 4682 4668 582 1068 1518 C ATOM 2194 CD2 LEU B 719 15.763 3.446 44.849 1.00 40.47 C ANISOU 2194 CD2 LEU B 719 6057 4830 4490 330 957 1515 C ATOM 0 H LEU B 719 16.283 7.334 45.347 1.00 42.52 H new ATOM 0 HA LEU B 719 17.887 5.204 44.871 1.00 39.69 H new ATOM 0 HB2 LEU B 719 15.956 6.271 43.120 1.00 39.53 H new ATOM 0 HB3 LEU B 719 16.754 4.959 42.852 1.00 39.53 H new ATOM 0 HG LEU B 719 14.759 5.213 44.835 1.00 41.29 H new ATOM 0 HD11 LEU B 719 13.495 3.796 43.480 1.00 42.45 H new ATOM 0 HD12 LEU B 719 13.855 5.122 42.693 1.00 42.45 H new ATOM 0 HD13 LEU B 719 14.657 3.788 42.404 1.00 42.45 H new ATOM 0 HD21 LEU B 719 15.033 2.938 45.235 1.00 40.47 H new ATOM 0 HD22 LEU B 719 16.232 2.897 44.201 1.00 40.47 H new ATOM 0 HD23 LEU B 719 16.377 3.712 45.551 1.00 40.47 H new ATOM 2206 N PRO B 720 19.671 6.312 43.491 1.00 36.80 N ANISOU 2206 N PRO B 720 6916 3782 3287 65 335 66 N ATOM 2207 CA PRO B 720 20.591 6.991 42.577 1.00 36.22 C ANISOU 2207 CA PRO B 720 6517 3821 3423 -124 118 -313 C ATOM 2208 C PRO B 720 20.124 6.866 41.134 1.00 32.58 C ANISOU 2208 C PRO B 720 5450 3548 3379 -176 -122 -53 C ATOM 2209 O PRO B 720 19.274 6.046 40.792 1.00 32.90 O ANISOU 2209 O PRO B 720 5249 3688 3563 188 -8 -131 O ATOM 2210 CB PRO B 720 21.916 6.257 42.810 1.00 36.50 C ANISOU 2210 CB PRO B 720 6718 3661 3490 -240 -286 -822 C ATOM 2211 CG PRO B 720 21.515 4.944 43.269 1.00 38.99 C ANISOU 2211 CG PRO B 720 7094 3952 3770 316 299 -464 C ATOM 2212 CD PRO B 720 20.295 5.134 44.106 1.00 38.11 C ANISOU 2212 CD PRO B 720 7137 3904 3440 544 353 -180 C ATOM 0 HA PRO B 720 20.657 7.945 42.737 1.00 36.22 H new ATOM 0 HB2 PRO B 720 22.440 6.203 41.996 1.00 36.50 H new ATOM 0 HB3 PRO B 720 22.463 6.712 43.470 1.00 36.50 H new ATOM 0 HG2 PRO B 720 21.329 4.359 42.518 1.00 38.99 H new ATOM 0 HG3 PRO B 720 22.224 4.528 43.784 1.00 38.99 H new ATOM 0 HD2 PRO B 720 19.712 4.359 44.076 1.00 38.11 H new ATOM 0 HD3 PRO B 720 20.516 5.287 45.038 1.00 38.11 H new ATOM 2220 N PHE B 721 20.690 7.710 40.273 1.00 30.02 N ANISOU 2220 N PHE B 721 4976 3107 3321 -28 -138 61 N ATOM 2221 CA PHE B 721 20.239 7.750 38.883 1.00 27.52 C ANISOU 2221 CA PHE B 721 4364 3083 3010 -136 -31 338 C ATOM 2222 C PHE B 721 20.230 6.396 38.188 1.00 25.72 C ANISOU 2222 C PHE B 721 3962 3020 2791 126 116 89 C ATOM 2223 O PHE B 721 19.239 6.085 37.502 1.00 24.50 O ANISOU 2223 O PHE B 721 3515 3047 2747 -148 192 -180 O ATOM 2224 CB PHE B 721 21.091 8.724 38.056 1.00 28.93 C ANISOU 2224 CB PHE B 721 4482 3177 3333 -159 165 278 C ATOM 2225 CG PHE B 721 20.806 8.624 36.595 1.00 28.04 C ANISOU 2225 CG PHE B 721 4246 3096 3312 -176 -38 232 C ATOM 2226 CD1 PHE B 721 19.686 9.219 36.055 1.00 28.49 C ANISOU 2226 CD1 PHE B 721 4220 3340 3264 -210 -110 422 C ATOM 2227 CD2 PHE B 721 21.628 7.886 35.767 1.00 28.41 C ANISOU 2227 CD2 PHE B 721 3869 3531 3396 -132 216 534 C ATOM 2228 CE1 PHE B 721 19.397 9.100 34.728 1.00 27.91 C ANISOU 2228 CE1 PHE B 721 3859 3443 3303 -300 -152 408 C ATOM 2229 CE2 PHE B 721 21.348 7.773 34.438 1.00 29.56 C ANISOU 2229 CE2 PHE B 721 3822 3831 3578 -31 54 646 C ATOM 2230 CZ PHE B 721 20.215 8.376 33.914 1.00 29.11 C ANISOU 2230 CZ PHE B 721 3689 3859 3511 -313 3 676 C ATOM 0 H PHE B 721 21.324 8.258 40.468 1.00 30.02 H new ATOM 0 HA PHE B 721 19.319 8.053 38.931 1.00 27.52 H new ATOM 0 HB2 PHE B 721 20.923 9.631 38.355 1.00 28.93 H new ATOM 0 HB3 PHE B 721 22.031 8.543 38.213 1.00 28.93 H new ATOM 0 HD1 PHE B 721 19.118 9.709 36.605 1.00 28.49 H new ATOM 0 HD2 PHE B 721 22.378 7.463 36.119 1.00 28.41 H new ATOM 0 HE1 PHE B 721 18.641 9.513 34.378 1.00 27.91 H new ATOM 0 HE2 PHE B 721 21.917 7.291 33.882 1.00 29.56 H new ATOM 0 HZ PHE B 721 20.014 8.287 33.010 1.00 29.11 H new ATOM 2240 N PRO B 722 21.263 5.558 38.288 1.00 26.10 N ANISOU 2240 N PRO B 722 4203 3115 2598 -5 130 -217 N ATOM 2241 CA PRO B 722 21.231 4.316 37.496 1.00 26.31 C ANISOU 2241 CA PRO B 722 4235 2973 2791 -8 50 -55 C ATOM 2242 C PRO B 722 20.094 3.407 37.887 1.00 26.32 C ANISOU 2242 C PRO B 722 4261 2824 2915 -341 203 -143 C ATOM 2243 O PRO B 722 19.564 2.677 37.035 1.00 27.17 O ANISOU 2243 O PRO B 722 3866 3463 2996 -531 73 -160 O ATOM 2244 CB PRO B 722 22.599 3.680 37.779 1.00 27.77 C ANISOU 2244 CB PRO B 722 4033 3265 3253 -303 295 -239 C ATOM 2245 CG PRO B 722 23.452 4.829 38.175 1.00 27.98 C ANISOU 2245 CG PRO B 722 4452 3139 3041 30 313 -272 C ATOM 2246 CD PRO B 722 22.559 5.727 38.955 1.00 28.48 C ANISOU 2246 CD PRO B 722 4789 3209 2822 56 470 -527 C ATOM 0 HA PRO B 722 21.079 4.484 36.553 1.00 26.31 H new ATOM 0 HB2 PRO B 722 22.544 3.018 38.486 1.00 27.77 H new ATOM 0 HB3 PRO B 722 22.951 3.230 36.995 1.00 27.77 H new ATOM 0 HG2 PRO B 722 24.208 4.537 38.708 1.00 27.98 H new ATOM 0 HG3 PRO B 722 23.812 5.283 37.397 1.00 27.98 H new ATOM 0 HD2 PRO B 722 22.519 5.471 39.890 1.00 28.48 H new ATOM 0 HD3 PRO B 722 22.861 6.648 38.926 1.00 28.48 H new ATOM 2254 N VAL B 723 19.688 3.451 39.149 1.00 25.84 N ANISOU 2254 N VAL B 723 4279 2854 2685 -128 166 -262 N ATOM 2255 CA VAL B 723 18.538 2.686 39.616 1.00 28.18 C ANISOU 2255 CA VAL B 723 4567 3157 2983 -164 350 261 C ATOM 2256 C VAL B 723 17.231 3.329 39.176 1.00 27.48 C ANISOU 2256 C VAL B 723 4200 3454 2785 -213 267 97 C ATOM 2257 O VAL B 723 16.357 2.636 38.643 1.00 27.72 O ANISOU 2257 O VAL B 723 4077 3635 2821 -240 501 361 O ATOM 2258 CB VAL B 723 18.601 2.542 41.139 1.00 29.52 C ANISOU 2258 CB VAL B 723 4842 3394 2979 4 279 493 C ATOM 2259 CG1 VAL B 723 17.457 1.691 41.661 1.00 32.44 C ANISOU 2259 CG1 VAL B 723 5088 3794 3445 183 508 518 C ATOM 2260 CG2 VAL B 723 19.913 1.942 41.511 1.00 31.08 C ANISOU 2260 CG2 VAL B 723 4775 3831 3201 207 -77 441 C ATOM 0 H VAL B 723 20.069 3.923 39.758 1.00 25.84 H new ATOM 0 HA VAL B 723 18.568 1.802 39.217 1.00 28.18 H new ATOM 0 HB VAL B 723 18.514 3.419 41.544 1.00 29.52 H new ATOM 0 HG11 VAL B 723 17.522 1.617 42.626 1.00 32.44 H new ATOM 0 HG12 VAL B 723 16.612 2.105 41.425 1.00 32.44 H new ATOM 0 HG13 VAL B 723 17.505 0.807 41.266 1.00 32.44 H new ATOM 0 HG21 VAL B 723 19.964 1.846 42.475 1.00 31.08 H new ATOM 0 HG22 VAL B 723 20.000 1.070 41.095 1.00 31.08 H new ATOM 0 HG23 VAL B 723 20.631 2.519 41.206 1.00 31.08 H new ATOM 2270 N ARG B 724 17.066 4.645 39.425 1.00 27.41 N ANISOU 2270 N ARG B 724 4162 3440 2811 -18 89 -572 N ATOM 2271 CA ARG B 724 15.876 5.374 38.979 1.00 29.84 C ANISOU 2271 CA ARG B 724 4442 3517 3377 -408 361 -226 C ATOM 2272 C ARG B 724 15.606 5.111 37.521 1.00 28.52 C ANISOU 2272 C ARG B 724 4011 3364 3462 -474 551 214 C ATOM 2273 O ARG B 724 14.457 4.876 37.100 1.00 28.96 O ANISOU 2273 O ARG B 724 4093 3464 3445 -294 994 24 O ATOM 2274 CB ARG B 724 16.047 6.891 39.139 1.00 33.95 C ANISOU 2274 CB ARG B 724 5502 3953 3443 295 147 -674 C ATOM 2275 CG ARG B 724 16.355 7.387 40.478 1.00 41.34 C ANISOU 2275 CG ARG B 724 6543 4587 4579 208 809 -204 C ATOM 2276 CD ARG B 724 16.004 8.856 40.556 1.00 39.91 C ANISOU 2276 CD ARG B 724 6587 3978 4601 265 981 86 C ATOM 2277 NE ARG B 724 16.798 9.745 39.686 1.00 39.98 N ANISOU 2277 NE ARG B 724 6663 3809 4718 559 828 313 N ATOM 2278 CZ ARG B 724 17.981 10.265 40.005 1.00 38.72 C ANISOU 2278 CZ ARG B 724 6489 3619 4606 778 801 570 C ATOM 2279 NH1 ARG B 724 18.558 9.964 41.160 1.00 38.70 N ANISOU 2279 NH1 ARG B 724 6458 3670 4576 585 32 507 N ATOM 2280 NH2 ARG B 724 18.594 11.093 39.167 1.00 38.27 N ANISOU 2280 NH2 ARG B 724 6423 3511 4606 709 840 638 N ATOM 0 H ARG B 724 17.637 5.127 39.852 1.00 27.41 H new ATOM 0 HA ARG B 724 15.142 5.062 39.531 1.00 29.84 H new ATOM 0 HB2 ARG B 724 16.754 7.179 38.541 1.00 33.95 H new ATOM 0 HB3 ARG B 724 15.230 7.320 38.840 1.00 33.95 H new ATOM 0 HG2 ARG B 724 15.855 6.888 41.143 1.00 41.34 H new ATOM 0 HG3 ARG B 724 17.296 7.257 40.674 1.00 41.34 H new ATOM 0 HD2 ARG B 724 15.067 8.961 40.330 1.00 39.91 H new ATOM 0 HD3 ARG B 724 16.109 9.150 41.475 1.00 39.91 H new ATOM 0 HE ARG B 724 16.472 9.942 38.915 1.00 39.98 H new ATOM 0 HH11 ARG B 724 18.168 9.429 41.709 1.00 38.70 H new ATOM 0 HH12 ARG B 724 19.322 10.303 41.360 1.00 38.70 H new ATOM 0 HH21 ARG B 724 18.227 11.295 38.416 1.00 38.27 H new ATOM 0 HH22 ARG B 724 19.358 11.428 39.375 1.00 38.27 H new ATOM 2294 N ASP B 725 16.663 5.206 36.715 1.00 26.22 N ANISOU 2294 N ASP B 725 3854 2799 3310 -261 271 430 N ATOM 2295 CA ASP B 725 16.477 5.135 35.280 1.00 27.87 C ANISOU 2295 CA ASP B 725 4337 3151 3101 115 190 488 C ATOM 2296 C ASP B 725 16.021 3.748 34.856 1.00 26.81 C ANISOU 2296 C ASP B 725 4091 3242 2853 -141 178 107 C ATOM 2297 O ASP B 725 15.151 3.603 33.981 1.00 27.59 O ANISOU 2297 O ASP B 725 3888 3414 3182 99 442 -182 O ATOM 2298 CB ASP B 725 17.762 5.530 34.583 1.00 28.28 C ANISOU 2298 CB ASP B 725 4431 3214 3101 -277 337 243 C ATOM 2299 CG ASP B 725 17.551 5.771 33.114 1.00 29.01 C ANISOU 2299 CG ASP B 725 4080 3574 3369 -22 133 461 C ATOM 2300 OD1 ASP B 725 16.979 6.824 32.731 1.00 29.82 O ANISOU 2300 OD1 ASP B 725 4018 3450 3861 -111 485 612 O ATOM 2301 OD2 ASP B 725 17.895 4.876 32.336 1.00 30.32 O1- ANISOU 2301 OD2 ASP B 725 3967 4002 3552 235 270 332 O1- ATOM 0 H ASP B 725 17.476 5.309 36.977 1.00 26.22 H new ATOM 0 HA ASP B 725 15.779 5.756 35.021 1.00 27.87 H new ATOM 0 HB2 ASP B 725 18.119 6.333 34.994 1.00 28.28 H new ATOM 0 HB3 ASP B 725 18.423 4.831 34.704 1.00 28.28 H new ATOM 2306 N ARG B 726 16.599 2.716 35.462 1.00 24.84 N ANISOU 2306 N ARG B 726 4157 2862 2419 210 310 242 N ATOM 2307 CA ARG B 726 16.201 1.359 35.124 1.00 23.42 C ANISOU 2307 CA ARG B 726 3449 2643 2807 247 502 86 C ATOM 2308 C ARG B 726 14.813 1.035 35.666 1.00 25.20 C ANISOU 2308 C ARG B 726 3573 2965 3038 33 522 9 C ATOM 2309 O ARG B 726 14.021 0.398 34.976 1.00 26.48 O ANISOU 2309 O ARG B 726 3333 3197 3532 -156 269 400 O ATOM 2310 CB ARG B 726 17.257 0.367 35.640 1.00 22.60 C ANISOU 2310 CB ARG B 726 3319 2591 2678 262 751 171 C ATOM 2311 CG ARG B 726 18.530 0.341 34.811 1.00 23.13 C ANISOU 2311 CG ARG B 726 3416 2812 2562 5 773 270 C ATOM 2312 CD ARG B 726 19.668 -0.307 35.551 1.00 23.19 C ANISOU 2312 CD ARG B 726 3198 2891 2722 -238 557 -14 C ATOM 2313 NE ARG B 726 20.848 -0.436 34.703 1.00 24.34 N ANISOU 2313 NE ARG B 726 3478 3061 2709 -258 732 -102 N ATOM 2314 CZ ARG B 726 21.733 0.526 34.486 1.00 24.94 C ANISOU 2314 CZ ARG B 726 3287 3136 3052 -129 496 -177 C ATOM 2315 NH1 ARG B 726 21.587 1.732 35.032 1.00 26.66 N ANISOU 2315 NH1 ARG B 726 3665 3302 3164 -408 514 -562 N ATOM 2316 NH2 ARG B 726 22.768 0.292 33.696 1.00 26.35 N ANISOU 2316 NH2 ARG B 726 2970 3497 3544 26 248 -68 N ATOM 0 H ARG B 726 17.213 2.779 36.061 1.00 24.84 H new ATOM 0 HA ARG B 726 16.149 1.280 34.159 1.00 23.42 H new ATOM 0 HB2 ARG B 726 17.482 0.594 36.556 1.00 22.60 H new ATOM 0 HB3 ARG B 726 16.872 -0.523 35.655 1.00 22.60 H new ATOM 0 HG2 ARG B 726 18.367 -0.139 33.984 1.00 23.13 H new ATOM 0 HG3 ARG B 726 18.776 1.247 34.569 1.00 23.13 H new ATOM 0 HD2 ARG B 726 19.887 0.219 36.336 1.00 23.19 H new ATOM 0 HD3 ARG B 726 19.395 -1.184 35.864 1.00 23.19 H new ATOM 0 HE ARG B 726 20.979 -1.192 34.315 1.00 24.34 H new ATOM 0 HH11 ARG B 726 20.909 1.897 35.535 1.00 26.66 H new ATOM 0 HH12 ARG B 726 22.170 2.346 34.881 1.00 26.66 H new ATOM 0 HH21 ARG B 726 22.862 -0.480 33.328 1.00 26.35 H new ATOM 0 HH22 ARG B 726 23.347 0.911 33.550 1.00 26.35 H new ATOM 2330 N VAL B 727 14.477 1.509 36.868 1.00 26.00 N ANISOU 2330 N VAL B 727 3551 3272 3058 126 881 -121 N ATOM 2331 CA VAL B 727 13.138 1.278 37.391 1.00 28.41 C ANISOU 2331 CA VAL B 727 3849 3569 3379 437 786 -47 C ATOM 2332 C VAL B 727 12.114 1.970 36.509 1.00 28.45 C ANISOU 2332 C VAL B 727 3912 3476 3424 309 730 327 C ATOM 2333 O VAL B 727 10.982 1.488 36.363 1.00 29.79 O ANISOU 2333 O VAL B 727 4032 3652 3634 8 792 222 O ATOM 2334 CB VAL B 727 13.046 1.743 38.858 1.00 31.03 C ANISOU 2334 CB VAL B 727 3995 4103 3691 384 1058 692 C ATOM 2335 CG1 VAL B 727 11.630 1.632 39.355 1.00 32.96 C ANISOU 2335 CG1 VAL B 727 4319 4448 3755 507 884 389 C ATOM 2336 CG2 VAL B 727 13.966 0.893 39.735 1.00 34.23 C ANISOU 2336 CG2 VAL B 727 4629 4430 3946 177 1423 944 C ATOM 0 H VAL B 727 15.000 1.957 37.383 1.00 26.00 H new ATOM 0 HA VAL B 727 12.945 0.327 37.379 1.00 28.41 H new ATOM 0 HB VAL B 727 13.325 2.671 38.906 1.00 31.03 H new ATOM 0 HG11 VAL B 727 11.587 1.927 40.278 1.00 32.96 H new ATOM 0 HG12 VAL B 727 11.051 2.188 38.810 1.00 32.96 H new ATOM 0 HG13 VAL B 727 11.338 0.709 39.297 1.00 32.96 H new ATOM 0 HG21 VAL B 727 13.902 1.192 40.656 1.00 34.23 H new ATOM 0 HG22 VAL B 727 13.698 -0.038 39.678 1.00 34.23 H new ATOM 0 HG23 VAL B 727 14.882 0.985 39.428 1.00 34.23 H new ATOM 2346 N GLY B 728 12.481 3.109 35.910 1.00 29.60 N ANISOU 2346 N GLY B 728 4174 3494 3577 421 396 320 N ATOM 2347 CA GLY B 728 11.606 3.811 34.983 1.00 27.61 C ANISOU 2347 CA GLY B 728 4023 3223 3244 -93 6 300 C ATOM 2348 C GLY B 728 11.312 3.050 33.709 1.00 25.69 C ANISOU 2348 C GLY B 728 3388 3212 3160 -174 -414 597 C ATOM 2349 O GLY B 728 10.400 3.439 32.974 1.00 29.06 O ANISOU 2349 O GLY B 728 3732 3388 3922 221 -222 506 O ATOM 0 H GLY B 728 13.242 3.490 36.033 1.00 29.60 H new ATOM 0 HA2 GLY B 728 10.768 4.007 35.431 1.00 27.61 H new ATOM 0 HA3 GLY B 728 12.011 4.662 34.753 1.00 27.61 H new ATOM 2353 N GLN B 729 12.072 1.994 33.432 1.00 27.23 N ANISOU 2353 N GLN B 729 3623 3285 3440 -351 335 228 N ATOM 2354 CA GLN B 729 11.783 1.115 32.307 1.00 24.43 C ANISOU 2354 CA GLN B 729 2893 3054 3336 -97 39 349 C ATOM 2355 C GLN B 729 10.623 0.189 32.586 1.00 25.33 C ANISOU 2355 C GLN B 729 2689 3432 3504 16 0 302 C ATOM 2356 O GLN B 729 10.053 -0.348 31.639 1.00 28.67 O ANISOU 2356 O GLN B 729 3243 3985 3667 -298 -3 320 O ATOM 2357 CB GLN B 729 12.978 0.214 31.970 1.00 27.58 C ANISOU 2357 CB GLN B 729 3355 3596 3528 -181 746 431 C ATOM 2358 CG GLN B 729 14.309 0.915 31.699 1.00 27.13 C ANISOU 2358 CG GLN B 729 3360 3689 3257 -478 314 -13 C ATOM 2359 CD GLN B 729 14.543 1.331 30.260 1.00 28.92 C ANISOU 2359 CD GLN B 729 3695 3692 3602 -264 536 167 C ATOM 2360 OE1 GLN B 729 13.743 1.060 29.352 1.00 30.30 O ANISOU 2360 OE1 GLN B 729 4214 4068 3232 -424 580 313 O ATOM 2361 NE2 GLN B 729 15.676 1.992 30.040 1.00 28.36 N ANISOU 2361 NE2 GLN B 729 3485 3385 3905 63 529 355 N ATOM 0 H GLN B 729 12.765 1.769 33.889 1.00 27.23 H new ATOM 0 HA GLN B 729 11.574 1.711 31.571 1.00 24.43 H new ATOM 0 HB2 GLN B 729 13.106 -0.407 32.704 1.00 27.58 H new ATOM 0 HB3 GLN B 729 12.749 -0.314 31.189 1.00 27.58 H new ATOM 0 HG2 GLN B 729 14.362 1.704 32.261 1.00 27.13 H new ATOM 0 HG3 GLN B 729 15.029 0.325 31.970 1.00 27.13 H new ATOM 0 HE21 GLN B 729 16.208 2.163 30.694 1.00 28.36 H new ATOM 0 HE22 GLN B 729 15.877 2.248 29.244 1.00 28.36 H new ATOM 2370 N ILE B 730 10.274 -0.022 33.849 1.00 26.64 N ANISOU 2370 N ILE B 730 3181 3571 3369 -182 361 18 N ATOM 2371 CA ILE B 730 9.364 -1.116 34.209 1.00 27.78 C ANISOU 2371 CA ILE B 730 3086 3832 3638 -259 440 -125 C ATOM 2372 C ILE B 730 7.957 -0.902 33.650 1.00 29.59 C ANISOU 2372 C ILE B 730 3512 3758 3971 -129 712 -23 C ATOM 2373 O ILE B 730 7.396 -1.843 33.089 1.00 28.53 O ANISOU 2373 O ILE B 730 3102 3669 4068 101 134 -108 O ATOM 2374 CB ILE B 730 9.364 -1.320 35.733 1.00 30.28 C ANISOU 2374 CB ILE B 730 3408 4174 3921 -391 627 163 C ATOM 2375 CG1 ILE B 730 10.761 -1.757 36.206 1.00 34.04 C ANISOU 2375 CG1 ILE B 730 3955 4673 4304 43 822 -241 C ATOM 2376 CG2 ILE B 730 8.311 -2.327 36.178 1.00 31.67 C ANISOU 2376 CG2 ILE B 730 3756 4339 3937 -758 772 387 C ATOM 2377 CD1 ILE B 730 11.242 -3.062 35.636 1.00 35.33 C ANISOU 2377 CD1 ILE B 730 4148 5037 4239 147 473 -392 C ATOM 0 H ILE B 730 10.548 0.451 34.513 1.00 26.64 H new ATOM 0 HA ILE B 730 9.689 -1.932 33.797 1.00 27.78 H new ATOM 0 HB ILE B 730 9.137 -0.470 36.142 1.00 30.28 H new ATOM 0 HG12 ILE B 730 11.398 -1.063 35.974 1.00 34.04 H new ATOM 0 HG13 ILE B 730 10.754 -1.824 37.174 1.00 34.04 H new ATOM 0 HG21 ILE B 730 8.345 -2.426 37.142 1.00 31.67 H new ATOM 0 HG22 ILE B 730 7.431 -2.013 35.916 1.00 31.67 H new ATOM 0 HG23 ILE B 730 8.486 -3.184 35.759 1.00 31.67 H new ATOM 0 HD11 ILE B 730 12.125 -3.261 35.984 1.00 35.33 H new ATOM 0 HD12 ILE B 730 10.629 -3.770 35.887 1.00 35.33 H new ATOM 0 HD13 ILE B 730 11.283 -2.998 34.669 1.00 35.33 H new ATOM 2389 N PRO B 731 7.341 0.277 33.722 1.00 30.64 N ANISOU 2389 N PRO B 731 3515 3828 4300 62 921 -270 N ATOM 2390 CA PRO B 731 5.983 0.390 33.161 1.00 29.79 C ANISOU 2390 CA PRO B 731 3400 3795 4124 146 471 -221 C ATOM 2391 C PRO B 731 5.855 -0.053 31.711 1.00 30.50 C ANISOU 2391 C PRO B 731 3455 3759 4374 381 353 63 C ATOM 2392 O PRO B 731 4.920 -0.796 31.366 1.00 32.34 O ANISOU 2392 O PRO B 731 3671 4288 4328 250 34 -517 O ATOM 2393 CB PRO B 731 5.671 1.869 33.346 1.00 31.41 C ANISOU 2393 CB PRO B 731 3376 4132 4426 667 277 -419 C ATOM 2394 CG PRO B 731 6.436 2.231 34.537 1.00 32.63 C ANISOU 2394 CG PRO B 731 3798 4314 4288 714 287 -648 C ATOM 2395 CD PRO B 731 7.731 1.507 34.422 1.00 31.18 C ANISOU 2395 CD PRO B 731 3627 3928 4294 407 457 -506 C ATOM 0 HA PRO B 731 5.359 -0.205 33.606 1.00 29.79 H new ATOM 0 HB2 PRO B 731 5.942 2.391 32.575 1.00 31.41 H new ATOM 0 HB3 PRO B 731 4.721 2.021 33.471 1.00 31.41 H new ATOM 0 HG2 PRO B 731 6.576 3.190 34.583 1.00 32.63 H new ATOM 0 HG3 PRO B 731 5.964 1.975 35.345 1.00 32.63 H new ATOM 0 HD2 PRO B 731 8.387 2.016 33.921 1.00 31.18 H new ATOM 0 HD3 PRO B 731 8.120 1.321 35.291 1.00 31.18 H new ATOM 2403 N ASN B 732 6.764 0.383 30.848 1.00 28.97 N ANISOU 2403 N ASN B 732 3373 3500 4132 107 262 428 N ATOM 2404 CA ASN B 732 6.712 -0.020 29.450 1.00 32.07 C ANISOU 2404 CA ASN B 732 3827 4085 4273 215 134 20 C ATOM 2405 C ASN B 732 6.983 -1.511 29.308 1.00 29.91 C ANISOU 2405 C ASN B 732 3338 3978 4049 517 39 -205 C ATOM 2406 O ASN B 732 6.380 -2.176 28.453 1.00 30.61 O ANISOU 2406 O ASN B 732 3501 3927 4202 102 70 -374 O ATOM 2407 CB ASN B 732 7.708 0.831 28.647 1.00 39.28 C ANISOU 2407 CB ASN B 732 5010 5118 4796 352 387 21 C ATOM 2408 CG ASN B 732 7.661 0.571 27.143 1.00 47.54 C ANISOU 2408 CG ASN B 732 6219 6250 5595 43 659 -38 C ATOM 2409 OD1 ASN B 732 6.603 0.625 26.514 1.00 51.11 O ANISOU 2409 OD1 ASN B 732 7164 6651 5605 -154 452 2 O ATOM 2410 ND2 ASN B 732 8.829 0.314 26.556 1.00 50.34 N ANISOU 2410 ND2 ASN B 732 6713 6644 5771 -172 1260 -307 N ATOM 0 H ASN B 732 7.414 0.909 31.049 1.00 28.97 H new ATOM 0 HA ASN B 732 5.823 0.134 29.095 1.00 32.07 H new ATOM 0 HB2 ASN B 732 7.526 1.769 28.811 1.00 39.28 H new ATOM 0 HB3 ASN B 732 8.606 0.656 28.970 1.00 39.28 H new ATOM 0 HD21 ASN B 732 8.863 0.178 25.707 1.00 50.34 H new ATOM 0 HD22 ASN B 732 9.549 0.284 27.026 1.00 50.34 H new ATOM 2417 N ILE B 733 7.854 -2.062 30.154 1.00 28.31 N ANISOU 2417 N ILE B 733 2843 3754 4159 658 147 -304 N ATOM 2418 CA ILE B 733 8.123 -3.492 30.099 1.00 28.81 C ANISOU 2418 CA ILE B 733 2649 3782 4515 693 213 -137 C ATOM 2419 C ILE B 733 6.905 -4.282 30.556 1.00 30.62 C ANISOU 2419 C ILE B 733 3116 3780 4739 194 479 -174 C ATOM 2420 O ILE B 733 6.573 -5.320 29.968 1.00 31.38 O ANISOU 2420 O ILE B 733 3150 3830 4944 293 366 -536 O ATOM 2421 CB ILE B 733 9.392 -3.830 30.904 1.00 31.10 C ANISOU 2421 CB ILE B 733 2954 3840 5021 564 488 -150 C ATOM 2422 CG1 ILE B 733 10.622 -3.455 30.057 1.00 35.56 C ANISOU 2422 CG1 ILE B 733 3857 4333 5322 492 861 165 C ATOM 2423 CG2 ILE B 733 9.426 -5.325 31.269 1.00 32.81 C ANISOU 2423 CG2 ILE B 733 3248 4133 5086 570 89 105 C ATOM 2424 CD1 ILE B 733 11.939 -3.529 30.756 1.00 39.13 C ANISOU 2424 CD1 ILE B 733 4567 4626 5673 326 1317 127 C ATOM 0 H ILE B 733 8.291 -1.631 30.756 1.00 28.31 H new ATOM 0 HA ILE B 733 8.295 -3.752 29.180 1.00 28.81 H new ATOM 0 HB ILE B 733 9.395 -3.326 31.733 1.00 31.10 H new ATOM 0 HG12 ILE B 733 10.652 -4.040 29.284 1.00 35.56 H new ATOM 0 HG13 ILE B 733 10.502 -2.552 29.725 1.00 35.56 H new ATOM 0 HG21 ILE B 733 10.231 -5.517 31.775 1.00 32.81 H new ATOM 0 HG22 ILE B 733 8.648 -5.545 31.805 1.00 32.81 H new ATOM 0 HG23 ILE B 733 9.420 -5.857 30.458 1.00 32.81 H new ATOM 0 HD11 ILE B 733 12.646 -3.276 30.142 1.00 39.13 H new ATOM 0 HD12 ILE B 733 11.938 -2.924 31.514 1.00 39.13 H new ATOM 0 HD13 ILE B 733 12.090 -4.435 31.067 1.00 39.13 H new ATOM 2436 N GLN B 734 6.180 -3.781 31.562 1.00 29.70 N ANISOU 2436 N GLN B 734 2854 3875 4556 -412 261 -235 N ATOM 2437 CA GLN B 734 4.963 -4.471 31.988 1.00 30.67 C ANISOU 2437 CA GLN B 734 2821 4178 4653 -305 175 -286 C ATOM 2438 C GLN B 734 3.948 -4.505 30.867 1.00 31.04 C ANISOU 2438 C GLN B 734 2833 4129 4831 -170 194 -105 C ATOM 2439 O GLN B 734 3.225 -5.493 30.704 1.00 33.35 O ANISOU 2439 O GLN B 734 3034 4574 5065 -315 475 -161 O ATOM 2440 CB GLN B 734 4.362 -3.794 33.213 1.00 32.62 C ANISOU 2440 CB GLN B 734 2900 4854 4640 -378 -152 -449 C ATOM 2441 CG GLN B 734 5.150 -3.973 34.492 1.00 36.89 C ANISOU 2441 CG GLN B 734 3375 5530 5112 -730 447 -450 C ATOM 2442 CD GLN B 734 4.601 -3.103 35.596 1.00 41.77 C ANISOU 2442 CD GLN B 734 4126 6371 5372 -958 586 -342 C ATOM 2443 OE1 GLN B 734 4.604 -1.874 35.500 1.00 45.37 O ANISOU 2443 OE1 GLN B 734 4421 6917 5899 -794 795 -477 O ATOM 2444 NE2 GLN B 734 4.089 -3.734 36.629 1.00 42.92 N ANISOU 2444 NE2 GLN B 734 4381 6793 5132 -1032 698 111 N ATOM 0 H GLN B 734 6.370 -3.064 31.998 1.00 29.70 H new ATOM 0 HA GLN B 734 5.201 -5.382 32.221 1.00 30.67 H new ATOM 0 HB2 GLN B 734 4.276 -2.845 33.032 1.00 32.62 H new ATOM 0 HB3 GLN B 734 3.466 -4.139 33.350 1.00 32.62 H new ATOM 0 HG2 GLN B 734 5.122 -4.903 34.765 1.00 36.89 H new ATOM 0 HG3 GLN B 734 6.081 -3.752 34.335 1.00 36.89 H new ATOM 0 HE21 GLN B 734 4.106 -4.593 36.660 1.00 42.92 H new ATOM 0 HE22 GLN B 734 3.737 -3.288 37.274 1.00 42.92 H new ATOM 2453 N LEU B 735 3.870 -3.432 30.083 1.00 32.35 N ANISOU 2453 N LEU B 735 3140 4250 4901 -5 -38 -244 N ATOM 2454 CA LEU B 735 2.934 -3.424 28.965 1.00 35.15 C ANISOU 2454 CA LEU B 735 3701 4429 5226 285 251 -402 C ATOM 2455 C LEU B 735 3.307 -4.493 27.950 1.00 33.43 C ANISOU 2455 C LEU B 735 3456 4032 5215 -50 376 -429 C ATOM 2456 O LEU B 735 2.432 -5.140 27.374 1.00 35.41 O ANISOU 2456 O LEU B 735 3313 4618 5524 -379 359 -782 O ATOM 2457 CB LEU B 735 2.904 -2.046 28.313 1.00 38.68 C ANISOU 2457 CB LEU B 735 4247 5012 5436 1170 254 -335 C ATOM 2458 CG LEU B 735 2.324 -0.939 29.191 1.00 44.25 C ANISOU 2458 CG LEU B 735 5313 5525 5977 1183 572 -508 C ATOM 2459 CD1 LEU B 735 2.238 0.344 28.391 1.00 44.66 C ANISOU 2459 CD1 LEU B 735 5339 5634 5993 1549 307 -98 C ATOM 2460 CD2 LEU B 735 0.954 -1.318 29.748 1.00 46.78 C ANISOU 2460 CD2 LEU B 735 5774 5769 6233 1127 884 -879 C ATOM 0 H LEU B 735 4.338 -2.716 30.178 1.00 32.35 H new ATOM 0 HA LEU B 735 2.046 -3.624 29.301 1.00 35.15 H new ATOM 0 HB2 LEU B 735 3.808 -1.801 28.060 1.00 38.68 H new ATOM 0 HB3 LEU B 735 2.385 -2.099 27.495 1.00 38.68 H new ATOM 0 HG LEU B 735 2.914 -0.810 29.950 1.00 44.25 H new ATOM 0 HD11 LEU B 735 1.870 1.048 28.947 1.00 44.66 H new ATOM 0 HD12 LEU B 735 3.125 0.599 28.092 1.00 44.66 H new ATOM 0 HD13 LEU B 735 1.664 0.208 27.621 1.00 44.66 H new ATOM 0 HD21 LEU B 735 0.617 -0.594 30.299 1.00 46.78 H new ATOM 0 HD22 LEU B 735 0.340 -1.479 29.015 1.00 46.78 H new ATOM 0 HD23 LEU B 735 1.034 -2.122 30.285 1.00 46.78 H new ATOM 2472 N LYS B 736 4.601 -4.712 27.739 1.00 29.19 N ANISOU 2472 N LYS B 736 3014 3437 4642 74 -272 -25 N ATOM 2473 CA LYS B 736 5.027 -5.750 26.805 1.00 30.01 C ANISOU 2473 CA LYS B 736 3134 3834 4433 -358 -181 -546 C ATOM 2474 C LYS B 736 4.824 -7.148 27.393 1.00 31.03 C ANISOU 2474 C LYS B 736 3419 3788 4584 -96 63 -532 C ATOM 2475 O LYS B 736 4.424 -8.082 26.676 1.00 32.20 O ANISOU 2475 O LYS B 736 3416 4097 4722 -139 226 -351 O ATOM 2476 CB LYS B 736 6.481 -5.499 26.409 1.00 31.55 C ANISOU 2476 CB LYS B 736 3656 3894 4438 -252 -33 -461 C ATOM 2477 CG LYS B 736 6.650 -4.122 25.722 1.00 37.22 C ANISOU 2477 CG LYS B 736 4650 4635 4857 -102 528 -396 C ATOM 2478 CD LYS B 736 8.036 -3.938 25.190 1.00 40.45 C ANISOU 2478 CD LYS B 736 5049 5213 5108 -366 255 -568 C ATOM 2479 CE LYS B 736 8.251 -2.534 24.626 1.00 45.63 C ANISOU 2479 CE LYS B 736 5829 5900 5610 267 170 -82 C ATOM 2480 NZ LYS B 736 7.157 -2.097 23.736 1.00 48.92 N ANISOU 2480 NZ LYS B 736 6189 6475 5922 112 135 -160 N ATOM 0 H LYS B 736 5.239 -4.279 28.119 1.00 29.19 H new ATOM 0 HA LYS B 736 4.477 -5.710 26.007 1.00 30.01 H new ATOM 0 HB2 LYS B 736 7.044 -5.540 27.198 1.00 31.55 H new ATOM 0 HB3 LYS B 736 6.780 -6.200 25.809 1.00 31.55 H new ATOM 0 HG2 LYS B 736 6.011 -4.041 24.997 1.00 37.22 H new ATOM 0 HG3 LYS B 736 6.450 -3.416 26.357 1.00 37.22 H new ATOM 0 HD2 LYS B 736 8.678 -4.103 25.898 1.00 40.45 H new ATOM 0 HD3 LYS B 736 8.205 -4.594 24.496 1.00 40.45 H new ATOM 0 HE2 LYS B 736 8.335 -1.905 25.360 1.00 45.63 H new ATOM 0 HE3 LYS B 736 9.088 -2.512 24.136 1.00 45.63 H new ATOM 0 HZ1 LYS B 736 7.473 -1.516 23.140 1.00 48.92 H new ATOM 0 HZ2 LYS B 736 6.819 -2.803 23.312 1.00 48.92 H new ATOM 0 HZ3 LYS B 736 6.518 -1.708 24.219 1.00 48.92 H new ATOM 2494 N LEU B 737 5.024 -7.306 28.703 1.00 30.80 N ANISOU 2494 N LEU B 737 3256 3778 4669 63 -172 -450 N ATOM 2495 CA LEU B 737 4.772 -8.606 29.333 1.00 33.07 C ANISOU 2495 CA LEU B 737 3836 4081 4647 -442 131 -270 C ATOM 2496 C LEU B 737 3.306 -8.988 29.280 1.00 35.51 C ANISOU 2496 C LEU B 737 4057 4569 4868 -415 189 -117 C ATOM 2497 O LEU B 737 2.980 -10.176 29.161 1.00 36.36 O ANISOU 2497 O LEU B 737 4012 4707 5097 -771 304 -340 O ATOM 2498 CB LEU B 737 5.240 -8.605 30.792 1.00 32.59 C ANISOU 2498 CB LEU B 737 4085 3895 4402 -577 441 -367 C ATOM 2499 CG LEU B 737 6.738 -8.793 30.962 1.00 32.35 C ANISOU 2499 CG LEU B 737 4094 3738 4461 -443 551 -12 C ATOM 2500 CD1 LEU B 737 7.134 -8.371 32.336 1.00 33.06 C ANISOU 2500 CD1 LEU B 737 4068 3733 4762 -325 500 197 C ATOM 2501 CD2 LEU B 737 7.102 -10.265 30.721 1.00 32.87 C ANISOU 2501 CD2 LEU B 737 4286 3633 4571 -848 680 264 C ATOM 0 H LEU B 737 5.299 -6.689 29.235 1.00 30.80 H new ATOM 0 HA LEU B 737 5.278 -9.262 28.829 1.00 33.07 H new ATOM 0 HB2 LEU B 737 4.980 -7.767 31.205 1.00 32.59 H new ATOM 0 HB3 LEU B 737 4.779 -9.312 31.270 1.00 32.59 H new ATOM 0 HG LEU B 737 7.215 -8.248 30.317 1.00 32.35 H new ATOM 0 HD11 LEU B 737 8.090 -8.490 32.448 1.00 33.06 H new ATOM 0 HD12 LEU B 737 6.907 -7.437 32.466 1.00 33.06 H new ATOM 0 HD13 LEU B 737 6.663 -8.912 32.989 1.00 33.06 H new ATOM 0 HD21 LEU B 737 8.059 -10.384 30.830 1.00 32.87 H new ATOM 0 HD22 LEU B 737 6.632 -10.823 31.360 1.00 32.87 H new ATOM 0 HD23 LEU B 737 6.845 -10.519 29.821 1.00 32.87 H new ATOM 2513 N LYS B 738 2.411 -8.007 29.367 1.00 35.11 N ANISOU 2513 N LYS B 738 3686 4484 5168 -420 124 -271 N ATOM 2514 CA LYS B 738 0.990 -8.317 29.324 1.00 39.05 C ANISOU 2514 CA LYS B 738 4135 5046 5655 -633 42 -235 C ATOM 2515 C LYS B 738 0.613 -9.032 28.033 1.00 39.14 C ANISOU 2515 C LYS B 738 4108 4985 5779 -591 -159 -266 C ATOM 2516 O LYS B 738 -0.356 -9.801 28.012 1.00 41.13 O ANISOU 2516 O LYS B 738 4593 5064 5972 -676 49 -398 O ATOM 2517 CB LYS B 738 0.201 -7.025 29.486 1.00 41.98 C ANISOU 2517 CB LYS B 738 4573 5466 5912 -817 -106 -64 C ATOM 2518 CG LYS B 738 -1.287 -7.193 29.573 1.00 47.10 C ANISOU 2518 CG LYS B 738 5425 6045 6428 -500 174 120 C ATOM 2519 CD LYS B 738 -1.952 -5.871 29.970 1.00 51.03 C ANISOU 2519 CD LYS B 738 6029 6515 6847 -308 429 84 C ATOM 2520 CE LYS B 738 -1.640 -4.721 28.999 1.00 52.88 C ANISOU 2520 CE LYS B 738 6238 6749 7107 -413 532 -55 C ATOM 2521 NZ LYS B 738 -2.141 -4.946 27.605 1.00 54.80 N ANISOU 2521 NZ LYS B 738 6443 6912 7466 -244 880 90 N ATOM 0 H LYS B 738 2.602 -7.173 29.450 1.00 35.11 H new ATOM 0 HA LYS B 738 0.775 -8.922 30.051 1.00 39.05 H new ATOM 0 HB2 LYS B 738 0.509 -6.573 30.287 1.00 41.98 H new ATOM 0 HB3 LYS B 738 0.403 -6.443 28.737 1.00 41.98 H new ATOM 0 HG2 LYS B 738 -1.635 -7.493 28.719 1.00 47.10 H new ATOM 0 HG3 LYS B 738 -1.503 -7.879 30.224 1.00 47.10 H new ATOM 0 HD2 LYS B 738 -2.913 -5.999 30.013 1.00 51.03 H new ATOM 0 HD3 LYS B 738 -1.659 -5.623 30.861 1.00 51.03 H new ATOM 0 HE2 LYS B 738 -2.031 -3.903 29.345 1.00 52.88 H new ATOM 0 HE3 LYS B 738 -0.680 -4.586 28.970 1.00 52.88 H new ATOM 0 HZ1 LYS B 738 -1.929 -4.247 27.097 1.00 54.80 H new ATOM 0 HZ2 LYS B 738 -1.767 -5.681 27.270 1.00 54.80 H new ATOM 0 HZ3 LYS B 738 -3.025 -5.044 27.619 1.00 54.80 H new ATOM 2535 N THR B 739 1.378 -8.808 26.958 1.00 38.48 N ANISOU 2535 N THR B 739 4050 4891 5681 73 -182 -354 N ATOM 2536 CA THR B 739 1.121 -9.401 25.650 1.00 38.65 C ANISOU 2536 CA THR B 739 3949 5000 5737 44 -17 -754 C ATOM 2537 C THR B 739 1.708 -10.802 25.517 1.00 37.08 C ANISOU 2537 C THR B 739 3557 4864 5667 -242 76 -786 C ATOM 2538 O THR B 739 1.305 -11.549 24.619 1.00 39.08 O ANISOU 2538 O THR B 739 4096 5229 5523 -166 120 -801 O ATOM 2539 CB THR B 739 1.700 -8.507 24.529 1.00 40.22 C ANISOU 2539 CB THR B 739 4487 5280 5514 456 -80 -873 C ATOM 2540 OG1 THR B 739 3.135 -8.574 24.530 1.00 42.94 O ANISOU 2540 OG1 THR B 739 5437 5748 5129 320 137 -847 O ATOM 2541 CG2 THR B 739 1.306 -7.063 24.711 1.00 40.16 C ANISOU 2541 CG2 THR B 739 4703 5115 5443 392 -134 -1146 C ATOM 0 H THR B 739 2.071 -8.298 26.974 1.00 38.48 H new ATOM 0 HA THR B 739 0.157 -9.469 25.563 1.00 38.65 H new ATOM 0 HB THR B 739 1.340 -8.837 23.691 1.00 40.22 H new ATOM 0 HG1 THR B 739 3.412 -8.635 25.321 1.00 42.94 H new ATOM 0 HG21 THR B 739 1.684 -6.531 23.993 1.00 40.16 H new ATOM 0 HG22 THR B 739 0.339 -6.987 24.694 1.00 40.16 H new ATOM 0 HG23 THR B 739 1.641 -6.741 25.563 1.00 40.16 H new ATOM 2549 N ALA B 740 2.633 -11.168 26.372 1.00 34.60 N ANISOU 2549 N ALA B 740 3253 4490 5401 -172 139 -517 N ATOM 2550 CA ALA B 740 3.289 -12.454 26.259 1.00 34.81 C ANISOU 2550 CA ALA B 740 3140 4440 5649 -778 536 -721 C ATOM 2551 C ALA B 740 2.358 -13.549 26.761 1.00 35.48 C ANISOU 2551 C ALA B 740 3127 4581 5772 -941 384 -447 C ATOM 2552 O ALA B 740 1.574 -13.319 27.683 1.00 36.39 O ANISOU 2552 O ALA B 740 3201 4889 5735 -774 532 -13 O ATOM 2553 CB ALA B 740 4.576 -12.474 27.074 1.00 36.45 C ANISOU 2553 CB ALA B 740 3455 4493 5902 -620 1165 -380 C ATOM 0 H ALA B 740 2.900 -10.685 27.032 1.00 34.60 H new ATOM 0 HA ALA B 740 3.506 -12.608 25.326 1.00 34.81 H new ATOM 0 HB1 ALA B 740 5.001 -13.342 26.987 1.00 36.45 H new ATOM 0 HB2 ALA B 740 5.177 -11.786 26.748 1.00 36.45 H new ATOM 0 HB3 ALA B 740 4.371 -12.307 28.007 1.00 36.45 H new ATOM 2559 N PRO B 741 2.430 -14.745 26.190 1.00 38.55 N ANISOU 2559 N PRO B 741 3914 4591 6141 -865 598 -326 N ATOM 2560 CA PRO B 741 1.698 -15.864 26.776 1.00 40.60 C ANISOU 2560 CA PRO B 741 4285 4854 6286 -862 226 -369 C ATOM 2561 C PRO B 741 2.388 -16.348 28.037 1.00 41.61 C ANISOU 2561 C PRO B 741 4556 4957 6299 -1268 -17 -172 C ATOM 2562 O PRO B 741 3.556 -16.052 28.292 1.00 40.45 O ANISOU 2562 O PRO B 741 4034 5082 6253 -647 -351 214 O ATOM 2563 CB PRO B 741 1.733 -16.920 25.676 1.00 41.22 C ANISOU 2563 CB PRO B 741 4559 4802 6299 -1001 288 -639 C ATOM 2564 CG PRO B 741 2.990 -16.649 24.960 1.00 41.29 C ANISOU 2564 CG PRO B 741 4498 4835 6355 -800 887 -459 C ATOM 2565 CD PRO B 741 3.159 -15.155 24.976 1.00 39.26 C ANISOU 2565 CD PRO B 741 4152 4541 6223 -1014 676 -491 C ATOM 0 HA PRO B 741 0.794 -15.638 27.045 1.00 40.60 H new ATOM 0 HB2 PRO B 741 1.721 -17.817 26.045 1.00 41.22 H new ATOM 0 HB3 PRO B 741 0.966 -16.845 25.087 1.00 41.22 H new ATOM 0 HG2 PRO B 741 3.739 -17.088 25.393 1.00 41.29 H new ATOM 0 HG3 PRO B 741 2.952 -16.985 24.051 1.00 41.29 H new ATOM 0 HD2 PRO B 741 4.094 -14.901 25.017 1.00 39.26 H new ATOM 0 HD3 PRO B 741 2.788 -14.744 24.180 1.00 39.26 H new ATOM 2573 N LEU B 742 1.642 -17.090 28.847 1.00 43.31 N ANISOU 2573 N LEU B 742 5147 5045 6262 -2105 -5 -485 N ATOM 2574 CA LEU B 742 2.244 -17.716 30.014 1.00 45.43 C ANISOU 2574 CA LEU B 742 5726 5208 6328 -2360 -358 -741 C ATOM 2575 C LEU B 742 3.209 -18.819 29.575 1.00 46.61 C ANISOU 2575 C LEU B 742 6360 5023 6327 -2023 -560 -775 C ATOM 2576 O LEU B 742 2.953 -19.541 28.604 1.00 47.71 O ANISOU 2576 O LEU B 742 6845 5149 6135 -1569 -782 -780 O ATOM 2577 CB LEU B 742 1.153 -18.291 30.926 1.00 48.25 C ANISOU 2577 CB LEU B 742 6125 5744 6466 -2274 -232 -655 C ATOM 2578 CG LEU B 742 0.063 -17.338 31.420 1.00 49.27 C ANISOU 2578 CG LEU B 742 6098 6130 6493 -1918 -272 -448 C ATOM 2579 CD1 LEU B 742 -1.061 -18.113 32.101 1.00 52.23 C ANISOU 2579 CD1 LEU B 742 6643 6553 6650 -1559 137 -261 C ATOM 2580 CD2 LEU B 742 0.638 -16.293 32.354 1.00 50.03 C ANISOU 2580 CD2 LEU B 742 6241 6225 6544 -1637 -177 -396 C ATOM 0 H LEU B 742 0.802 -17.241 28.742 1.00 43.31 H new ATOM 0 HA LEU B 742 2.741 -17.047 30.511 1.00 45.43 H new ATOM 0 HB2 LEU B 742 0.721 -19.019 30.452 1.00 48.25 H new ATOM 0 HB3 LEU B 742 1.587 -18.677 31.703 1.00 48.25 H new ATOM 0 HG LEU B 742 -0.307 -16.879 30.650 1.00 49.27 H new ATOM 0 HD11 LEU B 742 -1.742 -17.494 32.407 1.00 52.23 H new ATOM 0 HD12 LEU B 742 -1.452 -18.737 31.470 1.00 52.23 H new ATOM 0 HD13 LEU B 742 -0.704 -18.602 32.859 1.00 52.23 H new ATOM 0 HD21 LEU B 742 -0.070 -15.702 32.653 1.00 50.03 H new ATOM 0 HD22 LEU B 742 1.040 -16.730 33.121 1.00 50.03 H new ATOM 0 HD23 LEU B 742 1.313 -15.777 31.886 1.00 50.03 H new ATOM 2592 N LEU B 743 4.325 -18.949 30.295 1.00 45.78 N ANISOU 2592 N LEU B 743 6461 4795 6138 -1913 -662 -722 N ATOM 2593 CA LEU B 743 5.325 -19.952 29.958 1.00 46.34 C ANISOU 2593 CA LEU B 743 6742 4588 6277 -1846 -382 -438 C ATOM 2594 C LEU B 743 4.750 -21.343 30.143 1.00 48.50 C ANISOU 2594 C LEU B 743 7151 4876 6400 -1863 265 -363 C ATOM 2595 O LEU B 743 4.044 -21.598 31.117 1.00 49.16 O ANISOU 2595 O LEU B 743 7167 4986 6525 -1940 736 -393 O ATOM 2596 CB LEU B 743 6.552 -19.807 30.848 1.00 45.98 C ANISOU 2596 CB LEU B 743 6619 4605 6245 -1643 -658 -188 C ATOM 2597 CG LEU B 743 7.391 -18.557 30.630 1.00 46.42 C ANISOU 2597 CG LEU B 743 6774 4309 6554 -1173 -359 -219 C ATOM 2598 CD1 LEU B 743 8.156 -18.273 31.889 1.00 48.27 C ANISOU 2598 CD1 LEU B 743 6750 4855 6736 -775 -592 19 C ATOM 2599 CD2 LEU B 743 8.344 -18.722 29.461 1.00 47.61 C ANISOU 2599 CD2 LEU B 743 7048 4278 6765 -1149 -307 -190 C ATOM 0 H LEU B 743 4.518 -18.466 30.980 1.00 45.78 H new ATOM 0 HA LEU B 743 5.582 -19.821 29.032 1.00 46.34 H new ATOM 0 HB2 LEU B 743 6.262 -19.823 31.773 1.00 45.98 H new ATOM 0 HB3 LEU B 743 7.119 -20.583 30.715 1.00 45.98 H new ATOM 0 HG LEU B 743 6.804 -17.815 30.418 1.00 46.42 H new ATOM 0 HD11 LEU B 743 8.697 -17.477 31.767 1.00 48.27 H new ATOM 0 HD12 LEU B 743 7.535 -18.132 32.620 1.00 48.27 H new ATOM 0 HD13 LEU B 743 8.731 -19.026 32.095 1.00 48.27 H new ATOM 0 HD21 LEU B 743 8.863 -17.910 29.349 1.00 47.61 H new ATOM 0 HD22 LEU B 743 8.942 -19.466 29.633 1.00 47.61 H new ATOM 0 HD23 LEU B 743 7.837 -18.896 28.652 1.00 47.61 H new ATOM 2611 N GLY B 744 5.090 -22.248 29.223 1.00 50.67 N ANISOU 2611 N GLY B 744 7764 5088 6401 -1564 449 -455 N ATOM 2612 CA GLY B 744 4.598 -23.618 29.252 1.00 52.26 C ANISOU 2612 CA GLY B 744 8043 5418 6396 -1602 612 -569 C ATOM 2613 C GLY B 744 3.370 -23.789 28.388 1.00 53.58 C ANISOU 2613 C GLY B 744 8332 5666 6361 -1315 889 -412 C ATOM 2614 O GLY B 744 2.758 -22.799 28.004 1.00 53.87 O ANISOU 2614 O GLY B 744 8508 5605 6355 -1529 1094 -458 O ATOM 0 H GLY B 744 5.615 -22.079 28.563 1.00 50.67 H new ATOM 0 HA2 GLY B 744 5.295 -24.219 28.946 1.00 52.26 H new ATOM 0 HA3 GLY B 744 4.389 -23.868 30.166 1.00 52.26 H new TER 2618 GLY B 744 HETATM 2619 O HOH A 801 13.974 6.757 25.929 1.00 35.60 O ANISOU 2619 O HOH A 801 4926 4429 4172 -965 358 782 O HETATM 2620 O HOH A 802 25.419 20.720 29.700 1.00 40.17 O ANISOU 2620 O HOH A 802 4727 5239 5297 -137 -354 -691 O HETATM 2621 O HOH A 803 16.431 8.879 14.497 1.00 36.41 O ANISOU 2621 O HOH A 803 4563 4645 4628 -278 380 -634 O HETATM 2622 O HOH A 804 41.553 12.282 23.684 1.00 55.92 O ANISOU 2622 O HOH A 804 6847 6457 7942 2737 -1819 -2233 O HETATM 2623 O HOH A 805 14.400 4.449 27.427 1.00 38.38 O ANISOU 2623 O HOH A 805 4651 4357 5573 134 888 1547 O HETATM 2624 O HOH A 806 17.575 24.519 19.732 1.00 49.68 O ANISOU 2624 O HOH A 806 5434 3576 9866 -13 1766 1266 O HETATM 2625 O HOH A 807 26.340 11.691 35.718 1.00 39.87 O ANISOU 2625 O HOH A 807 4672 5477 4998 -451 256 13 O HETATM 2626 O HOH A 808 25.184 16.031 36.079 1.00 32.10 O ANISOU 2626 O HOH A 808 5090 3675 3432 -272 648 -760 O HETATM 2627 O HOH A 809 37.254 10.856 33.298 1.00 45.85 O ANISOU 2627 O HOH A 809 5856 5323 6242 79 -298 1769 O HETATM 2628 O HOH A 810 20.142 11.827 19.628 1.00 33.21 O ANISOU 2628 O HOH A 810 4335 3347 4936 99 -619 784 O HETATM 2629 O HOH A 811 12.603 11.119 20.717 1.00 32.80 O ANISOU 2629 O HOH A 811 3548 4445 4468 -575 -421 1640 O HETATM 2630 O HOH A 812 13.327 12.142 33.310 1.00 43.57 O ANISOU 2630 O HOH A 812 4710 6334 5510 -1075 144 1404 O HETATM 2631 O HOH A 813 13.139 10.052 14.262 1.00 43.13 O ANISOU 2631 O HOH A 813 7587 4334 4466 -602 -1253 475 O HETATM 2632 O HOH A 814 20.387 -2.773 28.018 1.00 29.02 O ANISOU 2632 O HOH A 814 4120 3472 3432 -716 345 -190 O HETATM 2633 O HOH A 815 28.680 8.372 22.809 1.00 30.68 O ANISOU 2633 O HOH A 815 3742 3934 3980 -282 491 327 O HETATM 2634 O HOH A 816 28.832 27.343 23.013 1.00 43.70 O ANISOU 2634 O HOH A 816 5420 5196 5989 -1623 232 411 O HETATM 2635 O HOH A 817 27.991 20.337 24.143 1.00 45.59 O ANISOU 2635 O HOH A 817 3712 6751 6859 -882 -520 -388 O HETATM 2636 O HOH A 818 39.054 9.478 25.559 1.00 43.53 O ANISOU 2636 O HOH A 818 2379 6984 7178 -425 -194 44 O HETATM 2637 O HOH A 819 7.020 13.540 30.949 1.00 58.64 O ANISOU 2637 O HOH A 819 5523 7500 9257 -1651 3626 -1837 O HETATM 2638 O HOH A 820 11.563 3.467 22.450 1.00 42.94 O ANISOU 2638 O HOH A 820 4741 5780 5794 -1398 -684 851 O HETATM 2639 O HOH A 821 17.198 10.397 12.292 1.00 34.17 O ANISOU 2639 O HOH A 821 4026 4227 4731 1199 -635 493 O HETATM 2640 O HOH A 822 24.693 22.677 31.450 1.00 37.16 O ANISOU 2640 O HOH A 822 5441 5118 3561 254 -574 107 O HETATM 2641 O HOH B 801 17.785 -12.189 24.424 1.00 54.08 O ANISOU 2641 O HOH B 801 4280 9672 6598 -1279 980 -3020 O HETATM 2642 O HOH B 802 8.652 2.702 31.112 1.00 33.43 O ANISOU 2642 O HOH B 802 4260 3729 4715 69 233 173 O HETATM 2643 O HOH B 803 21.125 -1.571 23.790 1.00 47.95 O ANISOU 2643 O HOH B 803 4034 7652 6533 -983 342 -756 O HETATM 2644 O HOH B 804 14.014 5.476 32.414 1.00 44.47 O ANISOU 2644 O HOH B 804 4951 4644 7303 -528 -2351 574 O HETATM 2645 O HOH B 805 25.904 0.542 31.404 1.00 46.37 O ANISOU 2645 O HOH B 805 3742 4231 9644 -582 -1201 -639 O HETATM 2646 O HOH B 806 24.314 -2.198 43.121 1.00 37.96 O ANISOU 2646 O HOH B 806 5174 5771 3478 -1552 8 358 O HETATM 2647 O HOH B 807 14.786 -11.500 33.122 1.00 31.25 O ANISOU 2647 O HOH B 807 3296 4283 4296 -280 27 11 O HETATM 2648 O HOH B 808 11.150 -0.070 29.024 1.00 35.57 O ANISOU 2648 O HOH B 808 4229 5634 3652 -1041 631 1 O HETATM 2649 O HOH B 809 21.594 -8.703 32.568 1.00 34.00 O ANISOU 2649 O HOH B 809 2749 4087 6081 116 319 900 O HETATM 2650 O HOH B 810 1.127 -13.519 22.537 1.00 41.22 O ANISOU 2650 O HOH B 810 3690 5203 6769 305 -672 -1710 O HETATM 2651 O HOH B 811 18.374 -7.232 40.442 1.00 54.05 O ANISOU 2651 O HOH B 811 12152 4131 4252 1524 761 465 O HETATM 2652 O HOH B 812 29.253 -1.736 36.929 1.00 42.50 O ANISOU 2652 O HOH B 812 4177 6294 5679 188 -168 -123 O HETATM 2653 O HOH B 813 10.625 3.447 28.937 1.00 45.70 O ANISOU 2653 O HOH B 813 4334 7337 5693 379 946 1741 O END