USER MOD reduce.3.24.130724 H: found=0, std=0, add=754, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 751 hydrogens (0 hets) HEADER TRANSFERASE 14-JUN-04 1VKR TITLE STRUCTURE OF IIB DOMAIN OF THE MANNITOL-SPECIFIC PERMEASE ENZYME II COMPND MOL_ID: 1; COMPND 2 MOLECULE: MANNITOL-SPECIFIC PTS SYSTEM ENZYME IIABC COMPONENTS; COMPND 3 CHAIN: A; COMPND 4 FRAGMENT: IIB DOMAIN; COMPND 5 SYNONYM: IIBMTL PHOSPHOTRANSFERASE ENZYME II, B COMPONENT, EIIB-MTL; COMPND 6 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; SOURCE 3 ORGANISM_TAXID: 83334; SOURCE 4 STRAIN: O157:H7; SOURCE 5 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 6 EXPRESSION_SYSTEM_TAXID: 562 KEYWDS PHOSPHOTRANSFERASE, TRANSFERASE, KINASE, SUGAR TRANSPORT EXPDTA SOLUTION NMR AUTHOR G.M.CLORE,P.M.LEGLER,M.CAI REVDAT 3 13-JUL-11 1VKR 1 VERSN REVDAT 2 24-FEB-09 1VKR 1 VERSN REVDAT 1 21-SEP-04 1VKR 0 JRNL AUTH P.M.LEGLER,M.CAI,A.PETERKOFSKY,G.M.CLORE JRNL TITL THREE-DIMENSIONAL SOLUTION STRUCTURE OF THE CYTOPLASMIC B JRNL TITL 2 DOMAIN OF THE MANNITOL TRANSPORTER II-MANNITOL OF THE JRNL TITL 3 ESCHERICHIA COLI PHOSPHOTRANSFERASE SYSTEM. JRNL REF J.BIOL.CHEM. V. 279 39115 2004 JRNL REFN ISSN 0021-9258 JRNL PMID 15258141 JRNL DOI 10.1074/JBC.M406764200 REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : X-PLOR_NIH (HTTP://NMR.CIT.NIH.GOV/XPLOR_NIH) REMARK 3 AUTHORS : SCHWIETERS, KUSZEWSKI, TJANDRA, CLORE REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: REMARK 3 THE TARGET FUNCTION COMPRISES TERMS FOR THE NOE-DERIVED INTERPROTON REMARK 3 DISTANCE RESTRAINTS, TORSION ANGLE RESTRAINTS, 3JHN-HALPHA COUPLING REMARK 3 CONSTANT RESTRAINTS, 13CALPHA/BETA CHEMICAL SHIFT RESTRAINTS, AND REMARK 3 RESIDUAL DIPOLAR COUPLING RESTRAINTS (N-H, N-C' AND HN-C'); A REMARK 3 QUARTIC VAN DER WAALS REPULSION TERM, TORSION ANGLE AND HYDROGEN REMARK 3 BONDING DATABASE POTENTIALS OF MEAN FORCE, AND A RADIUS OF GYRATION REMARK 3 RESTRAINTS. REMARK 3 REMARK 3 IN THIS ENTRY THE LAST COLUMN REPRESENTS THE AVERAGE RMS REMARK 3 DIFFERENCE BETWEEN THE INDIVIDUAL SIMULATED BEST-FITTED REMARK 3 TO RESIDUES 375-471. ONLY RESIDUES 375-471 ARE SHOWN REMARK 3 SINCE RESIDUES 365-374 AND 472-489 AT THE N- AND C-TERMINI REMARK 3 RESPECTIVELY, ARE DISORDERED IN SOLUTION. REMARK 3 REMARK 3 EXPERIMENTAL RESTRAINTS: REMARK 3 1444 INTERPROTON DISTANCE RESTRAINTS: REMARK 3 (90 INTRARESIDUE; 419 SEQUENTIAL, 347 REMARK 3 MEDIUM-RANGE, AND 517 LONG-RANGE INTERRESIDUE; REMARK 3 50 SEQUENTIAL/MEDIUM-RANGE AMBIGUOUS; REMARK 3 21 LONG-RANGE AMBIGUOUS REMARK 3 110 DISTANCE RESTRAINTS FOR 55 BACKBONE H-BONDS REMARK 3 214 TORSION ANGLE RESTRAINTS (90 PHI, 94 PSI, 68 CHI) REMARK 3 189 CALPHA/CBETA CHEMICAL SHIFT RESTRAINTS REMARK 3 70 3JHN-HA COUPLING CONSTANT RESTRAINTS REMARK 3 200 RESIDUAL DIPOLAR COUPLING RESTRAINTS REMARK 3 (74 N-H, 62 N-C', 64 HN-C') REMARK 3 DIPOLAR COUPLING R-FACTORS: REMARK 3 N-H 2.8% REMARK 3 N-C' 14.9% REMARK 3 HN-C' 13.5% REMARK 4 REMARK 4 1VKR COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 18-JUN-04. REMARK 100 THE RCSB ID CODE IS RCSB001960. REMARK 210 REMARK 210 EXPERIMENTAL DETAILS REMARK 210 EXPERIMENT TYPE : NMR REMARK 210 TEMPERATURE (KELVIN) : 308.00 REMARK 210 PH : 7.1 REMARK 210 IONIC STRENGTH : 40 MM SODIUM PHOSPHATE REMARK 210 PRESSURE : NULL REMARK 210 SAMPLE CONTENTS : NULL REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : 1) TRIPLE RESONANCE FOR REMARK 210 ASSIGNMENT OF PROTEIN; (2) REMARK 210 QUANTITATIVE J CORRELATION FOR REMARK 210 COUPLING CONSTANTS; (3) 3D, 4D REMARK 210 HETERONUCLEAR SEPARATED NOE REMARK 210 EXPTS; (4) IPAP AND COUPLED HSQC REMARK 210 EXPERIMENTS FOR DIPOLAR REMARK 210 COUPLINGS. DIPOLAR COUPLINGS WERE REMARK 210 MEASURED IN PEG/HEXANOL REMARK 210 SPECTROMETER FIELD STRENGTH : 500 MHZ; 600 MHZ; 750 MHZ; 800 REMARK 210 MHZ REMARK 210 SPECTROMETER MODEL : DMX500; DMX600; DRX600; DMC750; REMARK 210 DRX800 REMARK 210 SPECTROMETER MANUFACTURER : BRUKER REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : NULL REMARK 210 METHOD USED : TORSION ANGLE DYNAMICS REMARK 210 REMARK 210 CONFORMERS, NUMBER CALCULATED : 80 REMARK 210 CONFORMERS, NUMBER SUBMITTED : 1 REMARK 210 CONFORMERS, SELECTION CRITERIA : REGULARIZED MEAN STRUCTURE REMARK 210 REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : NULL REMARK 210 REMARK 210 REMARK: NULL REMARK 215 REMARK 215 NMR STUDY REMARK 215 THE COORDINATES IN THIS ENTRY WERE GENERATED FROM SOLUTION REMARK 215 NMR DATA. PROTEIN DATA BANK CONVENTIONS REQUIRE THAT REMARK 215 CRYST1 AND SCALE RECORDS BE INCLUDED, BUT THE VALUES ON REMARK 215 THESE RECORDS ARE MEANINGLESS. REMARK 300 REMARK 300 BIOMOLECULE: 1 REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON REMARK 300 BURIED SURFACE AREA. REMARK 350 REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. REMARK 350 REMARK 350 BIOMOLECULE: 1 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: MONOMERIC REMARK 350 APPLY THE FOLLOWING TO CHAINS: A REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 465 REMARK 465 MISSING RESIDUES REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE REMARK 465 EXPERIMENT. (RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 465 SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.) REMARK 465 RES C SSSEQI REMARK 465 GLY A 365 REMARK 465 SER A 366 REMARK 465 ALA A 367 REMARK 465 GLY A 368 REMARK 465 ASP A 369 REMARK 465 VAL A 370 REMARK 465 THR A 371 REMARK 465 ASN A 372 REMARK 465 ASP A 373 REMARK 465 LEU A 374 REMARK 465 THR A 472 REMARK 465 GLU A 473 REMARK 465 ASN A 474 REMARK 465 GLU A 475 REMARK 465 VAL A 476 REMARK 465 LYS A 477 REMARK 465 VAL A 478 REMARK 465 LYS A 479 REMARK 465 ASP A 480 REMARK 465 SER A 481 REMARK 465 LEU A 482 REMARK 465 LYS A 483 REMARK 465 ASP A 484 REMARK 465 SER A 485 REMARK 465 PHE A 486 REMARK 465 ASP A 487 REMARK 465 ASP A 488 REMARK 465 SER A 489 REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: CLOSE CONTACTS REMARK 500 REMARK 500 THE FOLLOWING ATOMS ARE IN CLOSE CONTACT. REMARK 500 REMARK 500 ATM1 RES C SSEQI ATM2 RES C SSEQI DISTANCE REMARK 500 HD1 HIS A 430 H ASP A 432 1.16 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: TORSION ANGLES REMARK 500 REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS: REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2) REMARK 500 REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI- REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400 REMARK 500 REMARK 500 M RES CSSEQI PSI PHI REMARK 500 ARG A 378 -3.04 -143.23 REMARK 500 MET A 388 -67.60 -149.09 REMARK 500 ASP A 454 79.20 -62.04 REMARK 500 REMARK 500 REMARK: NULL DBREF 1VKR A 367 489 UNP P00550 PTM3C_ECOLI 367 489 SEQADV 1VKR GLY A 365 UNP P00550 CLONING ARTIFACT SEQADV 1VKR SER A 366 UNP P00550 CLONING ARTIFACT SEQRES 1 A 125 GLY SER ALA GLY ASP VAL THR ASN ASP LEU SER HIS VAL SEQRES 2 A 125 ARG LYS ILE ILE VAL ALA CYS ASP ALA GLY MET GLY SER SEQRES 3 A 125 SER ALA MET GLY ALA GLY VAL LEU ARG LYS LYS ILE GLN SEQRES 4 A 125 ASP ALA GLY LEU SER GLN ILE SER VAL THR ASN SER ALA SEQRES 5 A 125 ILE ASN ASN LEU PRO PRO ASP VAL ASP LEU VAL ILE THR SEQRES 6 A 125 HIS ARG ASP LEU THR GLU ARG ALA MET ARG GLN VAL PRO SEQRES 7 A 125 GLN ALA GLN HIS ILE SER LEU THR ASN PHE LEU ASP SER SEQRES 8 A 125 GLY LEU TYR THR SER LEU THR GLU ARG LEU VAL ALA ALA SEQRES 9 A 125 GLN ARG HIS THR GLU ASN GLU VAL LYS VAL LYS ASP SER SEQRES 10 A 125 LEU LYS ASP SER PHE ASP ASP SER HELIX 1 1 MET A 388 ALA A 405 1 18 HELIX 2 2 ARG A 431 VAL A 441 1 11 HELIX 3 3 ASP A 454 HIS A 471 1 18 SHEET 1 A 4 SER A 411 ASN A 414 0 SHEET 2 A 4 LYS A 379 VAL A 382 1 N ILE A 380 O SER A 411 SHEET 3 A 4 LEU A 426 HIS A 430 1 O ILE A 428 N ILE A 381 SHEET 4 A 4 GLN A 445 LEU A 449 1 O GLN A 445 N VAL A 427 CRYST1 1.000 1.000 1.000 90.00 90.00 90.00 P 1 1 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 1.000000 0.000000 0.000000 0.00000 SCALE2 0.000000 1.000000 0.000000 0.00000 SCALE3 0.000000 0.000000 1.000000 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 384 CYS SG : rot -67:sc= 1.76! USER MOD Set 1.2: A 391 SER OG : rot 55:sc= 1.26! USER MOD Single : A 375 SER OG : rot 180:sc= 0 USER MOD Single : A 376 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 379 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 388 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 390 SER OG : rot 180:sc= 0 USER MOD Single : A 393 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 400 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 401 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 403 GLN : amide:sc= -0.143 K(o=-0.14,f=-0.92) USER MOD Single : A 408 SER OG : rot 180:sc= 0 USER MOD Single : A 409 GLN : amide:sc= 0 K(o=0,f=-0.87) USER MOD Single : A 411 SER OG : rot 180:sc= 0 USER MOD Single : A 413 THR OG1 : rot 180:sc= 0 USER MOD Single : A 414 ASN : amide:sc= -1.83 K(o=-1.8,f=-4.5!) USER MOD Single : A 415 SER OG : rot -126:sc= 0.797 USER MOD Single : A 418 ASN :FLIP amide:sc= -0.175 F(o=-1.5!,f=-0.17) USER MOD Single : A 419 ASN : amide:sc= -0.305 K(o=-0.3,f=-2.5!) USER MOD Single : A 429 THR OG1 : rot 130:sc= -0.426 USER MOD Single : A 430 HIS : no HD1:sc= 0.541 K(o=0.54,f=-8.7!) USER MOD Single : A 434 THR OG1 : rot 177:sc= -0.767 USER MOD Single : A 438 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 440 GLN : amide:sc= -3.19! C(o=-3.2!,f=-6.8!) USER MOD Single : A 443 GLN : amide:sc= 0 K(o=0,f=-1.6!) USER MOD Single : A 445 GLN : amide:sc= -0.0801 K(o=-0.08,f=-3.3!) USER MOD Single : A 446 HIS : no HD1:sc= -2.56! C(o=-2.6!,f=-13!) USER MOD Single : A 448 SER OG : rot 180:sc=-0.00839 USER MOD Single : A 450 THR OG1 : rot 106:sc= -0.876 USER MOD Single : A 451 ASN : amide:sc= -0.309 K(o=-0.31,f=-3.1!) USER MOD Single : A 455 SER OG : rot 180:sc= 0 USER MOD Single : A 458 TYR OH : rot 180:sc= -0.65 USER MOD Single : A 459 THR OG1 : rot 77:sc= 1.04 USER MOD Single : A 460 SER OG : rot 77:sc= 0.8 USER MOD Single : A 462 THR OG1 : rot 76:sc= 1.14 USER MOD Single : A 469 GLN : amide:sc= -1.66! C(o=-1.7!,f=-2.8!) USER MOD Single : A 471 HIS : no HD1:sc= -0.295 X(o=-0.29,f=-0.071) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 375 314.349 207.814 161.981 1.00 1.68 N ATOM 2 CA SER A 375 314.778 207.198 163.233 1.00 1.26 C ATOM 3 C SER A 375 315.390 208.246 164.165 1.00 0.97 C ATOM 4 O SER A 375 316.606 208.435 164.197 1.00 1.03 O ATOM 5 CB SER A 375 315.786 206.082 162.934 1.00 1.82 C ATOM 6 OG SER A 375 315.132 204.825 163.052 1.00 2.49 O ATOM 0 HA SER A 375 313.912 206.768 163.736 1.00 1.26 H new ATOM 0 HB2 SER A 375 316.194 206.202 161.930 1.00 1.82 H new ATOM 0 HB3 SER A 375 316.625 206.137 163.628 1.00 1.82 H new ATOM 0 HG SER A 375 315.769 204.105 162.861 1.00 2.49 H new ATOM 12 N HIS A 376 314.525 208.947 164.893 1.00 0.77 N ATOM 13 CA HIS A 376 314.959 210.011 165.800 1.00 0.59 C ATOM 14 C HIS A 376 314.733 209.637 167.268 1.00 0.48 C ATOM 15 O HIS A 376 313.618 209.287 167.649 1.00 0.42 O ATOM 16 CB HIS A 376 314.142 211.281 165.489 1.00 0.62 C ATOM 17 CG HIS A 376 315.015 212.369 164.932 1.00 1.37 C ATOM 18 ND1 HIS A 376 315.758 213.200 165.752 1.00 2.33 N ATOM 19 CD2 HIS A 376 315.240 212.801 163.652 1.00 2.32 C ATOM 20 CE1 HIS A 376 316.389 214.087 164.964 1.00 3.24 C ATOM 21 NE2 HIS A 376 316.109 213.889 163.674 1.00 3.25 N ATOM 0 H HIS A 376 313.516 208.798 164.874 1.00 0.77 H new ATOM 0 HA HIS A 376 316.026 210.172 165.650 1.00 0.59 H new ATOM 0 HB2 HIS A 376 313.354 211.043 164.775 1.00 0.62 H new ATOM 0 HB3 HIS A 376 313.653 211.633 166.397 1.00 0.62 H new ATOM 0 HD2 HIS A 376 314.810 212.365 162.762 1.00 2.32 H new ATOM 0 HE1 HIS A 376 317.043 214.865 165.330 1.00 3.24 H new ATOM 0 HE2 HIS A 376 316.457 214.420 162.876 1.00 3.25 H new ATOM 29 N VAL A 377 315.774 209.737 168.097 1.00 0.51 N ATOM 30 CA VAL A 377 315.622 209.468 169.523 1.00 0.44 C ATOM 31 C VAL A 377 314.740 210.538 170.163 1.00 0.31 C ATOM 32 O VAL A 377 315.144 211.696 170.275 1.00 0.38 O ATOM 33 CB VAL A 377 316.991 209.486 170.209 1.00 0.59 C ATOM 34 CG1 VAL A 377 316.815 209.214 171.706 1.00 0.67 C ATOM 35 CG2 VAL A 377 317.897 208.414 169.593 1.00 0.77 C ATOM 0 H VAL A 377 316.717 209.998 167.809 1.00 0.51 H new ATOM 0 HA VAL A 377 315.162 208.487 169.644 1.00 0.44 H new ATOM 0 HB VAL A 377 317.451 210.464 170.069 1.00 0.59 H new ATOM 0 HG11 VAL A 377 317.789 209.227 172.195 1.00 0.67 H new ATOM 0 HG12 VAL A 377 316.179 209.984 172.143 1.00 0.67 H new ATOM 0 HG13 VAL A 377 316.351 208.238 171.846 1.00 0.67 H new ATOM 0 HG21 VAL A 377 318.869 208.432 170.086 1.00 0.77 H new ATOM 0 HG22 VAL A 377 317.441 207.433 169.726 1.00 0.77 H new ATOM 0 HG23 VAL A 377 318.026 208.614 168.529 1.00 0.77 H new ATOM 45 N ARG A 378 313.548 210.148 170.599 1.00 0.22 N ATOM 46 CA ARG A 378 312.643 211.103 171.246 1.00 0.28 C ATOM 47 C ARG A 378 311.873 210.446 172.380 1.00 0.26 C ATOM 48 O ARG A 378 311.038 211.091 173.013 1.00 0.30 O ATOM 49 CB ARG A 378 311.632 211.687 170.230 1.00 0.41 C ATOM 50 CG ARG A 378 311.843 211.045 168.860 1.00 1.37 C ATOM 51 CD ARG A 378 310.971 211.737 167.805 1.00 1.57 C ATOM 52 NE ARG A 378 309.753 210.973 167.563 1.00 2.18 N ATOM 53 CZ ARG A 378 308.792 211.468 166.792 1.00 2.82 C ATOM 54 NH1 ARG A 378 308.966 212.631 166.221 1.00 3.04 N ATOM 55 NH2 ARG A 378 307.693 210.794 166.583 1.00 3.74 N ATOM 0 H ARG A 378 313.186 209.197 170.521 1.00 0.22 H new ATOM 0 HA ARG A 378 313.261 211.907 171.646 1.00 0.28 H new ATOM 0 HB2 ARG A 378 310.613 211.507 170.573 1.00 0.41 H new ATOM 0 HB3 ARG A 378 311.758 212.767 170.158 1.00 0.41 H new ATOM 0 HG2 ARG A 378 312.893 211.116 168.576 1.00 1.37 H new ATOM 0 HG3 ARG A 378 311.596 209.984 168.906 1.00 1.37 H new ATOM 0 HD2 ARG A 378 310.715 212.742 168.140 1.00 1.57 H new ATOM 0 HD3 ARG A 378 311.531 211.843 166.876 1.00 1.57 H new ATOM 0 HE ARG A 378 309.638 210.053 167.988 1.00 2.18 H new ATOM 0 HH11 ARG A 378 309.833 213.148 166.370 1.00 3.04 H new ATOM 0 HH12 ARG A 378 308.235 213.022 165.626 1.00 3.04 H new ATOM 0 HH21 ARG A 378 307.567 209.878 167.014 1.00 3.74 H new ATOM 0 HH22 ARG A 378 306.961 211.184 165.989 1.00 3.74 H new ATOM 69 N LYS A 379 312.072 209.147 172.572 1.00 0.26 N ATOM 70 CA LYS A 379 311.284 208.426 173.557 1.00 0.25 C ATOM 71 C LYS A 379 312.128 207.960 174.727 1.00 0.22 C ATOM 72 O LYS A 379 313.091 207.208 174.572 1.00 0.25 O ATOM 73 CB LYS A 379 310.607 207.237 172.869 1.00 0.30 C ATOM 74 CG LYS A 379 309.224 207.011 173.480 1.00 1.06 C ATOM 75 CD LYS A 379 308.456 205.973 172.666 1.00 1.16 C ATOM 76 CE LYS A 379 307.116 205.695 173.352 1.00 1.89 C ATOM 77 NZ LYS A 379 306.098 205.326 172.331 1.00 2.52 N ATOM 0 H LYS A 379 312.758 208.584 172.069 1.00 0.26 H new ATOM 0 HA LYS A 379 310.530 209.100 173.965 1.00 0.25 H new ATOM 0 HB2 LYS A 379 310.517 207.426 171.799 1.00 0.30 H new ATOM 0 HB3 LYS A 379 311.217 206.341 172.984 1.00 0.30 H new ATOM 0 HG2 LYS A 379 309.324 206.674 174.512 1.00 1.06 H new ATOM 0 HG3 LYS A 379 308.670 207.949 173.503 1.00 1.06 H new ATOM 0 HD2 LYS A 379 308.292 206.336 171.652 1.00 1.16 H new ATOM 0 HD3 LYS A 379 309.036 205.053 172.585 1.00 1.16 H new ATOM 0 HE2 LYS A 379 307.228 204.888 174.077 1.00 1.89 H new ATOM 0 HE3 LYS A 379 306.789 206.576 173.904 1.00 1.89 H new ATOM 0 HZ1 LYS A 379 305.189 205.138 172.800 1.00 2.52 H new ATOM 0 HZ2 LYS A 379 305.984 206.109 171.656 1.00 2.52 H new ATOM 0 HZ3 LYS A 379 306.409 204.473 171.823 1.00 2.52 H new ATOM 91 N ILE A 380 311.720 208.400 175.909 1.00 0.19 N ATOM 92 CA ILE A 380 312.390 208.035 177.142 1.00 0.18 C ATOM 93 C ILE A 380 311.379 207.427 178.102 1.00 0.17 C ATOM 94 O ILE A 380 310.322 208.012 178.383 1.00 0.21 O ATOM 95 CB ILE A 380 313.034 209.277 177.769 1.00 0.20 C ATOM 96 CG1 ILE A 380 314.141 209.789 176.852 1.00 0.27 C ATOM 97 CG2 ILE A 380 313.618 208.930 179.126 1.00 0.23 C ATOM 98 CD1 ILE A 380 314.458 211.225 177.180 1.00 0.46 C ATOM 0 H ILE A 380 310.918 209.017 176.037 1.00 0.19 H new ATOM 0 HA ILE A 380 313.171 207.304 176.932 1.00 0.18 H new ATOM 0 HB ILE A 380 312.276 210.050 177.896 1.00 0.20 H new ATOM 0 HG12 ILE A 380 315.034 209.175 176.968 1.00 0.27 H new ATOM 0 HG13 ILE A 380 313.830 209.705 175.811 1.00 0.27 H new ATOM 0 HG21 ILE A 380 314.073 209.818 179.564 1.00 0.23 H new ATOM 0 HG22 ILE A 380 312.826 208.568 179.781 1.00 0.23 H new ATOM 0 HG23 ILE A 380 314.375 208.154 179.009 1.00 0.23 H new ATOM 0 HD11 ILE A 380 315.249 211.583 176.521 1.00 0.46 H new ATOM 0 HD12 ILE A 380 313.566 211.836 177.041 1.00 0.46 H new ATOM 0 HD13 ILE A 380 314.789 211.297 178.216 1.00 0.46 H new ATOM 110 N ILE A 381 311.699 206.240 178.591 1.00 0.15 N ATOM 111 CA ILE A 381 310.813 205.539 179.501 1.00 0.15 C ATOM 112 C ILE A 381 311.602 204.973 180.664 1.00 0.14 C ATOM 113 O ILE A 381 312.685 204.413 180.484 1.00 0.18 O ATOM 114 CB ILE A 381 310.081 204.420 178.754 1.00 0.21 C ATOM 115 CG1 ILE A 381 308.888 203.939 179.592 1.00 0.23 C ATOM 116 CG2 ILE A 381 311.039 203.248 178.498 1.00 0.26 C ATOM 117 CD1 ILE A 381 307.945 203.079 178.739 1.00 0.43 C ATOM 0 H ILE A 381 312.563 205.744 178.373 1.00 0.15 H new ATOM 0 HA ILE A 381 310.076 206.240 179.893 1.00 0.15 H new ATOM 0 HB ILE A 381 309.723 204.802 177.798 1.00 0.21 H new ATOM 0 HG12 ILE A 381 309.244 203.362 180.445 1.00 0.23 H new ATOM 0 HG13 ILE A 381 308.347 204.797 179.991 1.00 0.23 H new ATOM 0 HG21 ILE A 381 310.511 202.456 177.966 1.00 0.26 H new ATOM 0 HG22 ILE A 381 311.881 203.591 177.896 1.00 0.26 H new ATOM 0 HG23 ILE A 381 311.406 202.864 179.450 1.00 0.26 H new ATOM 0 HD11 ILE A 381 307.105 202.746 179.348 1.00 0.43 H new ATOM 0 HD12 ILE A 381 307.574 203.668 177.900 1.00 0.43 H new ATOM 0 HD13 ILE A 381 308.486 202.211 178.362 1.00 0.43 H new ATOM 129 N VAL A 382 311.046 205.114 181.862 1.00 0.14 N ATOM 130 CA VAL A 382 311.702 204.598 183.054 1.00 0.16 C ATOM 131 C VAL A 382 310.986 203.338 183.513 1.00 0.30 C ATOM 132 O VAL A 382 309.757 203.312 183.598 1.00 0.47 O ATOM 133 CB VAL A 382 311.670 205.651 184.167 1.00 0.26 C ATOM 134 CG1 VAL A 382 312.229 205.047 185.463 1.00 0.43 C ATOM 135 CG2 VAL A 382 312.510 206.877 183.752 1.00 0.41 C ATOM 0 H VAL A 382 310.153 205.576 182.031 1.00 0.14 H new ATOM 0 HA VAL A 382 312.741 204.363 182.824 1.00 0.16 H new ATOM 0 HB VAL A 382 310.641 205.968 184.334 1.00 0.26 H new ATOM 0 HG11 VAL A 382 312.206 205.797 186.254 1.00 0.43 H new ATOM 0 HG12 VAL A 382 311.622 204.191 185.757 1.00 0.43 H new ATOM 0 HG13 VAL A 382 313.257 204.724 185.300 1.00 0.43 H new ATOM 0 HG21 VAL A 382 312.484 207.622 184.547 1.00 0.41 H new ATOM 0 HG22 VAL A 382 313.541 206.569 183.577 1.00 0.41 H new ATOM 0 HG23 VAL A 382 312.100 207.307 182.838 1.00 0.41 H new ATOM 145 N ALA A 383 311.747 202.284 183.779 1.00 0.29 N ATOM 146 CA ALA A 383 311.142 201.024 184.193 1.00 0.45 C ATOM 147 C ALA A 383 311.882 200.408 185.380 1.00 0.27 C ATOM 148 O ALA A 383 313.105 200.488 185.484 1.00 0.24 O ATOM 149 CB ALA A 383 311.141 200.053 183.011 1.00 0.72 C ATOM 0 H ALA A 383 312.765 202.274 183.717 1.00 0.29 H new ATOM 0 HA ALA A 383 310.119 201.222 184.512 1.00 0.45 H new ATOM 0 HB1 ALA A 383 310.689 199.109 183.316 1.00 0.72 H new ATOM 0 HB2 ALA A 383 310.567 200.481 182.189 1.00 0.72 H new ATOM 0 HB3 ALA A 383 312.166 199.876 182.685 1.00 0.72 H new ATOM 155 N CYS A 384 311.112 199.767 186.256 1.00 0.32 N ATOM 156 CA CYS A 384 311.662 199.094 187.430 1.00 0.21 C ATOM 157 C CYS A 384 310.807 197.862 187.729 1.00 0.20 C ATOM 158 O CYS A 384 309.844 197.598 187.005 1.00 0.23 O ATOM 159 CB CYS A 384 311.700 200.055 188.628 1.00 0.25 C ATOM 160 SG CYS A 384 310.065 200.180 189.396 1.00 0.33 S ATOM 0 H CYS A 384 310.098 199.699 186.174 1.00 0.32 H new ATOM 0 HA CYS A 384 312.687 198.778 187.237 1.00 0.21 H new ATOM 0 HB2 CYS A 384 312.426 199.703 189.361 1.00 0.25 H new ATOM 0 HB3 CYS A 384 312.030 201.041 188.300 1.00 0.25 H new ATOM 0 HG CYS A 384 309.246 200.771 188.578 1.00 0.33 H new ATOM 166 N ASP A 385 311.157 197.068 188.744 1.00 0.22 N ATOM 167 CA ASP A 385 310.396 195.851 189.020 1.00 0.24 C ATOM 168 C ASP A 385 309.002 196.171 189.550 1.00 0.23 C ATOM 169 O ASP A 385 308.091 195.347 189.457 1.00 0.31 O ATOM 170 CB ASP A 385 311.164 194.965 190.020 1.00 0.28 C ATOM 171 CG ASP A 385 310.881 195.356 191.476 1.00 1.40 C ATOM 172 OD1 ASP A 385 310.243 196.369 191.699 1.00 2.28 O ATOM 173 OD2 ASP A 385 311.318 194.626 192.352 1.00 1.62 O ATOM 0 H ASP A 385 311.942 197.240 189.373 1.00 0.22 H new ATOM 0 HA ASP A 385 310.274 195.308 188.083 1.00 0.24 H new ATOM 0 HB2 ASP A 385 310.888 193.922 189.865 1.00 0.28 H new ATOM 0 HB3 ASP A 385 312.234 195.044 189.826 1.00 0.28 H new ATOM 178 N ALA A 386 308.842 197.360 190.122 1.00 0.22 N ATOM 179 CA ALA A 386 307.553 197.754 190.679 1.00 0.31 C ATOM 180 C ALA A 386 306.747 198.560 189.670 1.00 0.29 C ATOM 181 O ALA A 386 305.524 198.653 189.773 1.00 0.49 O ATOM 182 CB ALA A 386 307.769 198.593 191.940 1.00 0.39 C ATOM 0 H ALA A 386 309.579 198.060 190.212 1.00 0.22 H new ATOM 0 HA ALA A 386 306.998 196.849 190.926 1.00 0.31 H new ATOM 0 HB1 ALA A 386 306.803 198.885 192.353 1.00 0.39 H new ATOM 0 HB2 ALA A 386 308.316 198.007 192.678 1.00 0.39 H new ATOM 0 HB3 ALA A 386 308.341 199.486 191.689 1.00 0.39 H new ATOM 188 N GLY A 387 307.438 199.152 188.692 1.00 0.19 N ATOM 189 CA GLY A 387 306.782 199.956 187.671 1.00 0.19 C ATOM 190 C GLY A 387 306.034 201.120 188.308 1.00 0.20 C ATOM 191 O GLY A 387 305.135 201.699 187.698 1.00 0.20 O ATOM 0 H GLY A 387 308.451 199.087 188.590 1.00 0.19 H new ATOM 0 HA2 GLY A 387 307.522 200.334 186.966 1.00 0.19 H new ATOM 0 HA3 GLY A 387 306.088 199.337 187.103 1.00 0.19 H new ATOM 195 N MET A 388 306.398 201.450 189.545 1.00 0.21 N ATOM 196 CA MET A 388 305.725 202.540 190.244 1.00 0.24 C ATOM 197 C MET A 388 306.667 203.252 191.216 1.00 0.27 C ATOM 198 O MET A 388 306.985 204.424 191.029 1.00 0.40 O ATOM 199 CB MET A 388 304.511 201.989 191.015 1.00 0.27 C ATOM 200 CG MET A 388 303.334 202.979 190.942 1.00 1.22 C ATOM 201 SD MET A 388 302.370 202.914 192.477 1.00 1.71 S ATOM 202 CE MET A 388 301.257 201.566 192.008 1.00 2.43 C ATOM 0 H MET A 388 307.139 200.990 190.074 1.00 0.21 H new ATOM 0 HA MET A 388 305.397 203.265 189.499 1.00 0.24 H new ATOM 0 HB2 MET A 388 304.212 201.028 190.597 1.00 0.27 H new ATOM 0 HB3 MET A 388 304.783 201.813 192.056 1.00 0.27 H new ATOM 0 HG2 MET A 388 303.708 203.990 190.781 1.00 1.22 H new ATOM 0 HG3 MET A 388 302.696 202.736 190.092 1.00 1.22 H new ATOM 0 HE1 MET A 388 300.568 201.362 192.827 1.00 2.43 H new ATOM 0 HE2 MET A 388 300.692 201.853 191.121 1.00 2.43 H new ATOM 0 HE3 MET A 388 301.840 200.671 191.793 1.00 2.43 H new ATOM 212 N GLY A 389 307.067 202.546 192.271 1.00 0.30 N ATOM 213 CA GLY A 389 307.931 203.122 193.302 1.00 0.33 C ATOM 214 C GLY A 389 308.869 204.189 192.742 1.00 0.26 C ATOM 215 O GLY A 389 308.461 205.323 192.475 1.00 0.32 O ATOM 0 H GLY A 389 306.807 201.573 192.436 1.00 0.30 H new ATOM 0 HA2 GLY A 389 307.314 203.559 194.087 1.00 0.33 H new ATOM 0 HA3 GLY A 389 308.520 202.330 193.764 1.00 0.33 H new ATOM 219 N SER A 390 310.137 203.824 192.594 1.00 0.22 N ATOM 220 CA SER A 390 311.142 204.758 192.101 1.00 0.27 C ATOM 221 C SER A 390 310.821 205.192 190.683 1.00 0.27 C ATOM 222 O SER A 390 311.391 206.157 190.170 1.00 0.27 O ATOM 223 CB SER A 390 312.515 204.102 192.111 1.00 0.35 C ATOM 224 OG SER A 390 312.510 202.991 191.223 1.00 1.34 O ATOM 0 H SER A 390 310.493 202.892 192.807 1.00 0.22 H new ATOM 0 HA SER A 390 311.140 205.630 192.755 1.00 0.27 H new ATOM 0 HB2 SER A 390 313.277 204.821 191.809 1.00 0.35 H new ATOM 0 HB3 SER A 390 312.768 203.775 193.120 1.00 0.35 H new ATOM 0 HG SER A 390 313.393 202.566 191.225 1.00 1.34 H new ATOM 230 N SER A 391 309.931 204.454 190.045 1.00 0.31 N ATOM 231 CA SER A 391 309.562 204.754 188.676 1.00 0.34 C ATOM 232 C SER A 391 308.959 206.149 188.576 1.00 0.31 C ATOM 233 O SER A 391 309.219 206.878 187.614 1.00 0.31 O ATOM 234 CB SER A 391 308.544 203.729 188.178 1.00 0.40 C ATOM 235 OG SER A 391 309.133 202.437 188.191 1.00 0.48 O ATOM 0 H SER A 391 309.454 203.649 190.450 1.00 0.31 H new ATOM 0 HA SER A 391 310.461 204.712 188.061 1.00 0.34 H new ATOM 0 HB2 SER A 391 307.657 203.743 188.811 1.00 0.40 H new ATOM 0 HB3 SER A 391 308.219 203.983 187.169 1.00 0.40 H new ATOM 0 HG SER A 391 309.481 202.245 189.087 1.00 0.48 H new ATOM 241 N ALA A 392 308.112 206.503 189.544 1.00 0.31 N ATOM 242 CA ALA A 392 307.420 207.786 189.520 1.00 0.32 C ATOM 243 C ALA A 392 308.371 208.978 189.619 1.00 0.27 C ATOM 244 O ALA A 392 308.232 209.943 188.868 1.00 0.27 O ATOM 245 CB ALA A 392 306.428 207.845 190.682 1.00 0.35 C ATOM 0 H ALA A 392 307.891 205.919 190.351 1.00 0.31 H new ATOM 0 HA ALA A 392 306.909 207.856 188.560 1.00 0.32 H new ATOM 0 HB1 ALA A 392 305.908 208.803 190.668 1.00 0.35 H new ATOM 0 HB2 ALA A 392 305.703 207.037 190.583 1.00 0.35 H new ATOM 0 HB3 ALA A 392 306.965 207.737 191.625 1.00 0.35 H new ATOM 251 N MET A 393 309.292 208.950 190.583 1.00 0.24 N ATOM 252 CA MET A 393 310.189 210.083 190.792 1.00 0.21 C ATOM 253 C MET A 393 311.127 210.290 189.611 1.00 0.19 C ATOM 254 O MET A 393 311.326 211.422 189.166 1.00 0.19 O ATOM 255 CB MET A 393 311.011 209.872 192.072 1.00 0.22 C ATOM 256 CG MET A 393 310.122 210.102 193.315 1.00 0.30 C ATOM 257 SD MET A 393 311.038 211.022 194.582 1.00 1.24 S ATOM 258 CE MET A 393 311.229 209.665 195.761 1.00 1.94 C ATOM 0 H MET A 393 309.434 208.167 191.222 1.00 0.24 H new ATOM 0 HA MET A 393 309.572 210.976 190.890 1.00 0.21 H new ATOM 0 HB2 MET A 393 311.420 208.862 192.089 1.00 0.22 H new ATOM 0 HB3 MET A 393 311.857 210.559 192.088 1.00 0.22 H new ATOM 0 HG2 MET A 393 309.225 210.654 193.032 1.00 0.30 H new ATOM 0 HG3 MET A 393 309.793 209.144 193.718 1.00 0.30 H new ATOM 0 HE1 MET A 393 311.777 210.017 196.635 1.00 1.94 H new ATOM 0 HE2 MET A 393 310.246 209.309 196.068 1.00 1.94 H new ATOM 0 HE3 MET A 393 311.780 208.850 195.292 1.00 1.94 H new ATOM 268 N GLY A 394 311.724 209.210 189.129 1.00 0.19 N ATOM 269 CA GLY A 394 312.665 209.318 188.021 1.00 0.21 C ATOM 270 C GLY A 394 311.997 209.958 186.814 1.00 0.23 C ATOM 271 O GLY A 394 312.548 210.869 186.195 1.00 0.22 O ATOM 0 H GLY A 394 311.578 208.263 189.480 1.00 0.19 H new ATOM 0 HA2 GLY A 394 313.527 209.913 188.325 1.00 0.21 H new ATOM 0 HA3 GLY A 394 313.038 208.329 187.755 1.00 0.21 H new ATOM 275 N ALA A 395 310.809 209.467 186.488 1.00 0.26 N ATOM 276 CA ALA A 395 310.057 209.981 185.350 1.00 0.30 C ATOM 277 C ALA A 395 309.741 211.467 185.491 1.00 0.26 C ATOM 278 O ALA A 395 309.901 212.232 184.541 1.00 0.27 O ATOM 279 CB ALA A 395 308.755 209.204 185.216 1.00 0.36 C ATOM 0 H ALA A 395 310.345 208.713 186.995 1.00 0.26 H new ATOM 0 HA ALA A 395 310.676 209.856 184.461 1.00 0.30 H new ATOM 0 HB1 ALA A 395 308.189 209.585 184.366 1.00 0.36 H new ATOM 0 HB2 ALA A 395 308.976 208.148 185.061 1.00 0.36 H new ATOM 0 HB3 ALA A 395 308.166 209.321 186.126 1.00 0.36 H new ATOM 285 N GLY A 396 309.239 211.859 186.658 1.00 0.25 N ATOM 286 CA GLY A 396 308.835 213.243 186.881 1.00 0.25 C ATOM 287 C GLY A 396 309.993 214.220 186.706 1.00 0.20 C ATOM 288 O GLY A 396 309.856 215.237 186.028 1.00 0.20 O ATOM 0 H GLY A 396 309.103 211.242 187.459 1.00 0.25 H new ATOM 0 HA2 GLY A 396 308.036 213.502 186.186 1.00 0.25 H new ATOM 0 HA3 GLY A 396 308.428 213.343 187.887 1.00 0.25 H new ATOM 292 N VAL A 397 311.118 213.930 187.345 1.00 0.16 N ATOM 293 CA VAL A 397 312.268 214.824 187.274 1.00 0.13 C ATOM 294 C VAL A 397 312.793 214.941 185.842 1.00 0.14 C ATOM 295 O VAL A 397 313.022 216.046 185.347 1.00 0.13 O ATOM 296 CB VAL A 397 313.371 214.303 188.203 1.00 0.15 C ATOM 297 CG1 VAL A 397 314.671 215.067 187.937 1.00 0.19 C ATOM 298 CG2 VAL A 397 312.942 214.486 189.679 1.00 0.19 C ATOM 0 H VAL A 397 311.260 213.094 187.912 1.00 0.16 H new ATOM 0 HA VAL A 397 311.957 215.819 187.594 1.00 0.13 H new ATOM 0 HB VAL A 397 313.534 213.243 188.010 1.00 0.15 H new ATOM 0 HG11 VAL A 397 315.453 214.695 188.598 1.00 0.19 H new ATOM 0 HG12 VAL A 397 314.973 214.921 186.900 1.00 0.19 H new ATOM 0 HG13 VAL A 397 314.513 216.129 188.123 1.00 0.19 H new ATOM 0 HG21 VAL A 397 313.729 214.114 190.335 1.00 0.19 H new ATOM 0 HG22 VAL A 397 312.771 215.544 189.880 1.00 0.19 H new ATOM 0 HG23 VAL A 397 312.023 213.929 189.863 1.00 0.19 H new ATOM 308 N LEU A 398 312.993 213.803 185.190 1.00 0.17 N ATOM 309 CA LEU A 398 313.505 213.810 183.820 1.00 0.22 C ATOM 310 C LEU A 398 312.547 214.557 182.913 1.00 0.23 C ATOM 311 O LEU A 398 312.949 215.360 182.074 1.00 0.24 O ATOM 312 CB LEU A 398 313.632 212.377 183.299 1.00 0.28 C ATOM 313 CG LEU A 398 314.899 211.719 183.840 1.00 0.31 C ATOM 314 CD1 LEU A 398 314.773 210.204 183.652 1.00 0.36 C ATOM 315 CD2 LEU A 398 316.130 212.242 183.068 1.00 0.36 C ATOM 0 H LEU A 398 312.813 212.876 185.577 1.00 0.17 H new ATOM 0 HA LEU A 398 314.480 214.297 183.822 1.00 0.22 H new ATOM 0 HB2 LEU A 398 312.759 211.797 183.597 1.00 0.28 H new ATOM 0 HB3 LEU A 398 313.655 212.381 182.209 1.00 0.28 H new ATOM 0 HG LEU A 398 315.023 211.956 184.897 1.00 0.31 H new ATOM 0 HD11 LEU A 398 315.669 209.714 184.033 1.00 0.36 H new ATOM 0 HD12 LEU A 398 313.902 209.841 184.197 1.00 0.36 H new ATOM 0 HD13 LEU A 398 314.658 209.977 182.592 1.00 0.36 H new ATOM 0 HD21 LEU A 398 317.032 211.770 183.458 1.00 0.36 H new ATOM 0 HD22 LEU A 398 316.024 212.004 182.010 1.00 0.36 H new ATOM 0 HD23 LEU A 398 316.204 213.322 183.191 1.00 0.36 H new ATOM 327 N ARG A 399 311.278 214.266 183.097 1.00 0.24 N ATOM 328 CA ARG A 399 310.241 214.886 182.298 1.00 0.28 C ATOM 329 C ARG A 399 310.300 216.404 182.408 1.00 0.24 C ATOM 330 O ARG A 399 310.204 217.114 181.408 1.00 0.26 O ATOM 331 CB ARG A 399 308.892 214.407 182.806 1.00 0.34 C ATOM 332 CG ARG A 399 307.777 214.985 181.949 1.00 0.41 C ATOM 333 CD ARG A 399 306.450 214.585 182.566 1.00 0.69 C ATOM 334 NE ARG A 399 305.374 215.030 181.689 1.00 1.44 N ATOM 335 CZ ARG A 399 304.113 215.005 182.078 1.00 2.09 C ATOM 336 NH1 ARG A 399 303.828 214.708 183.320 1.00 2.43 N ATOM 337 NH2 ARG A 399 303.162 215.313 181.241 1.00 3.03 N ATOM 0 H ARG A 399 310.938 213.603 183.794 1.00 0.24 H new ATOM 0 HA ARG A 399 310.386 214.610 181.254 1.00 0.28 H new ATOM 0 HB2 ARG A 399 308.852 213.318 182.783 1.00 0.34 H new ATOM 0 HB3 ARG A 399 308.757 214.709 183.845 1.00 0.34 H new ATOM 0 HG2 ARG A 399 307.861 216.071 181.898 1.00 0.41 H new ATOM 0 HG3 ARG A 399 307.850 214.611 180.928 1.00 0.41 H new ATOM 0 HD2 ARG A 399 306.406 213.504 182.700 1.00 0.69 H new ATOM 0 HD3 ARG A 399 306.342 215.033 183.554 1.00 0.69 H new ATOM 0 HE ARG A 399 305.601 215.368 180.754 1.00 1.44 H new ATOM 0 HH11 ARG A 399 304.578 214.498 183.979 1.00 2.43 H new ATOM 0 HH12 ARG A 399 302.856 214.686 183.629 1.00 2.43 H new ATOM 0 HH21 ARG A 399 303.391 215.574 180.282 1.00 3.03 H new ATOM 0 HH22 ARG A 399 302.189 215.293 181.545 1.00 3.03 H new ATOM 351 N LYS A 400 310.429 216.892 183.633 1.00 0.20 N ATOM 352 CA LYS A 400 310.462 218.327 183.868 1.00 0.19 C ATOM 353 C LYS A 400 311.648 218.974 183.169 1.00 0.15 C ATOM 354 O LYS A 400 311.514 220.028 182.549 1.00 0.16 O ATOM 355 CB LYS A 400 310.540 218.617 185.365 1.00 0.21 C ATOM 356 CG LYS A 400 310.479 220.129 185.575 1.00 0.28 C ATOM 357 CD LYS A 400 310.482 220.451 187.068 1.00 0.82 C ATOM 358 CE LYS A 400 310.403 221.967 187.246 1.00 1.35 C ATOM 359 NZ LYS A 400 310.812 222.330 188.631 1.00 1.96 N ATOM 0 H LYS A 400 310.512 216.320 184.474 1.00 0.20 H new ATOM 0 HA LYS A 400 309.544 218.749 183.460 1.00 0.19 H new ATOM 0 HB2 LYS A 400 309.717 218.129 185.888 1.00 0.21 H new ATOM 0 HB3 LYS A 400 311.464 218.215 185.780 1.00 0.21 H new ATOM 0 HG2 LYS A 400 311.331 220.606 185.090 1.00 0.28 H new ATOM 0 HG3 LYS A 400 309.580 220.533 185.110 1.00 0.28 H new ATOM 0 HD2 LYS A 400 309.637 219.969 187.560 1.00 0.82 H new ATOM 0 HD3 LYS A 400 311.387 220.063 187.536 1.00 0.82 H new ATOM 0 HE2 LYS A 400 311.051 222.462 186.523 1.00 1.35 H new ATOM 0 HE3 LYS A 400 309.388 222.313 187.053 1.00 1.35 H new ATOM 0 HZ1 LYS A 400 310.758 223.362 188.750 1.00 1.96 H new ATOM 0 HZ2 LYS A 400 310.176 221.869 189.313 1.00 1.96 H new ATOM 0 HZ3 LYS A 400 311.788 222.013 188.799 1.00 1.96 H new ATOM 373 N LYS A 401 312.808 218.352 183.287 1.00 0.15 N ATOM 374 CA LYS A 401 314.004 218.906 182.673 1.00 0.19 C ATOM 375 C LYS A 401 313.850 218.973 181.157 1.00 0.21 C ATOM 376 O LYS A 401 314.243 219.951 180.522 1.00 0.22 O ATOM 377 CB LYS A 401 315.213 218.052 183.018 1.00 0.26 C ATOM 378 CG LYS A 401 315.478 218.111 184.521 1.00 0.28 C ATOM 379 CD LYS A 401 316.669 217.209 184.868 1.00 0.36 C ATOM 380 CE LYS A 401 316.975 217.304 186.369 1.00 0.59 C ATOM 381 NZ LYS A 401 318.450 217.322 186.574 1.00 1.42 N ATOM 0 H LYS A 401 312.948 217.478 183.793 1.00 0.15 H new ATOM 0 HA LYS A 401 314.148 219.915 183.060 1.00 0.19 H new ATOM 0 HB2 LYS A 401 315.041 217.021 182.710 1.00 0.26 H new ATOM 0 HB3 LYS A 401 316.087 218.406 182.471 1.00 0.26 H new ATOM 0 HG2 LYS A 401 315.685 219.137 184.824 1.00 0.28 H new ATOM 0 HG3 LYS A 401 314.593 217.789 185.070 1.00 0.28 H new ATOM 0 HD2 LYS A 401 316.446 216.177 184.598 1.00 0.36 H new ATOM 0 HD3 LYS A 401 317.543 217.508 184.290 1.00 0.36 H new ATOM 0 HE2 LYS A 401 316.528 218.206 186.786 1.00 0.59 H new ATOM 0 HE3 LYS A 401 316.534 216.457 186.895 1.00 0.59 H new ATOM 0 HZ1 LYS A 401 318.658 217.386 187.591 1.00 1.42 H new ATOM 0 HZ2 LYS A 401 318.865 216.449 186.190 1.00 1.42 H new ATOM 0 HZ3 LYS A 401 318.859 218.143 186.084 1.00 1.42 H new ATOM 395 N ILE A 402 313.284 217.919 180.586 1.00 0.26 N ATOM 396 CA ILE A 402 313.089 217.846 179.143 1.00 0.34 C ATOM 397 C ILE A 402 312.155 218.950 178.664 1.00 0.31 C ATOM 398 O ILE A 402 312.419 219.610 177.656 1.00 0.32 O ATOM 399 CB ILE A 402 312.491 216.484 178.805 1.00 0.44 C ATOM 400 CG1 ILE A 402 313.538 215.398 179.059 1.00 0.50 C ATOM 401 CG2 ILE A 402 312.054 216.425 177.341 1.00 0.55 C ATOM 402 CD1 ILE A 402 312.880 214.020 178.967 1.00 0.59 C ATOM 0 H ILE A 402 312.952 217.102 181.099 1.00 0.26 H new ATOM 0 HA ILE A 402 314.049 217.976 178.643 1.00 0.34 H new ATOM 0 HB ILE A 402 311.616 216.324 179.435 1.00 0.44 H new ATOM 0 HG12 ILE A 402 314.343 215.477 178.329 1.00 0.50 H new ATOM 0 HG13 ILE A 402 313.986 215.533 180.043 1.00 0.50 H new ATOM 0 HG21 ILE A 402 311.631 215.443 177.127 1.00 0.55 H new ATOM 0 HG22 ILE A 402 311.303 217.192 177.154 1.00 0.55 H new ATOM 0 HG23 ILE A 402 312.916 216.597 176.697 1.00 0.55 H new ATOM 0 HD11 ILE A 402 313.627 213.247 179.148 1.00 0.59 H new ATOM 0 HD12 ILE A 402 312.090 213.943 179.714 1.00 0.59 H new ATOM 0 HD13 ILE A 402 312.453 213.886 177.973 1.00 0.59 H new ATOM 414 N GLN A 403 311.065 219.142 179.392 1.00 0.30 N ATOM 415 CA GLN A 403 310.095 220.168 179.040 1.00 0.34 C ATOM 416 C GLN A 403 310.721 221.552 179.175 1.00 0.27 C ATOM 417 O GLN A 403 310.501 222.433 178.346 1.00 0.29 O ATOM 418 CB GLN A 403 308.873 220.056 179.957 1.00 0.40 C ATOM 419 CG GLN A 403 308.276 218.633 179.873 1.00 0.69 C ATOM 420 CD GLN A 403 306.857 218.677 179.307 1.00 1.45 C ATOM 421 OE1 GLN A 403 306.110 219.616 179.577 1.00 2.25 O ATOM 422 NE2 GLN A 403 306.444 217.713 178.530 1.00 2.11 N ATOM 0 H GLN A 403 310.831 218.604 180.226 1.00 0.30 H new ATOM 0 HA GLN A 403 309.784 220.024 178.005 1.00 0.34 H new ATOM 0 HB2 GLN A 403 309.158 220.279 180.985 1.00 0.40 H new ATOM 0 HB3 GLN A 403 308.122 220.792 179.668 1.00 0.40 H new ATOM 0 HG2 GLN A 403 308.906 218.005 179.242 1.00 0.69 H new ATOM 0 HG3 GLN A 403 308.264 218.179 180.864 1.00 0.69 H new ATOM 0 HE21 GLN A 403 307.066 216.935 178.308 1.00 2.11 H new ATOM 0 HE22 GLN A 403 305.500 217.737 178.145 1.00 2.11 H new ATOM 431 N ASP A 404 311.521 221.725 180.218 1.00 0.22 N ATOM 432 CA ASP A 404 312.196 222.996 180.454 1.00 0.22 C ATOM 433 C ASP A 404 313.140 223.323 179.294 1.00 0.19 C ATOM 434 O ASP A 404 313.307 224.485 178.923 1.00 0.21 O ATOM 435 CB ASP A 404 312.988 222.914 181.779 1.00 0.23 C ATOM 436 CG ASP A 404 312.495 223.941 182.806 1.00 1.10 C ATOM 437 OD1 ASP A 404 311.667 224.768 182.461 1.00 1.74 O ATOM 438 OD2 ASP A 404 312.962 223.882 183.932 1.00 1.37 O ATOM 0 H ASP A 404 311.719 221.005 180.913 1.00 0.22 H new ATOM 0 HA ASP A 404 311.452 223.790 180.524 1.00 0.22 H new ATOM 0 HB2 ASP A 404 312.895 221.911 182.196 1.00 0.23 H new ATOM 0 HB3 ASP A 404 314.047 223.080 181.580 1.00 0.23 H new ATOM 443 N ALA A 405 313.783 222.292 178.758 1.00 0.17 N ATOM 444 CA ALA A 405 314.743 222.479 177.675 1.00 0.19 C ATOM 445 C ALA A 405 314.044 222.808 176.355 1.00 0.19 C ATOM 446 O ALA A 405 314.703 223.020 175.337 1.00 0.21 O ATOM 447 CB ALA A 405 315.592 221.213 177.514 1.00 0.22 C ATOM 0 H ALA A 405 313.659 221.323 179.053 1.00 0.17 H new ATOM 0 HA ALA A 405 315.383 223.323 177.933 1.00 0.19 H new ATOM 0 HB1 ALA A 405 316.308 221.356 176.705 1.00 0.22 H new ATOM 0 HB2 ALA A 405 316.128 221.014 178.442 1.00 0.22 H new ATOM 0 HB3 ALA A 405 314.944 220.368 177.281 1.00 0.22 H new ATOM 453 N GLY A 406 312.718 222.889 176.380 1.00 0.19 N ATOM 454 CA GLY A 406 311.973 223.238 175.175 1.00 0.21 C ATOM 455 C GLY A 406 311.914 222.071 174.198 1.00 0.20 C ATOM 456 O GLY A 406 311.722 222.269 172.998 1.00 0.21 O ATOM 0 H GLY A 406 312.144 222.721 177.206 1.00 0.19 H new ATOM 0 HA2 GLY A 406 310.961 223.539 175.446 1.00 0.21 H new ATOM 0 HA3 GLY A 406 312.442 224.095 174.692 1.00 0.21 H new ATOM 460 N LEU A 407 312.086 220.855 174.707 1.00 0.19 N ATOM 461 CA LEU A 407 312.053 219.677 173.846 1.00 0.20 C ATOM 462 C LEU A 407 310.680 219.019 173.904 1.00 0.20 C ATOM 463 O LEU A 407 310.549 217.868 174.320 1.00 0.19 O ATOM 464 CB LEU A 407 313.115 218.666 174.293 1.00 0.21 C ATOM 465 CG LEU A 407 314.527 219.278 174.211 1.00 0.23 C ATOM 466 CD1 LEU A 407 315.517 218.408 175.006 1.00 0.24 C ATOM 467 CD2 LEU A 407 315.003 219.353 172.745 1.00 0.32 C ATOM 0 H LEU A 407 312.247 220.660 175.695 1.00 0.19 H new ATOM 0 HA LEU A 407 312.260 219.993 172.823 1.00 0.20 H new ATOM 0 HB2 LEU A 407 312.912 218.347 175.315 1.00 0.21 H new ATOM 0 HB3 LEU A 407 313.063 217.776 173.665 1.00 0.21 H new ATOM 0 HG LEU A 407 314.488 220.284 174.630 1.00 0.23 H new ATOM 0 HD11 LEU A 407 316.514 218.844 174.946 1.00 0.24 H new ATOM 0 HD12 LEU A 407 315.204 218.361 176.049 1.00 0.24 H new ATOM 0 HD13 LEU A 407 315.535 217.402 174.587 1.00 0.24 H new ATOM 0 HD21 LEU A 407 316.002 219.788 172.709 1.00 0.32 H new ATOM 0 HD22 LEU A 407 315.028 218.350 172.319 1.00 0.32 H new ATOM 0 HD23 LEU A 407 314.316 219.974 172.171 1.00 0.32 H new ATOM 479 N SER A 408 309.660 219.764 173.494 1.00 0.20 N ATOM 480 CA SER A 408 308.297 219.254 173.518 1.00 0.22 C ATOM 481 C SER A 408 308.175 218.027 172.622 1.00 0.22 C ATOM 482 O SER A 408 307.188 217.295 172.689 1.00 0.24 O ATOM 483 CB SER A 408 307.330 220.334 173.034 1.00 0.24 C ATOM 484 OG SER A 408 307.361 220.390 171.614 1.00 1.33 O ATOM 0 H SER A 408 309.751 220.717 173.143 1.00 0.20 H new ATOM 0 HA SER A 408 308.048 218.974 174.542 1.00 0.22 H new ATOM 0 HB2 SER A 408 306.320 220.115 173.379 1.00 0.24 H new ATOM 0 HB3 SER A 408 307.607 221.301 173.454 1.00 0.24 H new ATOM 0 HG SER A 408 306.741 221.081 171.300 1.00 1.33 H new ATOM 490 N GLN A 409 309.166 217.826 171.757 1.00 0.22 N ATOM 491 CA GLN A 409 309.135 216.707 170.823 1.00 0.24 C ATOM 492 C GLN A 409 309.467 215.396 171.528 1.00 0.24 C ATOM 493 O GLN A 409 309.099 214.319 171.059 1.00 0.28 O ATOM 494 CB GLN A 409 310.141 216.944 169.697 1.00 0.24 C ATOM 495 CG GLN A 409 309.780 218.234 168.961 1.00 0.28 C ATOM 496 CD GLN A 409 310.610 218.360 167.690 1.00 1.35 C ATOM 497 OE1 GLN A 409 311.675 217.753 167.577 1.00 2.21 O ATOM 498 NE2 GLN A 409 310.180 219.115 166.717 1.00 2.02 N ATOM 0 H GLN A 409 309.993 218.418 171.684 1.00 0.22 H new ATOM 0 HA GLN A 409 308.128 216.636 170.412 1.00 0.24 H new ATOM 0 HB2 GLN A 409 311.150 217.014 170.104 1.00 0.24 H new ATOM 0 HB3 GLN A 409 310.134 216.102 169.004 1.00 0.24 H new ATOM 0 HG2 GLN A 409 308.719 218.236 168.713 1.00 0.28 H new ATOM 0 HG3 GLN A 409 309.958 219.093 169.608 1.00 0.28 H new ATOM 0 HE21 GLN A 409 309.297 219.617 166.813 1.00 2.02 H new ATOM 0 HE22 GLN A 409 310.726 219.203 165.860 1.00 2.02 H new ATOM 507 N ILE A 410 310.148 215.492 172.662 1.00 0.21 N ATOM 508 CA ILE A 410 310.498 214.297 173.418 1.00 0.22 C ATOM 509 C ILE A 410 309.370 213.943 174.382 1.00 0.23 C ATOM 510 O ILE A 410 308.828 214.813 175.063 1.00 0.23 O ATOM 511 CB ILE A 410 311.801 214.507 174.199 1.00 0.21 C ATOM 512 CG1 ILE A 410 312.939 214.802 173.211 1.00 0.25 C ATOM 513 CG2 ILE A 410 312.133 213.239 175.018 1.00 0.23 C ATOM 514 CD1 ILE A 410 314.216 215.172 173.975 1.00 0.27 C ATOM 0 H ILE A 410 310.465 216.370 173.074 1.00 0.21 H new ATOM 0 HA ILE A 410 310.645 213.477 172.715 1.00 0.22 H new ATOM 0 HB ILE A 410 311.684 215.348 174.883 1.00 0.21 H new ATOM 0 HG12 ILE A 410 313.121 213.930 172.583 1.00 0.25 H new ATOM 0 HG13 ILE A 410 312.653 215.618 172.548 1.00 0.25 H new ATOM 0 HG21 ILE A 410 313.060 213.395 175.570 1.00 0.23 H new ATOM 0 HG22 ILE A 410 311.323 213.036 175.718 1.00 0.23 H new ATOM 0 HG23 ILE A 410 312.251 212.391 174.344 1.00 0.23 H new ATOM 0 HD11 ILE A 410 315.017 215.379 173.266 1.00 0.27 H new ATOM 0 HD12 ILE A 410 314.032 216.057 174.584 1.00 0.27 H new ATOM 0 HD13 ILE A 410 314.508 214.343 174.619 1.00 0.27 H new ATOM 526 N SER A 411 309.006 212.664 174.417 1.00 0.26 N ATOM 527 CA SER A 411 307.920 212.201 175.279 1.00 0.29 C ATOM 528 C SER A 411 308.471 211.383 176.441 1.00 0.23 C ATOM 529 O SER A 411 309.479 210.690 176.293 1.00 0.34 O ATOM 530 CB SER A 411 306.944 211.350 174.468 1.00 0.45 C ATOM 531 OG SER A 411 306.263 210.457 175.339 1.00 1.43 O ATOM 0 H SER A 411 309.445 211.931 173.860 1.00 0.26 H new ATOM 0 HA SER A 411 307.399 213.070 175.680 1.00 0.29 H new ATOM 0 HB2 SER A 411 306.228 211.990 173.952 1.00 0.45 H new ATOM 0 HB3 SER A 411 307.481 210.790 173.702 1.00 0.45 H new ATOM 0 HG SER A 411 305.635 209.911 174.822 1.00 1.43 H new ATOM 537 N VAL A 412 307.819 211.488 177.600 1.00 0.22 N ATOM 538 CA VAL A 412 308.267 210.771 178.795 1.00 0.22 C ATOM 539 C VAL A 412 307.130 210.029 179.484 1.00 0.22 C ATOM 540 O VAL A 412 306.099 210.609 179.825 1.00 0.27 O ATOM 541 CB VAL A 412 308.905 211.759 179.781 1.00 0.34 C ATOM 542 CG1 VAL A 412 308.954 211.157 181.195 1.00 1.33 C ATOM 543 CG2 VAL A 412 310.329 212.055 179.329 1.00 1.21 C ATOM 0 H VAL A 412 306.985 212.058 177.737 1.00 0.22 H new ATOM 0 HA VAL A 412 308.999 210.029 178.475 1.00 0.22 H new ATOM 0 HB VAL A 412 308.308 212.670 179.802 1.00 0.34 H new ATOM 0 HG11 VAL A 412 309.410 211.873 181.879 1.00 1.33 H new ATOM 0 HG12 VAL A 412 307.942 210.929 181.529 1.00 1.33 H new ATOM 0 HG13 VAL A 412 309.546 210.242 181.180 1.00 1.33 H new ATOM 0 HG21 VAL A 412 310.793 212.756 180.023 1.00 1.21 H new ATOM 0 HG22 VAL A 412 310.905 211.130 179.310 1.00 1.21 H new ATOM 0 HG23 VAL A 412 310.310 212.491 178.330 1.00 1.21 H new ATOM 553 N THR A 413 307.374 208.752 179.743 1.00 0.21 N ATOM 554 CA THR A 413 306.410 207.930 180.467 1.00 0.24 C ATOM 555 C THR A 413 307.132 206.881 181.303 1.00 0.20 C ATOM 556 O THR A 413 308.345 206.719 181.202 1.00 0.22 O ATOM 557 CB THR A 413 305.444 207.251 179.496 1.00 0.28 C ATOM 558 OG1 THR A 413 306.077 206.126 178.906 1.00 0.28 O ATOM 559 CG2 THR A 413 305.030 208.243 178.409 1.00 0.32 C ATOM 0 H THR A 413 308.225 208.263 179.465 1.00 0.21 H new ATOM 0 HA THR A 413 305.838 208.578 181.130 1.00 0.24 H new ATOM 0 HB THR A 413 304.557 206.921 180.036 1.00 0.28 H new ATOM 0 HG1 THR A 413 305.457 205.690 178.285 1.00 0.28 H new ATOM 0 HG21 THR A 413 304.341 207.758 177.717 1.00 0.32 H new ATOM 0 HG22 THR A 413 304.539 209.101 178.868 1.00 0.32 H new ATOM 0 HG23 THR A 413 305.914 208.578 177.866 1.00 0.32 H new ATOM 567 N ASN A 414 306.384 206.159 182.128 1.00 0.22 N ATOM 568 CA ASN A 414 306.975 205.110 182.952 1.00 0.21 C ATOM 569 C ASN A 414 306.096 203.873 182.922 1.00 0.20 C ATOM 570 O ASN A 414 304.885 203.966 182.727 1.00 0.23 O ATOM 571 CB ASN A 414 307.141 205.587 184.394 1.00 0.26 C ATOM 572 CG ASN A 414 305.784 205.901 185.012 1.00 0.75 C ATOM 573 OD1 ASN A 414 304.749 205.705 184.376 1.00 1.33 O ATOM 574 ND2 ASN A 414 305.729 206.381 186.224 1.00 0.99 N ATOM 0 H ASN A 414 305.378 206.278 182.245 1.00 0.22 H new ATOM 0 HA ASN A 414 307.958 204.867 182.549 1.00 0.21 H new ATOM 0 HB2 ASN A 414 307.646 204.820 184.981 1.00 0.26 H new ATOM 0 HB3 ASN A 414 307.773 206.475 184.419 1.00 0.26 H new ATOM 0 HD21 ASN A 414 304.826 206.595 186.647 1.00 0.99 H new ATOM 0 HD22 ASN A 414 306.589 206.542 186.748 1.00 0.99 H new ATOM 581 N SER A 415 306.711 202.714 183.110 1.00 0.19 N ATOM 582 CA SER A 415 305.974 201.463 183.095 1.00 0.20 C ATOM 583 C SER A 415 306.834 200.343 183.667 1.00 0.19 C ATOM 584 O SER A 415 308.047 200.491 183.811 1.00 0.19 O ATOM 585 CB SER A 415 305.551 201.128 181.660 1.00 0.23 C ATOM 586 OG SER A 415 305.937 199.796 181.350 1.00 1.38 O ATOM 0 H SER A 415 307.713 202.616 183.274 1.00 0.19 H new ATOM 0 HA SER A 415 305.081 201.566 183.712 1.00 0.20 H new ATOM 0 HB2 SER A 415 304.472 201.239 181.552 1.00 0.23 H new ATOM 0 HB3 SER A 415 306.015 201.824 180.961 1.00 0.23 H new ATOM 0 HG SER A 415 306.478 199.794 180.533 1.00 1.38 H new ATOM 592 N ALA A 416 306.201 199.225 183.993 1.00 0.20 N ATOM 593 CA ALA A 416 306.920 198.086 184.552 1.00 0.20 C ATOM 594 C ALA A 416 307.907 197.521 183.526 1.00 0.22 C ATOM 595 O ALA A 416 307.705 197.655 182.320 1.00 0.22 O ATOM 596 CB ALA A 416 305.913 197.003 184.978 1.00 0.23 C ATOM 0 H ALA A 416 305.197 199.081 183.882 1.00 0.20 H new ATOM 0 HA ALA A 416 307.485 198.414 185.424 1.00 0.20 H new ATOM 0 HB1 ALA A 416 306.450 196.151 185.396 1.00 0.23 H new ATOM 0 HB2 ALA A 416 305.237 197.410 185.730 1.00 0.23 H new ATOM 0 HB3 ALA A 416 305.338 196.679 184.110 1.00 0.23 H new ATOM 602 N ILE A 417 308.967 196.880 184.010 1.00 0.24 N ATOM 603 CA ILE A 417 309.964 196.298 183.114 1.00 0.28 C ATOM 604 C ILE A 417 309.302 195.278 182.202 1.00 0.30 C ATOM 605 O ILE A 417 309.596 195.219 181.008 1.00 0.32 O ATOM 606 CB ILE A 417 311.080 195.625 183.921 1.00 0.31 C ATOM 607 CG1 ILE A 417 311.878 196.693 184.663 1.00 0.33 C ATOM 608 CG2 ILE A 417 312.040 194.865 182.994 1.00 0.36 C ATOM 609 CD1 ILE A 417 312.863 196.027 185.620 1.00 0.37 C ATOM 0 H ILE A 417 309.158 196.751 185.004 1.00 0.24 H new ATOM 0 HA ILE A 417 310.400 197.094 182.510 1.00 0.28 H new ATOM 0 HB ILE A 417 310.623 194.925 184.621 1.00 0.31 H new ATOM 0 HG12 ILE A 417 312.415 197.320 183.951 1.00 0.33 H new ATOM 0 HG13 ILE A 417 311.203 197.346 185.217 1.00 0.33 H new ATOM 0 HG21 ILE A 417 312.824 194.395 183.588 1.00 0.36 H new ATOM 0 HG22 ILE A 417 311.489 194.098 182.449 1.00 0.36 H new ATOM 0 HG23 ILE A 417 312.489 195.561 182.286 1.00 0.36 H new ATOM 0 HD11 ILE A 417 313.431 196.793 186.148 1.00 0.37 H new ATOM 0 HD12 ILE A 417 312.316 195.419 186.341 1.00 0.37 H new ATOM 0 HD13 ILE A 417 313.546 195.393 185.055 1.00 0.37 H new ATOM 621 N ASN A 418 308.414 194.468 182.764 1.00 0.30 N ATOM 622 CA ASN A 418 307.734 193.452 181.976 1.00 0.33 C ATOM 623 C ASN A 418 307.056 194.096 180.775 1.00 0.35 C ATOM 624 O ASN A 418 306.717 193.416 179.807 1.00 0.38 O ATOM 625 CB ASN A 418 306.673 192.736 182.829 1.00 0.34 C ATOM 626 CG ASN A 418 307.264 191.519 183.543 1.00 1.27 C ATOM 627 OD1 ASN A 418 308.221 190.830 182.981 1.00 1.87 O flip ATOM 628 ND2 ASN A 418 306.827 191.178 184.642 1.00 2.02 N flip ATOM 0 H ASN A 418 308.151 194.494 183.749 1.00 0.30 H new ATOM 0 HA ASN A 418 308.473 192.726 181.636 1.00 0.33 H new ATOM 0 HB2 ASN A 418 306.266 193.430 183.564 1.00 0.34 H new ATOM 0 HB3 ASN A 418 305.845 192.421 182.194 1.00 0.34 H new ATOM 0 HD21 ASN A 418 306.080 191.715 185.083 1.00 2.02 H new ATOM 0 HD22 ASN A 418 307.212 190.359 185.112 1.00 2.02 H new ATOM 635 N ASN A 419 306.843 195.411 180.845 1.00 0.33 N ATOM 636 CA ASN A 419 306.184 196.135 179.765 1.00 0.37 C ATOM 637 C ASN A 419 307.082 197.248 179.207 1.00 0.38 C ATOM 638 O ASN A 419 307.089 198.363 179.727 1.00 0.42 O ATOM 639 CB ASN A 419 304.874 196.745 180.306 1.00 0.39 C ATOM 640 CG ASN A 419 303.644 196.142 179.624 1.00 1.22 C ATOM 641 OD1 ASN A 419 303.750 195.514 178.571 1.00 2.00 O ATOM 642 ND2 ASN A 419 302.470 196.310 180.168 1.00 1.88 N ATOM 0 H ASN A 419 307.118 195.992 181.637 1.00 0.33 H new ATOM 0 HA ASN A 419 305.974 195.439 178.953 1.00 0.37 H new ATOM 0 HB2 ASN A 419 304.812 196.578 181.381 1.00 0.39 H new ATOM 0 HB3 ASN A 419 304.884 197.824 180.151 1.00 0.39 H new ATOM 0 HD21 ASN A 419 301.640 195.921 179.720 1.00 1.88 H new ATOM 0 HD22 ASN A 419 302.382 196.830 181.041 1.00 1.88 H new ATOM 649 N LEU A 420 307.766 196.967 178.101 1.00 0.37 N ATOM 650 CA LEU A 420 308.576 197.986 177.431 1.00 0.39 C ATOM 651 C LEU A 420 308.408 197.841 175.916 1.00 0.41 C ATOM 652 O LEU A 420 308.828 196.833 175.347 1.00 0.63 O ATOM 653 CB LEU A 420 310.062 197.848 177.777 1.00 0.40 C ATOM 654 CG LEU A 420 310.286 198.106 179.274 1.00 0.41 C ATOM 655 CD1 LEU A 420 311.750 197.809 179.639 1.00 0.44 C ATOM 656 CD2 LEU A 420 309.962 199.578 179.603 1.00 0.51 C ATOM 0 H LEU A 420 307.778 196.052 177.651 1.00 0.37 H new ATOM 0 HA LEU A 420 308.235 198.964 177.771 1.00 0.39 H new ATOM 0 HB2 LEU A 420 310.412 196.849 177.517 1.00 0.40 H new ATOM 0 HB3 LEU A 420 310.647 198.554 177.188 1.00 0.40 H new ATOM 0 HG LEU A 420 309.630 197.454 179.851 1.00 0.41 H new ATOM 0 HD11 LEU A 420 311.905 197.993 180.702 1.00 0.44 H new ATOM 0 HD12 LEU A 420 311.977 196.767 179.415 1.00 0.44 H new ATOM 0 HD13 LEU A 420 312.408 198.456 179.059 1.00 0.44 H new ATOM 0 HD21 LEU A 420 310.122 199.757 180.666 1.00 0.51 H new ATOM 0 HD22 LEU A 420 310.613 200.232 179.023 1.00 0.51 H new ATOM 0 HD23 LEU A 420 308.922 199.786 179.353 1.00 0.51 H new ATOM 668 N PRO A 421 307.796 198.791 175.247 1.00 0.30 N ATOM 669 CA PRO A 421 307.590 198.684 173.780 1.00 0.32 C ATOM 670 C PRO A 421 308.930 198.572 173.034 1.00 0.31 C ATOM 671 O PRO A 421 309.877 199.288 173.357 1.00 0.36 O ATOM 672 CB PRO A 421 306.829 199.961 173.379 1.00 0.37 C ATOM 673 CG PRO A 421 306.655 200.795 174.619 1.00 0.77 C ATOM 674 CD PRO A 421 307.257 200.039 175.807 1.00 0.45 C ATOM 0 HA PRO A 421 307.031 197.786 173.518 1.00 0.32 H new ATOM 0 HB2 PRO A 421 307.382 200.514 172.620 1.00 0.37 H new ATOM 0 HB3 PRO A 421 305.860 199.710 172.947 1.00 0.37 H new ATOM 0 HG2 PRO A 421 307.146 201.760 174.497 1.00 0.77 H new ATOM 0 HG3 PRO A 421 305.598 200.995 174.795 1.00 0.77 H new ATOM 0 HD2 PRO A 421 308.041 200.624 176.288 1.00 0.45 H new ATOM 0 HD3 PRO A 421 306.501 199.834 176.565 1.00 0.45 H new ATOM 682 N PRO A 422 309.036 197.698 172.056 1.00 0.31 N ATOM 683 CA PRO A 422 310.305 197.528 171.292 1.00 0.33 C ATOM 684 C PRO A 422 310.716 198.803 170.549 1.00 0.35 C ATOM 685 O PRO A 422 311.861 198.926 170.114 1.00 0.45 O ATOM 686 CB PRO A 422 310.029 196.388 170.291 1.00 0.36 C ATOM 687 CG PRO A 422 308.576 196.024 170.409 1.00 0.67 C ATOM 688 CD PRO A 422 307.978 196.782 171.598 1.00 0.40 C ATOM 0 HA PRO A 422 311.131 197.303 171.966 1.00 0.33 H new ATOM 0 HB2 PRO A 422 310.263 196.705 169.275 1.00 0.36 H new ATOM 0 HB3 PRO A 422 310.659 195.526 170.509 1.00 0.36 H new ATOM 0 HG2 PRO A 422 308.046 196.280 169.492 1.00 0.67 H new ATOM 0 HG3 PRO A 422 308.466 194.949 170.551 1.00 0.67 H new ATOM 0 HD2 PRO A 422 307.084 197.332 171.303 1.00 0.40 H new ATOM 0 HD3 PRO A 422 307.683 196.096 172.392 1.00 0.40 H new ATOM 696 N ASP A 423 309.777 199.726 170.365 1.00 0.31 N ATOM 697 CA ASP A 423 310.080 200.946 169.623 1.00 0.34 C ATOM 698 C ASP A 423 310.773 201.984 170.502 1.00 0.30 C ATOM 699 O ASP A 423 311.168 203.042 170.012 1.00 0.30 O ATOM 700 CB ASP A 423 308.793 201.563 169.072 1.00 0.39 C ATOM 701 CG ASP A 423 307.913 200.487 168.447 1.00 1.43 C ATOM 702 OD1 ASP A 423 308.360 199.355 168.366 1.00 2.33 O ATOM 703 OD2 ASP A 423 306.803 200.812 168.059 1.00 1.72 O ATOM 0 H ASP A 423 308.820 199.657 170.711 1.00 0.31 H new ATOM 0 HA ASP A 423 310.749 200.668 168.809 1.00 0.34 H new ATOM 0 HB2 ASP A 423 308.251 202.065 169.873 1.00 0.39 H new ATOM 0 HB3 ASP A 423 309.035 202.321 168.327 1.00 0.39 H new ATOM 708 N VAL A 424 310.913 201.705 171.798 1.00 0.28 N ATOM 709 CA VAL A 424 311.547 202.660 172.700 1.00 0.25 C ATOM 710 C VAL A 424 313.004 202.880 172.307 1.00 0.22 C ATOM 711 O VAL A 424 313.715 201.936 171.962 1.00 0.21 O ATOM 712 CB VAL A 424 311.457 202.162 174.151 1.00 0.26 C ATOM 713 CG1 VAL A 424 312.347 200.926 174.346 1.00 0.24 C ATOM 714 CG2 VAL A 424 311.900 203.280 175.111 1.00 0.25 C ATOM 0 H VAL A 424 310.601 200.840 172.239 1.00 0.28 H new ATOM 0 HA VAL A 424 311.020 203.611 172.622 1.00 0.25 H new ATOM 0 HB VAL A 424 310.424 201.888 174.367 1.00 0.26 H new ATOM 0 HG11 VAL A 424 312.274 200.584 175.378 1.00 0.24 H new ATOM 0 HG12 VAL A 424 312.018 200.131 173.676 1.00 0.24 H new ATOM 0 HG13 VAL A 424 313.382 201.184 174.122 1.00 0.24 H new ATOM 0 HG21 VAL A 424 311.835 202.924 176.139 1.00 0.25 H new ATOM 0 HG22 VAL A 424 312.929 203.563 174.889 1.00 0.25 H new ATOM 0 HG23 VAL A 424 311.250 204.146 174.985 1.00 0.25 H new ATOM 724 N ASP A 425 313.434 204.136 172.350 1.00 0.20 N ATOM 725 CA ASP A 425 314.804 204.477 171.986 1.00 0.18 C ATOM 726 C ASP A 425 315.702 204.522 173.217 1.00 0.13 C ATOM 727 O ASP A 425 316.845 204.061 173.178 1.00 0.13 O ATOM 728 CB ASP A 425 314.825 205.833 171.280 1.00 0.21 C ATOM 729 CG ASP A 425 314.203 205.699 169.894 1.00 0.93 C ATOM 730 OD1 ASP A 425 314.126 204.583 169.408 1.00 1.62 O ATOM 731 OD2 ASP A 425 313.804 206.711 169.344 1.00 1.32 O ATOM 0 H ASP A 425 312.858 204.930 172.631 1.00 0.20 H new ATOM 0 HA ASP A 425 315.184 203.707 171.314 1.00 0.18 H new ATOM 0 HB2 ASP A 425 314.275 206.568 171.867 1.00 0.21 H new ATOM 0 HB3 ASP A 425 315.850 206.195 171.196 1.00 0.21 H new ATOM 736 N LEU A 426 315.181 205.076 174.310 1.00 0.14 N ATOM 737 CA LEU A 426 315.951 205.176 175.549 1.00 0.15 C ATOM 738 C LEU A 426 315.218 204.517 176.705 1.00 0.14 C ATOM 739 O LEU A 426 314.039 204.782 176.943 1.00 0.15 O ATOM 740 CB LEU A 426 316.192 206.645 175.915 1.00 0.19 C ATOM 741 CG LEU A 426 317.102 207.326 174.892 1.00 0.35 C ATOM 742 CD1 LEU A 426 316.937 208.840 175.027 1.00 0.30 C ATOM 743 CD2 LEU A 426 318.571 206.969 175.165 1.00 0.60 C ATOM 0 H LEU A 426 314.237 205.460 174.364 1.00 0.14 H new ATOM 0 HA LEU A 426 316.900 204.668 175.379 1.00 0.15 H new ATOM 0 HB2 LEU A 426 315.239 207.171 175.965 1.00 0.19 H new ATOM 0 HB3 LEU A 426 316.643 206.707 176.905 1.00 0.19 H new ATOM 0 HG LEU A 426 316.831 206.991 173.891 1.00 0.35 H new ATOM 0 HD11 LEU A 426 317.580 209.342 174.304 1.00 0.30 H new ATOM 0 HD12 LEU A 426 315.898 209.111 174.839 1.00 0.30 H new ATOM 0 HD13 LEU A 426 317.215 209.148 176.035 1.00 0.30 H new ATOM 0 HD21 LEU A 426 319.208 207.461 174.429 1.00 0.60 H new ATOM 0 HD22 LEU A 426 318.847 207.304 176.165 1.00 0.60 H new ATOM 0 HD23 LEU A 426 318.702 205.889 175.095 1.00 0.60 H new ATOM 755 N VAL A 427 315.949 203.705 177.457 1.00 0.15 N ATOM 756 CA VAL A 427 315.395 203.056 178.634 1.00 0.16 C ATOM 757 C VAL A 427 316.238 203.415 179.852 1.00 0.15 C ATOM 758 O VAL A 427 317.463 203.290 179.826 1.00 0.15 O ATOM 759 CB VAL A 427 315.384 201.546 178.434 1.00 0.19 C ATOM 760 CG1 VAL A 427 315.033 200.869 179.753 1.00 0.23 C ATOM 761 CG2 VAL A 427 314.339 201.177 177.378 1.00 0.26 C ATOM 0 H VAL A 427 316.927 203.481 177.272 1.00 0.15 H new ATOM 0 HA VAL A 427 314.372 203.397 178.791 1.00 0.16 H new ATOM 0 HB VAL A 427 316.367 201.214 178.101 1.00 0.19 H new ATOM 0 HG11 VAL A 427 315.024 199.788 179.616 1.00 0.23 H new ATOM 0 HG12 VAL A 427 315.775 201.133 180.506 1.00 0.23 H new ATOM 0 HG13 VAL A 427 314.048 201.202 180.082 1.00 0.23 H new ATOM 0 HG21 VAL A 427 314.332 200.096 177.235 1.00 0.26 H new ATOM 0 HG22 VAL A 427 313.354 201.506 177.710 1.00 0.26 H new ATOM 0 HG23 VAL A 427 314.586 201.666 176.435 1.00 0.26 H new ATOM 771 N ILE A 428 315.583 203.889 180.907 1.00 0.16 N ATOM 772 CA ILE A 428 316.292 204.296 182.119 1.00 0.16 C ATOM 773 C ILE A 428 315.813 203.480 183.316 1.00 0.18 C ATOM 774 O ILE A 428 314.646 203.558 183.695 1.00 0.20 O ATOM 775 CB ILE A 428 316.026 205.781 182.372 1.00 0.18 C ATOM 776 CG1 ILE A 428 316.531 206.597 181.178 1.00 0.19 C ATOM 777 CG2 ILE A 428 316.755 206.226 183.640 1.00 0.20 C ATOM 778 CD1 ILE A 428 316.019 208.032 181.282 1.00 0.21 C ATOM 0 H ILE A 428 314.570 204.001 180.950 1.00 0.16 H new ATOM 0 HA ILE A 428 317.360 204.123 181.986 1.00 0.16 H new ATOM 0 HB ILE A 428 314.955 205.942 182.498 1.00 0.18 H new ATOM 0 HG12 ILE A 428 317.621 206.590 181.155 1.00 0.19 H new ATOM 0 HG13 ILE A 428 316.190 206.146 180.246 1.00 0.19 H new ATOM 0 HG21 ILE A 428 316.563 207.284 183.817 1.00 0.20 H new ATOM 0 HG22 ILE A 428 316.396 205.645 184.489 1.00 0.20 H new ATOM 0 HG23 ILE A 428 317.826 206.067 183.519 1.00 0.20 H new ATOM 0 HD11 ILE A 428 316.380 208.610 180.431 1.00 0.21 H new ATOM 0 HD12 ILE A 428 314.929 208.030 181.283 1.00 0.21 H new ATOM 0 HD13 ILE A 428 316.382 208.482 182.206 1.00 0.21 H new ATOM 790 N THR A 429 316.710 202.696 183.917 1.00 0.17 N ATOM 791 CA THR A 429 316.331 201.880 185.078 1.00 0.18 C ATOM 792 C THR A 429 317.465 201.828 186.091 1.00 0.17 C ATOM 793 O THR A 429 318.589 202.244 185.807 1.00 0.18 O ATOM 794 CB THR A 429 316.004 200.428 184.683 1.00 0.19 C ATOM 795 OG1 THR A 429 317.210 199.680 184.647 1.00 0.71 O ATOM 796 CG2 THR A 429 315.324 200.348 183.311 1.00 0.61 C ATOM 0 H THR A 429 317.684 202.607 183.629 1.00 0.17 H new ATOM 0 HA THR A 429 315.446 202.352 185.505 1.00 0.18 H new ATOM 0 HB THR A 429 315.314 200.022 185.423 1.00 0.19 H new ATOM 0 HG1 THR A 429 317.100 198.857 185.167 1.00 0.71 H new ATOM 0 HG21 THR A 429 315.111 199.306 183.071 1.00 0.61 H new ATOM 0 HG22 THR A 429 314.392 200.913 183.333 1.00 0.61 H new ATOM 0 HG23 THR A 429 315.985 200.767 182.552 1.00 0.61 H new ATOM 804 N HIS A 430 317.176 201.259 187.259 1.00 0.19 N ATOM 805 CA HIS A 430 318.195 201.097 188.284 1.00 0.20 C ATOM 806 C HIS A 430 319.158 199.985 187.873 1.00 0.19 C ATOM 807 O HIS A 430 318.744 198.955 187.336 1.00 0.17 O ATOM 808 CB HIS A 430 317.551 200.759 189.631 1.00 0.23 C ATOM 809 CG HIS A 430 318.591 200.837 190.717 1.00 0.25 C ATOM 810 ND1 HIS A 430 319.462 199.794 190.980 1.00 0.32 N ATOM 811 CD2 HIS A 430 318.912 201.828 191.613 1.00 0.35 C ATOM 812 CE1 HIS A 430 320.259 200.175 191.995 1.00 0.33 C ATOM 813 NE2 HIS A 430 319.966 201.407 192.419 1.00 0.35 N ATOM 0 H HIS A 430 316.253 200.907 187.514 1.00 0.19 H new ATOM 0 HA HIS A 430 318.744 202.033 188.389 1.00 0.20 H new ATOM 0 HB2 HIS A 430 316.737 201.453 189.841 1.00 0.23 H new ATOM 0 HB3 HIS A 430 317.118 199.759 189.599 1.00 0.23 H new ATOM 0 HD2 HIS A 430 318.421 202.788 191.682 1.00 0.35 H new ATOM 0 HE1 HIS A 430 321.040 199.559 192.416 1.00 0.33 H new ATOM 0 HE2 HIS A 430 320.417 201.927 193.171 1.00 0.35 H new ATOM 821 N ARG A 431 320.443 200.231 188.071 1.00 0.21 N ATOM 822 CA ARG A 431 321.479 199.286 187.670 1.00 0.22 C ATOM 823 C ARG A 431 321.117 197.852 188.040 1.00 0.21 C ATOM 824 O ARG A 431 321.490 196.911 187.340 1.00 0.21 O ATOM 825 CB ARG A 431 322.789 199.663 188.340 1.00 0.27 C ATOM 826 CG ARG A 431 323.899 198.776 187.798 1.00 0.30 C ATOM 827 CD ARG A 431 325.202 199.132 188.498 1.00 0.40 C ATOM 828 NE ARG A 431 326.323 198.560 187.777 1.00 1.33 N ATOM 829 CZ ARG A 431 327.558 198.978 188.012 1.00 1.98 C ATOM 830 NH1 ARG A 431 327.779 199.838 188.970 1.00 2.26 N ATOM 831 NH2 ARG A 431 328.549 198.524 187.296 1.00 2.96 N ATOM 0 H ARG A 431 320.797 201.081 188.509 1.00 0.21 H new ATOM 0 HA ARG A 431 321.576 199.336 186.585 1.00 0.22 H new ATOM 0 HB2 ARG A 431 323.020 200.711 188.151 1.00 0.27 H new ATOM 0 HB3 ARG A 431 322.707 199.544 189.420 1.00 0.27 H new ATOM 0 HG2 ARG A 431 323.657 197.726 187.964 1.00 0.30 H new ATOM 0 HG3 ARG A 431 324.000 198.914 186.721 1.00 0.30 H new ATOM 0 HD2 ARG A 431 325.310 200.215 188.555 1.00 0.40 H new ATOM 0 HD3 ARG A 431 325.188 198.759 189.522 1.00 0.40 H new ATOM 0 HE ARG A 431 326.159 197.830 187.084 1.00 1.33 H new ATOM 0 HH11 ARG A 431 327.003 200.185 189.533 1.00 2.26 H new ATOM 0 HH12 ARG A 431 328.728 200.163 189.155 1.00 2.26 H new ATOM 0 HH21 ARG A 431 328.374 197.846 186.554 1.00 2.96 H new ATOM 0 HH22 ARG A 431 329.499 198.847 187.478 1.00 2.96 H new ATOM 845 N ASP A 432 320.421 197.685 189.151 1.00 0.21 N ATOM 846 CA ASP A 432 320.071 196.342 189.595 1.00 0.21 C ATOM 847 C ASP A 432 319.122 195.671 188.611 1.00 0.19 C ATOM 848 O ASP A 432 319.010 194.445 188.598 1.00 0.19 O ATOM 849 CB ASP A 432 319.417 196.392 190.994 1.00 0.22 C ATOM 850 CG ASP A 432 320.430 196.075 192.100 1.00 1.27 C ATOM 851 OD1 ASP A 432 321.518 195.622 191.784 1.00 2.05 O ATOM 852 OD2 ASP A 432 320.093 196.281 193.254 1.00 1.53 O ATOM 0 H ASP A 432 320.092 198.441 189.752 1.00 0.21 H new ATOM 0 HA ASP A 432 320.989 195.757 189.647 1.00 0.21 H new ATOM 0 HB2 ASP A 432 318.991 197.381 191.162 1.00 0.22 H new ATOM 0 HB3 ASP A 432 318.594 195.679 191.038 1.00 0.22 H new ATOM 857 N LEU A 433 318.407 196.463 187.816 1.00 0.19 N ATOM 858 CA LEU A 433 317.442 195.899 186.877 1.00 0.18 C ATOM 859 C LEU A 433 317.780 196.260 185.423 1.00 0.17 C ATOM 860 O LEU A 433 317.043 195.898 184.498 1.00 0.18 O ATOM 861 CB LEU A 433 316.049 196.416 187.229 1.00 0.20 C ATOM 862 CG LEU A 433 315.765 196.192 188.722 1.00 0.25 C ATOM 863 CD1 LEU A 433 314.507 196.975 189.112 1.00 0.26 C ATOM 864 CD2 LEU A 433 315.550 194.688 189.012 1.00 0.35 C ATOM 0 H LEU A 433 318.475 197.481 187.802 1.00 0.19 H new ATOM 0 HA LEU A 433 317.477 194.813 186.960 1.00 0.18 H new ATOM 0 HB2 LEU A 433 315.976 197.477 186.992 1.00 0.20 H new ATOM 0 HB3 LEU A 433 315.299 195.903 186.627 1.00 0.20 H new ATOM 0 HG LEU A 433 316.618 196.539 189.305 1.00 0.25 H new ATOM 0 HD11 LEU A 433 314.297 196.822 190.171 1.00 0.26 H new ATOM 0 HD12 LEU A 433 314.666 198.037 188.923 1.00 0.26 H new ATOM 0 HD13 LEU A 433 313.662 196.624 188.520 1.00 0.26 H new ATOM 0 HD21 LEU A 433 315.350 194.547 190.074 1.00 0.35 H new ATOM 0 HD22 LEU A 433 314.703 194.323 188.432 1.00 0.35 H new ATOM 0 HD23 LEU A 433 316.446 194.132 188.735 1.00 0.35 H new ATOM 876 N THR A 434 318.887 196.967 185.214 1.00 0.17 N ATOM 877 CA THR A 434 319.277 197.341 183.854 1.00 0.17 C ATOM 878 C THR A 434 319.564 196.101 183.013 1.00 0.17 C ATOM 879 O THR A 434 319.282 196.083 181.815 1.00 0.17 O ATOM 880 CB THR A 434 320.510 198.252 183.867 1.00 0.19 C ATOM 881 OG1 THR A 434 321.425 197.797 184.852 1.00 0.21 O ATOM 882 CG2 THR A 434 320.102 199.701 184.159 1.00 0.20 C ATOM 0 H THR A 434 319.518 197.287 185.948 1.00 0.17 H new ATOM 0 HA THR A 434 318.444 197.885 183.410 1.00 0.17 H new ATOM 0 HB THR A 434 320.986 198.218 182.887 1.00 0.19 H new ATOM 0 HG1 THR A 434 322.234 198.349 184.827 1.00 0.21 H new ATOM 0 HG21 THR A 434 320.989 200.335 184.165 1.00 0.20 H new ATOM 0 HG22 THR A 434 319.413 200.047 183.388 1.00 0.20 H new ATOM 0 HG23 THR A 434 319.613 199.752 185.132 1.00 0.20 H new ATOM 890 N GLU A 435 320.088 195.054 183.644 1.00 0.18 N ATOM 891 CA GLU A 435 320.355 193.812 182.924 1.00 0.19 C ATOM 892 C GLU A 435 319.071 193.293 182.292 1.00 0.19 C ATOM 893 O GLU A 435 319.058 192.870 181.136 1.00 0.21 O ATOM 894 CB GLU A 435 320.909 192.748 183.876 1.00 0.21 C ATOM 895 CG GLU A 435 322.369 193.054 184.211 1.00 1.31 C ATOM 896 CD GLU A 435 322.886 192.044 185.229 1.00 1.92 C ATOM 897 OE1 GLU A 435 322.106 191.205 185.649 1.00 2.18 O ATOM 898 OE2 GLU A 435 324.055 192.119 185.570 1.00 2.77 O ATOM 0 H GLU A 435 320.333 195.039 184.634 1.00 0.18 H new ATOM 0 HA GLU A 435 321.092 194.017 182.148 1.00 0.19 H new ATOM 0 HB2 GLU A 435 320.316 192.722 184.790 1.00 0.21 H new ATOM 0 HB3 GLU A 435 320.832 191.762 183.417 1.00 0.21 H new ATOM 0 HG2 GLU A 435 322.975 193.015 183.306 1.00 1.31 H new ATOM 0 HG3 GLU A 435 322.456 194.064 184.610 1.00 1.31 H new ATOM 905 N ARG A 436 317.990 193.329 183.064 1.00 0.19 N ATOM 906 CA ARG A 436 316.700 192.854 182.580 1.00 0.21 C ATOM 907 C ARG A 436 316.226 193.648 181.373 1.00 0.21 C ATOM 908 O ARG A 436 315.772 193.072 180.383 1.00 0.22 O ATOM 909 CB ARG A 436 315.646 192.985 183.681 1.00 0.23 C ATOM 910 CG ARG A 436 315.587 191.713 184.517 1.00 1.03 C ATOM 911 CD ARG A 436 314.479 191.874 185.551 1.00 1.06 C ATOM 912 NE ARG A 436 314.308 190.632 186.288 1.00 1.60 N ATOM 913 CZ ARG A 436 313.504 190.566 187.340 1.00 2.07 C ATOM 914 NH1 ARG A 436 312.838 191.624 187.717 1.00 2.33 N ATOM 915 NH2 ARG A 436 313.367 189.441 187.984 1.00 2.92 N ATOM 0 H ARG A 436 317.981 193.680 184.022 1.00 0.19 H new ATOM 0 HA ARG A 436 316.829 191.811 182.292 1.00 0.21 H new ATOM 0 HB2 ARG A 436 315.882 193.836 184.319 1.00 0.23 H new ATOM 0 HB3 ARG A 436 314.670 193.181 183.237 1.00 0.23 H new ATOM 0 HG2 ARG A 436 315.391 190.849 183.882 1.00 1.03 H new ATOM 0 HG3 ARG A 436 316.544 191.537 185.009 1.00 1.03 H new ATOM 0 HD2 ARG A 436 314.725 192.684 186.238 1.00 1.06 H new ATOM 0 HD3 ARG A 436 313.546 192.146 185.058 1.00 1.06 H new ATOM 0 HE ARG A 436 314.815 189.798 185.991 1.00 1.60 H new ATOM 0 HH11 ARG A 436 312.937 192.499 187.202 1.00 2.33 H new ATOM 0 HH12 ARG A 436 312.219 191.575 188.526 1.00 2.33 H new ATOM 0 HH21 ARG A 436 313.878 188.613 187.678 1.00 2.92 H new ATOM 0 HH22 ARG A 436 312.749 189.389 188.794 1.00 2.92 H new ATOM 929 N ALA A 437 316.287 194.971 181.465 1.00 0.20 N ATOM 930 CA ALA A 437 315.810 195.807 180.376 1.00 0.20 C ATOM 931 C ALA A 437 316.650 195.594 179.129 1.00 0.19 C ATOM 932 O ALA A 437 316.122 195.516 178.019 1.00 0.20 O ATOM 933 CB ALA A 437 315.857 197.270 180.791 1.00 0.22 C ATOM 0 H ALA A 437 316.656 195.479 182.269 1.00 0.20 H new ATOM 0 HA ALA A 437 314.781 195.529 180.149 1.00 0.20 H new ATOM 0 HB1 ALA A 437 315.498 197.892 179.971 1.00 0.22 H new ATOM 0 HB2 ALA A 437 315.223 197.421 181.665 1.00 0.22 H new ATOM 0 HB3 ALA A 437 316.883 197.546 181.035 1.00 0.22 H new ATOM 939 N MET A 438 317.958 195.489 179.319 1.00 0.20 N ATOM 940 CA MET A 438 318.859 195.271 178.201 1.00 0.22 C ATOM 941 C MET A 438 318.430 194.023 177.460 1.00 0.23 C ATOM 942 O MET A 438 318.517 193.936 176.236 1.00 0.25 O ATOM 943 CB MET A 438 320.279 195.037 178.722 1.00 0.25 C ATOM 944 CG MET A 438 320.926 196.353 179.147 1.00 0.28 C ATOM 945 SD MET A 438 322.532 195.985 179.903 1.00 0.56 S ATOM 946 CE MET A 438 323.193 197.668 179.927 1.00 1.08 C ATOM 0 H MET A 438 318.414 195.551 180.229 1.00 0.20 H new ATOM 0 HA MET A 438 318.834 196.143 177.547 1.00 0.22 H new ATOM 0 HB2 MET A 438 320.252 194.350 179.568 1.00 0.25 H new ATOM 0 HB3 MET A 438 320.882 194.564 177.947 1.00 0.25 H new ATOM 0 HG2 MET A 438 321.054 197.008 178.285 1.00 0.28 H new ATOM 0 HG3 MET A 438 320.285 196.879 179.855 1.00 0.28 H new ATOM 0 HE1 MET A 438 324.192 197.660 180.363 1.00 1.08 H new ATOM 0 HE2 MET A 438 323.244 198.053 178.909 1.00 1.08 H new ATOM 0 HE3 MET A 438 322.542 198.306 180.524 1.00 1.08 H new ATOM 956 N ARG A 439 318.041 193.031 178.234 1.00 0.23 N ATOM 957 CA ARG A 439 317.681 191.737 177.697 1.00 0.26 C ATOM 958 C ARG A 439 316.449 191.814 176.811 1.00 0.28 C ATOM 959 O ARG A 439 316.416 191.249 175.718 1.00 0.32 O ATOM 960 CB ARG A 439 317.395 190.812 178.876 1.00 0.26 C ATOM 961 CG ARG A 439 317.934 189.426 178.574 1.00 1.13 C ATOM 962 CD ARG A 439 317.737 188.519 179.780 1.00 1.54 C ATOM 963 NE ARG A 439 319.022 187.872 180.027 1.00 2.19 N ATOM 964 CZ ARG A 439 319.135 186.733 180.667 1.00 2.98 C ATOM 965 NH1 ARG A 439 318.061 186.082 181.020 1.00 3.36 N ATOM 966 NH2 ARG A 439 320.318 186.249 180.925 1.00 3.83 N ATOM 0 H ARG A 439 317.966 193.099 179.249 1.00 0.23 H new ATOM 0 HA ARG A 439 318.501 191.366 177.083 1.00 0.26 H new ATOM 0 HB2 ARG A 439 317.858 191.205 179.781 1.00 0.26 H new ATOM 0 HB3 ARG A 439 316.322 190.764 179.062 1.00 0.26 H new ATOM 0 HG2 ARG A 439 317.422 189.008 177.707 1.00 1.13 H new ATOM 0 HG3 ARG A 439 318.993 189.485 178.322 1.00 1.13 H new ATOM 0 HD2 ARG A 439 317.419 189.094 180.650 1.00 1.54 H new ATOM 0 HD3 ARG A 439 316.961 187.779 179.586 1.00 1.54 H new ATOM 0 HE ARG A 439 319.870 188.326 179.687 1.00 2.19 H new ATOM 0 HH11 ARG A 439 317.140 186.459 180.798 1.00 3.36 H new ATOM 0 HH12 ARG A 439 318.143 185.196 181.518 1.00 3.36 H new ATOM 0 HH21 ARG A 439 321.152 186.756 180.629 1.00 3.83 H new ATOM 0 HH22 ARG A 439 320.409 185.363 181.423 1.00 3.83 H new ATOM 980 N GLN A 440 315.436 192.507 177.296 1.00 0.27 N ATOM 981 CA GLN A 440 314.204 192.634 176.550 1.00 0.31 C ATOM 982 C GLN A 440 314.513 193.325 175.241 1.00 0.31 C ATOM 983 O GLN A 440 314.082 192.888 174.173 1.00 0.36 O ATOM 984 CB GLN A 440 313.219 193.448 177.375 1.00 0.31 C ATOM 985 CG GLN A 440 311.821 193.389 176.772 1.00 0.42 C ATOM 986 CD GLN A 440 310.876 194.096 177.729 1.00 0.46 C ATOM 987 OE1 GLN A 440 311.273 195.065 178.362 1.00 1.31 O ATOM 988 NE2 GLN A 440 309.667 193.653 177.909 1.00 0.99 N ATOM 0 H GLN A 440 315.443 192.986 178.196 1.00 0.27 H new ATOM 0 HA GLN A 440 313.763 191.659 176.342 1.00 0.31 H new ATOM 0 HB2 GLN A 440 313.194 193.069 178.397 1.00 0.31 H new ATOM 0 HB3 GLN A 440 313.553 194.484 177.428 1.00 0.31 H new ATOM 0 HG2 GLN A 440 311.806 193.870 175.794 1.00 0.42 H new ATOM 0 HG3 GLN A 440 311.512 192.354 176.623 1.00 0.42 H new ATOM 0 HE21 GLN A 440 309.336 192.845 177.381 1.00 0.99 H new ATOM 0 HE22 GLN A 440 309.050 194.113 178.578 1.00 0.99 H new ATOM 997 N VAL A 441 315.331 194.364 175.325 1.00 0.27 N ATOM 998 CA VAL A 441 315.787 195.075 174.150 1.00 0.28 C ATOM 999 C VAL A 441 317.253 195.452 174.333 1.00 0.25 C ATOM 1000 O VAL A 441 317.566 196.557 174.775 1.00 0.22 O ATOM 1001 CB VAL A 441 314.961 196.350 173.950 1.00 0.28 C ATOM 1002 CG1 VAL A 441 313.631 195.999 173.271 1.00 0.33 C ATOM 1003 CG2 VAL A 441 314.697 197.031 175.314 1.00 0.25 C ATOM 0 H VAL A 441 315.692 194.732 176.205 1.00 0.27 H new ATOM 0 HA VAL A 441 315.670 194.434 173.276 1.00 0.28 H new ATOM 0 HB VAL A 441 315.516 197.041 173.316 1.00 0.28 H new ATOM 0 HG11 VAL A 441 313.044 196.907 173.129 1.00 0.33 H new ATOM 0 HG12 VAL A 441 313.827 195.539 172.303 1.00 0.33 H new ATOM 0 HG13 VAL A 441 313.075 195.302 173.898 1.00 0.33 H new ATOM 0 HG21 VAL A 441 314.109 197.936 175.161 1.00 0.25 H new ATOM 0 HG22 VAL A 441 314.148 196.347 175.962 1.00 0.25 H new ATOM 0 HG23 VAL A 441 315.647 197.290 175.781 1.00 0.25 H new ATOM 1013 N PRO A 442 318.155 194.573 173.986 1.00 0.27 N ATOM 1014 CA PRO A 442 319.604 194.845 174.100 1.00 0.26 C ATOM 1015 C PRO A 442 320.047 195.721 172.950 1.00 0.29 C ATOM 1016 O PRO A 442 321.183 196.193 172.902 1.00 0.31 O ATOM 1017 CB PRO A 442 320.254 193.462 174.056 1.00 0.30 C ATOM 1018 CG PRO A 442 319.277 192.570 173.351 1.00 0.33 C ATOM 1019 CD PRO A 442 317.893 193.228 173.445 1.00 0.31 C ATOM 0 HA PRO A 442 319.879 195.379 175.009 1.00 0.26 H new ATOM 0 HB2 PRO A 442 321.206 193.495 173.526 1.00 0.30 H new ATOM 0 HB3 PRO A 442 320.462 193.096 175.062 1.00 0.30 H new ATOM 0 HG2 PRO A 442 319.566 192.434 172.309 1.00 0.33 H new ATOM 0 HG3 PRO A 442 319.262 191.581 173.809 1.00 0.33 H new ATOM 0 HD2 PRO A 442 317.412 193.281 172.468 1.00 0.31 H new ATOM 0 HD3 PRO A 442 317.228 192.661 174.097 1.00 0.31 H new ATOM 1027 N GLN A 443 319.113 195.952 172.031 1.00 0.29 N ATOM 1028 CA GLN A 443 319.348 196.797 170.878 1.00 0.32 C ATOM 1029 C GLN A 443 318.982 198.240 171.210 1.00 0.27 C ATOM 1030 O GLN A 443 319.262 199.159 170.441 1.00 0.28 O ATOM 1031 CB GLN A 443 318.481 196.304 169.721 1.00 0.36 C ATOM 1032 CG GLN A 443 318.776 194.825 169.467 1.00 0.42 C ATOM 1033 CD GLN A 443 318.134 194.379 168.159 1.00 1.15 C ATOM 1034 OE1 GLN A 443 317.488 195.176 167.480 1.00 1.85 O ATOM 1035 NE2 GLN A 443 318.283 193.146 167.759 1.00 1.83 N ATOM 0 H GLN A 443 318.174 195.556 172.070 1.00 0.29 H new ATOM 0 HA GLN A 443 320.401 196.754 170.600 1.00 0.32 H new ATOM 0 HB2 GLN A 443 317.426 196.441 169.957 1.00 0.36 H new ATOM 0 HB3 GLN A 443 318.685 196.887 168.823 1.00 0.36 H new ATOM 0 HG2 GLN A 443 319.853 194.663 169.426 1.00 0.42 H new ATOM 0 HG3 GLN A 443 318.394 194.223 170.292 1.00 0.42 H new ATOM 0 HE21 GLN A 443 318.819 192.488 168.324 1.00 1.83 H new ATOM 0 HE22 GLN A 443 317.863 192.840 166.881 1.00 1.83 H new ATOM 1044 N ALA A 444 318.352 198.424 172.367 1.00 0.24 N ATOM 1045 CA ALA A 444 317.946 199.753 172.805 1.00 0.20 C ATOM 1046 C ALA A 444 319.062 200.419 173.588 1.00 0.19 C ATOM 1047 O ALA A 444 320.023 199.767 173.996 1.00 0.20 O ATOM 1048 CB ALA A 444 316.698 199.665 173.684 1.00 0.19 C ATOM 0 H ALA A 444 318.113 197.673 173.014 1.00 0.24 H new ATOM 0 HA ALA A 444 317.724 200.348 171.919 1.00 0.20 H new ATOM 0 HB1 ALA A 444 316.407 200.666 174.004 1.00 0.19 H new ATOM 0 HB2 ALA A 444 315.884 199.214 173.116 1.00 0.19 H new ATOM 0 HB3 ALA A 444 316.912 199.052 174.560 1.00 0.19 H new ATOM 1054 N GLN A 445 318.899 201.707 173.857 1.00 0.17 N ATOM 1055 CA GLN A 445 319.873 202.423 174.662 1.00 0.17 C ATOM 1056 C GLN A 445 319.442 202.414 176.116 1.00 0.16 C ATOM 1057 O GLN A 445 318.308 202.766 176.444 1.00 0.15 O ATOM 1058 CB GLN A 445 320.051 203.853 174.155 1.00 0.18 C ATOM 1059 CG GLN A 445 320.864 203.808 172.861 1.00 0.96 C ATOM 1060 CD GLN A 445 321.180 205.216 172.373 1.00 1.48 C ATOM 1061 OE1 GLN A 445 320.786 206.196 172.999 1.00 2.03 O ATOM 1062 NE2 GLN A 445 321.898 205.372 171.297 1.00 2.26 N ATOM 0 H GLN A 445 318.112 202.270 173.534 1.00 0.17 H new ATOM 0 HA GLN A 445 320.837 201.920 174.579 1.00 0.17 H new ATOM 0 HB2 GLN A 445 319.080 204.316 173.977 1.00 0.18 H new ATOM 0 HB3 GLN A 445 320.561 204.460 174.903 1.00 0.18 H new ATOM 0 HG2 GLN A 445 321.791 203.259 173.027 1.00 0.96 H new ATOM 0 HG3 GLN A 445 320.307 203.269 172.095 1.00 0.96 H new ATOM 0 HE21 GLN A 445 322.224 204.556 170.779 1.00 2.26 H new ATOM 0 HE22 GLN A 445 322.134 206.310 170.973 1.00 2.26 H new ATOM 1071 N HIS A 446 320.341 201.952 176.979 1.00 0.15 N ATOM 1072 CA HIS A 446 320.033 201.827 178.394 1.00 0.15 C ATOM 1073 C HIS A 446 320.951 202.698 179.226 1.00 0.16 C ATOM 1074 O HIS A 446 322.164 202.731 179.018 1.00 0.18 O ATOM 1075 CB HIS A 446 320.198 200.371 178.828 1.00 0.15 C ATOM 1076 CG HIS A 446 319.233 199.515 178.062 1.00 0.16 C ATOM 1077 ND1 HIS A 446 317.892 199.429 178.399 1.00 0.20 N ATOM 1078 CD2 HIS A 446 319.394 198.715 176.959 1.00 0.20 C ATOM 1079 CE1 HIS A 446 317.304 198.605 177.513 1.00 0.21 C ATOM 1080 NE2 HIS A 446 318.174 198.142 176.613 1.00 0.20 N ATOM 0 H HIS A 446 321.284 201.660 176.722 1.00 0.15 H new ATOM 0 HA HIS A 446 319.004 202.151 178.550 1.00 0.15 H new ATOM 0 HB2 HIS A 446 321.220 200.039 178.647 1.00 0.15 H new ATOM 0 HB3 HIS A 446 320.017 200.275 179.899 1.00 0.15 H new ATOM 0 HD2 HIS A 446 320.326 198.554 176.438 1.00 0.20 H new ATOM 0 HE1 HIS A 446 316.255 198.349 177.528 1.00 0.21 H new ATOM 0 HE2 HIS A 446 317.985 197.505 175.839 1.00 0.20 H new ATOM 1088 N ILE A 447 320.361 203.357 180.207 1.00 0.15 N ATOM 1089 CA ILE A 447 321.112 204.187 181.127 1.00 0.17 C ATOM 1090 C ILE A 447 320.848 203.690 182.539 1.00 0.16 C ATOM 1091 O ILE A 447 319.694 203.473 182.927 1.00 0.17 O ATOM 1092 CB ILE A 447 320.677 205.644 180.990 1.00 0.19 C ATOM 1093 CG1 ILE A 447 320.929 206.137 179.556 1.00 0.20 C ATOM 1094 CG2 ILE A 447 321.452 206.514 181.972 1.00 0.22 C ATOM 1095 CD1 ILE A 447 322.410 205.974 179.185 1.00 0.25 C ATOM 0 H ILE A 447 319.357 203.332 180.386 1.00 0.15 H new ATOM 0 HA ILE A 447 322.177 204.128 180.904 1.00 0.17 H new ATOM 0 HB ILE A 447 319.612 205.714 181.211 1.00 0.19 H new ATOM 0 HG12 ILE A 447 320.309 205.575 178.858 1.00 0.20 H new ATOM 0 HG13 ILE A 447 320.639 207.184 179.469 1.00 0.20 H new ATOM 0 HG21 ILE A 447 321.135 207.552 181.867 1.00 0.22 H new ATOM 0 HG22 ILE A 447 321.257 206.176 182.990 1.00 0.22 H new ATOM 0 HG23 ILE A 447 322.519 206.437 181.762 1.00 0.22 H new ATOM 0 HD11 ILE A 447 322.571 206.328 178.167 1.00 0.25 H new ATOM 0 HD12 ILE A 447 323.024 206.556 179.873 1.00 0.25 H new ATOM 0 HD13 ILE A 447 322.688 204.922 179.252 1.00 0.25 H new ATOM 1107 N SER A 448 321.917 203.446 183.281 1.00 0.17 N ATOM 1108 CA SER A 448 321.784 202.897 184.622 1.00 0.17 C ATOM 1109 C SER A 448 321.951 203.967 185.687 1.00 0.18 C ATOM 1110 O SER A 448 322.829 204.825 185.600 1.00 0.19 O ATOM 1111 CB SER A 448 322.833 201.808 184.830 1.00 0.17 C ATOM 1112 OG SER A 448 324.040 202.400 185.290 1.00 1.26 O ATOM 0 H SER A 448 322.877 203.617 182.982 1.00 0.17 H new ATOM 0 HA SER A 448 320.781 202.481 184.717 1.00 0.17 H new ATOM 0 HB2 SER A 448 322.475 201.076 185.554 1.00 0.17 H new ATOM 0 HB3 SER A 448 323.009 201.274 183.896 1.00 0.17 H new ATOM 0 HG SER A 448 324.715 201.703 185.426 1.00 1.26 H new ATOM 1118 N LEU A 449 321.118 203.873 186.715 1.00 0.19 N ATOM 1119 CA LEU A 449 321.181 204.793 187.840 1.00 0.22 C ATOM 1120 C LEU A 449 321.809 204.085 189.032 1.00 0.26 C ATOM 1121 O LEU A 449 321.912 202.858 189.044 1.00 0.44 O ATOM 1122 CB LEU A 449 319.777 205.268 188.207 1.00 0.21 C ATOM 1123 CG LEU A 449 319.129 205.953 187.000 1.00 0.28 C ATOM 1124 CD1 LEU A 449 317.687 206.313 187.354 1.00 0.35 C ATOM 1125 CD2 LEU A 449 319.910 207.231 186.632 1.00 0.34 C ATOM 0 H LEU A 449 320.388 203.165 186.792 1.00 0.19 H new ATOM 0 HA LEU A 449 321.786 205.657 187.565 1.00 0.22 H new ATOM 0 HB2 LEU A 449 319.169 204.422 188.526 1.00 0.21 H new ATOM 0 HB3 LEU A 449 319.826 205.961 189.047 1.00 0.21 H new ATOM 0 HG LEU A 449 319.145 205.277 186.145 1.00 0.28 H new ATOM 0 HD11 LEU A 449 317.214 206.802 186.502 1.00 0.35 H new ATOM 0 HD12 LEU A 449 317.136 205.406 187.603 1.00 0.35 H new ATOM 0 HD13 LEU A 449 317.680 206.988 188.209 1.00 0.35 H new ATOM 0 HD21 LEU A 449 319.440 207.710 185.773 1.00 0.34 H new ATOM 0 HD22 LEU A 449 319.903 207.918 187.478 1.00 0.34 H new ATOM 0 HD23 LEU A 449 320.939 206.970 186.385 1.00 0.34 H new ATOM 1137 N THR A 450 322.187 204.841 190.056 1.00 0.28 N ATOM 1138 CA THR A 450 322.771 204.249 191.255 1.00 0.32 C ATOM 1139 C THR A 450 321.881 204.521 192.463 1.00 0.25 C ATOM 1140 O THR A 450 321.684 203.650 193.311 1.00 0.35 O ATOM 1141 CB THR A 450 324.162 204.845 191.497 1.00 0.46 C ATOM 1142 OG1 THR A 450 324.084 206.260 191.385 1.00 0.86 O ATOM 1143 CG2 THR A 450 325.166 204.309 190.462 1.00 0.94 C ATOM 0 H THR A 450 322.101 205.857 190.082 1.00 0.28 H new ATOM 0 HA THR A 450 322.855 203.172 191.113 1.00 0.32 H new ATOM 0 HB THR A 450 324.501 204.562 192.493 1.00 0.46 H new ATOM 0 HG1 THR A 450 324.134 206.662 192.277 1.00 0.86 H new ATOM 0 HG21 THR A 450 326.148 204.743 190.649 1.00 0.94 H new ATOM 0 HG22 THR A 450 325.227 203.224 190.543 1.00 0.94 H new ATOM 0 HG23 THR A 450 324.835 204.580 189.460 1.00 0.94 H new ATOM 1151 N ASN A 451 321.334 205.733 192.527 1.00 0.25 N ATOM 1152 CA ASN A 451 320.452 206.112 193.629 1.00 0.24 C ATOM 1153 C ASN A 451 319.213 206.836 193.104 1.00 0.26 C ATOM 1154 O ASN A 451 319.228 207.430 192.026 1.00 0.25 O ATOM 1155 CB ASN A 451 321.206 206.999 194.639 1.00 0.27 C ATOM 1156 CG ASN A 451 321.624 206.195 195.875 1.00 1.02 C ATOM 1157 OD1 ASN A 451 321.133 205.090 196.105 1.00 1.76 O ATOM 1158 ND2 ASN A 451 322.505 206.697 196.695 1.00 1.67 N ATOM 0 H ASN A 451 321.484 206.466 191.833 1.00 0.25 H new ATOM 0 HA ASN A 451 320.128 205.204 194.137 1.00 0.24 H new ATOM 0 HB2 ASN A 451 322.089 207.427 194.164 1.00 0.27 H new ATOM 0 HB3 ASN A 451 320.571 207.832 194.941 1.00 0.27 H new ATOM 0 HD21 ASN A 451 322.786 206.174 197.525 1.00 1.67 H new ATOM 0 HD22 ASN A 451 322.913 207.612 196.507 1.00 1.67 H new ATOM 1165 N PHE A 452 318.135 206.737 193.870 1.00 0.31 N ATOM 1166 CA PHE A 452 316.857 207.324 193.489 1.00 0.35 C ATOM 1167 C PHE A 452 316.930 208.842 193.377 1.00 0.32 C ATOM 1168 O PHE A 452 316.304 209.427 192.493 1.00 0.32 O ATOM 1169 CB PHE A 452 315.797 206.938 194.521 1.00 0.44 C ATOM 1170 CG PHE A 452 315.720 205.431 194.626 1.00 0.48 C ATOM 1171 CD1 PHE A 452 315.426 204.661 193.496 1.00 0.53 C ATOM 1172 CD2 PHE A 452 315.953 204.802 195.856 1.00 0.52 C ATOM 1173 CE1 PHE A 452 315.359 203.267 193.592 1.00 0.60 C ATOM 1174 CE2 PHE A 452 315.885 203.406 195.954 1.00 0.58 C ATOM 1175 CZ PHE A 452 315.587 202.639 194.821 1.00 0.61 C ATOM 0 H PHE A 452 318.121 206.251 194.767 1.00 0.31 H new ATOM 0 HA PHE A 452 316.593 206.936 192.505 1.00 0.35 H new ATOM 0 HB2 PHE A 452 316.045 207.369 195.491 1.00 0.44 H new ATOM 0 HB3 PHE A 452 314.827 207.343 194.231 1.00 0.44 H new ATOM 0 HD1 PHE A 452 315.250 205.144 192.546 1.00 0.53 H new ATOM 0 HD2 PHE A 452 316.185 205.394 196.729 1.00 0.52 H new ATOM 0 HE1 PHE A 452 315.131 202.676 192.717 1.00 0.60 H new ATOM 0 HE2 PHE A 452 316.062 202.922 196.903 1.00 0.58 H new ATOM 0 HZ PHE A 452 315.533 201.563 194.896 1.00 0.61 H new ATOM 1185 N LEU A 453 317.669 209.488 194.275 1.00 0.32 N ATOM 1186 CA LEU A 453 317.766 210.948 194.238 1.00 0.32 C ATOM 1187 C LEU A 453 319.144 211.399 193.755 1.00 0.29 C ATOM 1188 O LEU A 453 319.546 212.538 193.992 1.00 0.30 O ATOM 1189 CB LEU A 453 317.476 211.535 195.629 1.00 0.39 C ATOM 1190 CG LEU A 453 316.072 211.122 196.118 1.00 0.45 C ATOM 1191 CD1 LEU A 453 315.947 211.451 197.610 1.00 0.53 C ATOM 1192 CD2 LEU A 453 314.966 211.884 195.359 1.00 0.50 C ATOM 0 H LEU A 453 318.199 209.038 195.022 1.00 0.32 H new ATOM 0 HA LEU A 453 317.022 211.317 193.532 1.00 0.32 H new ATOM 0 HB2 LEU A 453 318.229 211.190 196.338 1.00 0.39 H new ATOM 0 HB3 LEU A 453 317.548 212.622 195.592 1.00 0.39 H new ATOM 0 HG LEU A 453 315.950 210.054 195.938 1.00 0.45 H new ATOM 0 HD11 LEU A 453 314.957 211.162 197.965 1.00 0.53 H new ATOM 0 HD12 LEU A 453 316.706 210.903 198.168 1.00 0.53 H new ATOM 0 HD13 LEU A 453 316.088 212.521 197.760 1.00 0.53 H new ATOM 0 HD21 LEU A 453 313.989 211.570 195.727 1.00 0.50 H new ATOM 0 HD22 LEU A 453 315.087 212.955 195.519 1.00 0.50 H new ATOM 0 HD23 LEU A 453 315.039 211.666 194.294 1.00 0.50 H new ATOM 1204 N ASP A 454 319.855 210.515 193.058 1.00 0.25 N ATOM 1205 CA ASP A 454 321.173 210.869 192.532 1.00 0.23 C ATOM 1206 C ASP A 454 321.055 212.021 191.539 1.00 0.23 C ATOM 1207 O ASP A 454 321.070 211.812 190.327 1.00 0.21 O ATOM 1208 CB ASP A 454 321.797 209.664 191.830 1.00 0.22 C ATOM 1209 CG ASP A 454 323.288 209.903 191.618 1.00 1.26 C ATOM 1210 OD1 ASP A 454 323.634 210.974 191.146 1.00 1.98 O ATOM 1211 OD2 ASP A 454 324.061 209.014 191.932 1.00 1.61 O ATOM 0 H ASP A 454 319.549 209.565 192.847 1.00 0.25 H new ATOM 0 HA ASP A 454 321.806 211.175 193.365 1.00 0.23 H new ATOM 0 HB2 ASP A 454 321.645 208.765 192.427 1.00 0.22 H new ATOM 0 HB3 ASP A 454 321.307 209.496 190.871 1.00 0.22 H new ATOM 1216 N SER A 455 320.931 213.235 192.066 1.00 0.26 N ATOM 1217 CA SER A 455 320.776 214.420 191.228 1.00 0.27 C ATOM 1218 C SER A 455 321.957 214.607 190.283 1.00 0.25 C ATOM 1219 O SER A 455 321.782 215.073 189.157 1.00 0.24 O ATOM 1220 CB SER A 455 320.629 215.660 192.111 1.00 0.33 C ATOM 1221 OG SER A 455 321.758 215.764 192.967 1.00 1.34 O ATOM 0 H SER A 455 320.935 213.424 193.068 1.00 0.26 H new ATOM 0 HA SER A 455 319.881 214.281 190.622 1.00 0.27 H new ATOM 0 HB2 SER A 455 320.544 216.553 191.492 1.00 0.33 H new ATOM 0 HB3 SER A 455 319.715 215.594 192.702 1.00 0.33 H new ATOM 0 HG SER A 455 321.667 216.559 193.533 1.00 1.34 H new ATOM 1227 N GLY A 456 323.156 214.262 190.735 1.00 0.27 N ATOM 1228 CA GLY A 456 324.341 214.419 189.903 1.00 0.29 C ATOM 1229 C GLY A 456 324.225 213.596 188.623 1.00 0.27 C ATOM 1230 O GLY A 456 324.450 214.110 187.527 1.00 0.27 O ATOM 0 H GLY A 456 323.333 213.876 191.662 1.00 0.27 H new ATOM 0 HA2 GLY A 456 324.476 215.471 189.652 1.00 0.29 H new ATOM 0 HA3 GLY A 456 325.225 214.108 190.460 1.00 0.29 H new ATOM 1234 N LEU A 457 323.849 212.325 188.761 1.00 0.25 N ATOM 1235 CA LEU A 457 323.687 211.474 187.586 1.00 0.26 C ATOM 1236 C LEU A 457 322.578 212.008 186.686 1.00 0.24 C ATOM 1237 O LEU A 457 322.741 212.088 185.473 1.00 0.26 O ATOM 1238 CB LEU A 457 323.345 210.033 187.982 1.00 0.26 C ATOM 1239 CG LEU A 457 324.566 209.330 188.588 1.00 0.30 C ATOM 1240 CD1 LEU A 457 324.141 207.940 189.078 1.00 0.30 C ATOM 1241 CD2 LEU A 457 325.681 209.187 187.531 1.00 0.39 C ATOM 0 H LEU A 457 323.655 211.871 189.654 1.00 0.25 H new ATOM 0 HA LEU A 457 324.637 211.482 187.051 1.00 0.26 H new ATOM 0 HB2 LEU A 457 322.526 210.033 188.701 1.00 0.26 H new ATOM 0 HB3 LEU A 457 323.000 209.483 187.107 1.00 0.26 H new ATOM 0 HG LEU A 457 324.949 209.921 189.420 1.00 0.30 H new ATOM 0 HD11 LEU A 457 325.000 207.429 189.512 1.00 0.30 H new ATOM 0 HD12 LEU A 457 323.361 208.043 189.833 1.00 0.30 H new ATOM 0 HD13 LEU A 457 323.759 207.359 188.238 1.00 0.30 H new ATOM 0 HD21 LEU A 457 326.541 208.686 187.975 1.00 0.39 H new ATOM 0 HD22 LEU A 457 325.313 208.598 186.691 1.00 0.39 H new ATOM 0 HD23 LEU A 457 325.978 210.175 187.179 1.00 0.39 H new ATOM 1253 N TYR A 458 321.451 212.375 187.287 1.00 0.21 N ATOM 1254 CA TYR A 458 320.328 212.889 186.509 1.00 0.21 C ATOM 1255 C TYR A 458 320.735 214.129 185.728 1.00 0.20 C ATOM 1256 O TYR A 458 320.408 214.262 184.548 1.00 0.22 O ATOM 1257 CB TYR A 458 319.142 213.229 187.422 1.00 0.22 C ATOM 1258 CG TYR A 458 318.341 211.984 187.736 1.00 0.25 C ATOM 1259 CD1 TYR A 458 317.583 211.380 186.730 1.00 0.57 C ATOM 1260 CD2 TYR A 458 318.342 211.443 189.026 1.00 0.67 C ATOM 1261 CE1 TYR A 458 316.824 210.240 187.009 1.00 0.58 C ATOM 1262 CE2 TYR A 458 317.580 210.303 189.309 1.00 0.70 C ATOM 1263 CZ TYR A 458 316.821 209.700 188.299 1.00 0.33 C ATOM 1264 OH TYR A 458 316.063 208.581 188.578 1.00 0.38 O ATOM 0 H TYR A 458 321.291 212.328 188.293 1.00 0.21 H new ATOM 0 HA TYR A 458 320.027 212.109 185.809 1.00 0.21 H new ATOM 0 HB2 TYR A 458 319.504 213.678 188.347 1.00 0.22 H new ATOM 0 HB3 TYR A 458 318.503 213.967 186.938 1.00 0.22 H new ATOM 0 HD1 TYR A 458 317.583 211.795 185.733 1.00 0.57 H new ATOM 0 HD2 TYR A 458 318.931 211.905 189.804 1.00 0.67 H new ATOM 0 HE1 TYR A 458 316.240 209.776 186.228 1.00 0.58 H new ATOM 0 HE2 TYR A 458 317.578 209.889 190.306 1.00 0.70 H new ATOM 0 HH TYR A 458 316.175 208.336 189.520 1.00 0.38 H new ATOM 1274 N THR A 459 321.438 215.036 186.388 1.00 0.20 N ATOM 1275 CA THR A 459 321.863 216.262 185.734 1.00 0.20 C ATOM 1276 C THR A 459 322.782 215.956 184.558 1.00 0.22 C ATOM 1277 O THR A 459 322.608 216.504 183.472 1.00 0.21 O ATOM 1278 CB THR A 459 322.592 217.163 186.733 1.00 0.24 C ATOM 1279 OG1 THR A 459 321.710 217.500 187.795 1.00 0.29 O ATOM 1280 CG2 THR A 459 323.055 218.439 186.027 1.00 0.30 C ATOM 0 H THR A 459 321.723 214.948 187.363 1.00 0.20 H new ATOM 0 HA THR A 459 320.977 216.775 185.361 1.00 0.20 H new ATOM 0 HB THR A 459 323.459 216.637 187.133 1.00 0.24 H new ATOM 0 HG1 THR A 459 321.625 216.737 188.404 1.00 0.29 H new ATOM 0 HG21 THR A 459 323.574 219.081 186.739 1.00 0.30 H new ATOM 0 HG22 THR A 459 323.731 218.179 185.212 1.00 0.30 H new ATOM 0 HG23 THR A 459 322.190 218.967 185.626 1.00 0.30 H new ATOM 1288 N SER A 460 323.757 215.075 184.774 1.00 0.26 N ATOM 1289 CA SER A 460 324.700 214.712 183.720 1.00 0.31 C ATOM 1290 C SER A 460 323.985 214.095 182.526 1.00 0.32 C ATOM 1291 O SER A 460 324.288 214.413 181.375 1.00 0.33 O ATOM 1292 CB SER A 460 325.712 213.701 184.260 1.00 0.38 C ATOM 1293 OG SER A 460 326.373 214.250 185.391 1.00 1.33 O ATOM 0 H SER A 460 323.914 214.602 185.664 1.00 0.26 H new ATOM 0 HA SER A 460 325.205 215.622 183.396 1.00 0.31 H new ATOM 0 HB2 SER A 460 325.206 212.776 184.535 1.00 0.38 H new ATOM 0 HB3 SER A 460 326.439 213.450 183.487 1.00 0.38 H new ATOM 0 HG SER A 460 325.780 214.206 186.170 1.00 1.33 H new ATOM 1299 N LEU A 461 323.061 213.184 182.803 1.00 0.33 N ATOM 1300 CA LEU A 461 322.343 212.496 181.743 1.00 0.38 C ATOM 1301 C LEU A 461 321.540 213.485 180.913 1.00 0.33 C ATOM 1302 O LEU A 461 321.499 213.396 179.686 1.00 0.33 O ATOM 1303 CB LEU A 461 321.422 211.449 182.363 1.00 0.45 C ATOM 1304 CG LEU A 461 322.281 210.362 183.024 1.00 0.56 C ATOM 1305 CD1 LEU A 461 321.404 209.462 183.915 1.00 0.58 C ATOM 1306 CD2 LEU A 461 322.985 209.524 181.947 1.00 0.77 C ATOM 0 H LEU A 461 322.794 212.907 183.748 1.00 0.33 H new ATOM 0 HA LEU A 461 323.058 212.005 181.082 1.00 0.38 H new ATOM 0 HB2 LEU A 461 320.767 211.912 183.101 1.00 0.45 H new ATOM 0 HB3 LEU A 461 320.781 211.010 181.598 1.00 0.45 H new ATOM 0 HG LEU A 461 323.037 210.838 183.648 1.00 0.56 H new ATOM 0 HD11 LEU A 461 322.024 208.695 184.379 1.00 0.58 H new ATOM 0 HD12 LEU A 461 320.933 210.066 184.691 1.00 0.58 H new ATOM 0 HD13 LEU A 461 320.634 208.988 183.307 1.00 0.58 H new ATOM 0 HD21 LEU A 461 323.593 208.755 182.424 1.00 0.77 H new ATOM 0 HD22 LEU A 461 322.239 209.052 181.308 1.00 0.77 H new ATOM 0 HD23 LEU A 461 323.624 210.169 181.344 1.00 0.77 H new ATOM 1318 N THR A 462 320.900 214.425 181.592 1.00 0.29 N ATOM 1319 CA THR A 462 320.100 215.423 180.906 1.00 0.28 C ATOM 1320 C THR A 462 320.947 216.261 179.963 1.00 0.21 C ATOM 1321 O THR A 462 320.573 216.483 178.812 1.00 0.22 O ATOM 1322 CB THR A 462 319.441 216.355 181.913 1.00 0.29 C ATOM 1323 OG1 THR A 462 318.722 215.587 182.869 1.00 0.40 O ATOM 1324 CG2 THR A 462 318.486 217.303 181.180 1.00 0.39 C ATOM 0 H THR A 462 320.919 214.516 182.608 1.00 0.29 H new ATOM 0 HA THR A 462 319.343 214.890 180.331 1.00 0.28 H new ATOM 0 HB THR A 462 320.204 216.940 182.426 1.00 0.29 H new ATOM 0 HG1 THR A 462 319.350 215.185 183.505 1.00 0.40 H new ATOM 0 HG21 THR A 462 318.013 217.971 181.900 1.00 0.39 H new ATOM 0 HG22 THR A 462 319.045 217.891 180.452 1.00 0.39 H new ATOM 0 HG23 THR A 462 317.720 216.722 180.666 1.00 0.39 H new ATOM 1332 N GLU A 463 322.082 216.739 180.458 1.00 0.17 N ATOM 1333 CA GLU A 463 322.950 217.569 179.638 1.00 0.15 C ATOM 1334 C GLU A 463 323.354 216.807 178.391 1.00 0.14 C ATOM 1335 O GLU A 463 323.451 217.371 177.301 1.00 0.15 O ATOM 1336 CB GLU A 463 324.213 217.962 180.413 1.00 0.19 C ATOM 1337 CG GLU A 463 323.842 218.840 181.613 1.00 0.21 C ATOM 1338 CD GLU A 463 324.980 219.805 181.940 1.00 1.28 C ATOM 1339 OE1 GLU A 463 326.008 219.729 181.288 1.00 2.00 O ATOM 1340 OE2 GLU A 463 324.802 220.613 182.837 1.00 1.57 O ATOM 0 H GLU A 463 322.417 216.569 181.406 1.00 0.17 H new ATOM 0 HA GLU A 463 322.404 218.472 179.365 1.00 0.15 H new ATOM 0 HB2 GLU A 463 324.733 217.067 180.754 1.00 0.19 H new ATOM 0 HB3 GLU A 463 324.899 218.499 179.758 1.00 0.19 H new ATOM 0 HG2 GLU A 463 322.933 219.401 181.394 1.00 0.21 H new ATOM 0 HG3 GLU A 463 323.629 218.213 182.478 1.00 0.21 H new ATOM 1347 N ARG A 464 323.616 215.524 178.572 1.00 0.15 N ATOM 1348 CA ARG A 464 324.048 214.653 177.493 1.00 0.17 C ATOM 1349 C ARG A 464 322.981 214.494 176.416 1.00 0.17 C ATOM 1350 O ARG A 464 323.272 214.549 175.221 1.00 0.19 O ATOM 1351 CB ARG A 464 324.344 213.278 178.104 1.00 0.18 C ATOM 1352 CG ARG A 464 325.805 212.908 177.913 1.00 1.16 C ATOM 1353 CD ARG A 464 325.996 211.487 178.396 1.00 1.54 C ATOM 1354 NE ARG A 464 327.392 211.127 178.167 1.00 2.11 N ATOM 1355 CZ ARG A 464 327.769 209.904 177.869 1.00 2.69 C ATOM 1356 NH1 ARG A 464 326.866 208.980 177.660 1.00 2.96 N ATOM 1357 NH2 ARG A 464 329.036 209.622 177.753 1.00 3.55 N ATOM 0 H ARG A 464 323.535 215.056 179.474 1.00 0.15 H new ATOM 0 HA ARG A 464 324.926 215.091 177.018 1.00 0.17 H new ATOM 0 HB2 ARG A 464 324.102 213.287 179.167 1.00 0.18 H new ATOM 0 HB3 ARG A 464 323.709 212.524 177.639 1.00 0.18 H new ATOM 0 HG2 ARG A 464 326.086 212.994 176.863 1.00 1.16 H new ATOM 0 HG3 ARG A 464 326.447 213.590 178.472 1.00 1.16 H new ATOM 0 HD2 ARG A 464 325.748 211.406 179.454 1.00 1.54 H new ATOM 0 HD3 ARG A 464 325.333 210.808 177.860 1.00 1.54 H new ATOM 0 HE ARG A 464 328.103 211.854 178.241 1.00 2.11 H new ATOM 0 HH11 ARG A 464 325.875 209.211 177.729 1.00 2.96 H new ATOM 0 HH12 ARG A 464 327.153 208.029 177.428 1.00 2.96 H new ATOM 0 HH21 ARG A 464 329.736 210.351 177.894 1.00 3.55 H new ATOM 0 HH22 ARG A 464 329.328 208.672 177.522 1.00 3.55 H new ATOM 1371 N LEU A 465 321.753 214.260 176.847 1.00 0.16 N ATOM 1372 CA LEU A 465 320.662 214.051 175.917 1.00 0.18 C ATOM 1373 C LEU A 465 320.439 215.314 175.101 1.00 0.18 C ATOM 1374 O LEU A 465 320.251 215.256 173.888 1.00 0.20 O ATOM 1375 CB LEU A 465 319.406 213.641 176.687 1.00 0.19 C ATOM 1376 CG LEU A 465 319.637 212.238 177.276 1.00 0.20 C ATOM 1377 CD1 LEU A 465 318.546 211.911 178.300 1.00 0.21 C ATOM 1378 CD2 LEU A 465 319.636 211.179 176.150 1.00 0.29 C ATOM 0 H LEU A 465 321.490 214.211 177.831 1.00 0.16 H new ATOM 0 HA LEU A 465 320.907 213.246 175.224 1.00 0.18 H new ATOM 0 HB2 LEU A 465 319.197 214.357 177.482 1.00 0.19 H new ATOM 0 HB3 LEU A 465 318.539 213.637 176.026 1.00 0.19 H new ATOM 0 HG LEU A 465 320.607 212.223 177.773 1.00 0.20 H new ATOM 0 HD11 LEU A 465 318.719 210.916 178.711 1.00 0.21 H new ATOM 0 HD12 LEU A 465 318.571 212.645 179.105 1.00 0.21 H new ATOM 0 HD13 LEU A 465 317.571 211.938 177.814 1.00 0.21 H new ATOM 0 HD21 LEU A 465 319.800 210.191 176.580 1.00 0.29 H new ATOM 0 HD22 LEU A 465 318.675 211.196 175.636 1.00 0.29 H new ATOM 0 HD23 LEU A 465 320.432 211.403 175.440 1.00 0.29 H new ATOM 1390 N VAL A 466 320.537 216.455 175.763 1.00 0.17 N ATOM 1391 CA VAL A 466 320.409 217.735 175.083 1.00 0.17 C ATOM 1392 C VAL A 466 321.495 217.848 174.019 1.00 0.18 C ATOM 1393 O VAL A 466 321.227 218.242 172.881 1.00 0.19 O ATOM 1394 CB VAL A 466 320.544 218.874 176.105 1.00 0.18 C ATOM 1395 CG1 VAL A 466 320.563 220.243 175.409 1.00 0.20 C ATOM 1396 CG2 VAL A 466 319.356 218.822 177.066 1.00 0.20 C ATOM 0 H VAL A 466 320.704 216.522 176.767 1.00 0.17 H new ATOM 0 HA VAL A 466 319.432 217.806 174.605 1.00 0.17 H new ATOM 0 HB VAL A 466 321.483 218.746 176.644 1.00 0.18 H new ATOM 0 HG11 VAL A 466 320.659 221.030 176.157 1.00 0.20 H new ATOM 0 HG12 VAL A 466 321.408 220.290 174.722 1.00 0.20 H new ATOM 0 HG13 VAL A 466 319.635 220.382 174.854 1.00 0.20 H new ATOM 0 HG21 VAL A 466 319.443 219.627 177.796 1.00 0.20 H new ATOM 0 HG22 VAL A 466 318.429 218.939 176.505 1.00 0.20 H new ATOM 0 HG23 VAL A 466 319.348 217.863 177.583 1.00 0.20 H new ATOM 1406 N ALA A 467 322.723 217.491 174.394 1.00 0.18 N ATOM 1407 CA ALA A 467 323.841 217.543 173.464 1.00 0.21 C ATOM 1408 C ALA A 467 323.588 216.619 172.276 1.00 0.23 C ATOM 1409 O ALA A 467 323.878 216.978 171.138 1.00 0.25 O ATOM 1410 CB ALA A 467 325.141 217.144 174.185 1.00 0.23 C ATOM 0 H ALA A 467 322.964 217.165 175.330 1.00 0.18 H new ATOM 0 HA ALA A 467 323.942 218.562 173.091 1.00 0.21 H new ATOM 0 HB1 ALA A 467 325.974 217.185 173.483 1.00 0.23 H new ATOM 0 HB2 ALA A 467 325.326 217.833 175.009 1.00 0.23 H new ATOM 0 HB3 ALA A 467 325.045 216.131 174.575 1.00 0.23 H new ATOM 1416 N ALA A 468 323.048 215.430 172.549 1.00 0.24 N ATOM 1417 CA ALA A 468 322.765 214.454 171.500 1.00 0.28 C ATOM 1418 C ALA A 468 321.583 214.896 170.638 1.00 0.29 C ATOM 1419 O ALA A 468 321.457 214.476 169.492 1.00 0.33 O ATOM 1420 CB ALA A 468 322.478 213.082 172.132 1.00 0.31 C ATOM 0 H ALA A 468 322.798 215.121 173.489 1.00 0.24 H new ATOM 0 HA ALA A 468 323.640 214.380 170.854 1.00 0.28 H new ATOM 0 HB1 ALA A 468 322.267 212.356 171.346 1.00 0.31 H new ATOM 0 HB2 ALA A 468 323.347 212.756 172.704 1.00 0.31 H new ATOM 0 HB3 ALA A 468 321.616 213.160 172.795 1.00 0.31 H new ATOM 1426 N GLN A 469 320.702 215.713 171.207 1.00 0.27 N ATOM 1427 CA GLN A 469 319.528 216.186 170.474 1.00 0.29 C ATOM 1428 C GLN A 469 319.941 217.112 169.340 1.00 0.29 C ATOM 1429 O GLN A 469 319.529 216.933 168.194 1.00 0.33 O ATOM 1430 CB GLN A 469 318.598 216.945 171.416 1.00 0.29 C ATOM 1431 CG GLN A 469 317.795 215.952 172.253 1.00 0.32 C ATOM 1432 CD GLN A 469 316.649 215.382 171.430 1.00 0.88 C ATOM 1433 OE1 GLN A 469 316.013 216.106 170.664 1.00 1.63 O ATOM 1434 NE2 GLN A 469 316.346 214.119 171.544 1.00 1.54 N ATOM 0 H GLN A 469 320.775 216.060 172.164 1.00 0.27 H new ATOM 0 HA GLN A 469 319.013 215.319 170.061 1.00 0.29 H new ATOM 0 HB2 GLN A 469 319.178 217.599 172.067 1.00 0.29 H new ATOM 0 HB3 GLN A 469 317.924 217.582 170.843 1.00 0.29 H new ATOM 0 HG2 GLN A 469 318.443 215.146 172.596 1.00 0.32 H new ATOM 0 HG3 GLN A 469 317.404 216.446 173.142 1.00 0.32 H new ATOM 0 HE21 GLN A 469 316.876 213.523 172.180 1.00 1.54 H new ATOM 0 HE22 GLN A 469 315.579 213.727 170.997 1.00 1.54 H new ATOM 1443 N ARG A 470 320.796 218.075 169.664 1.00 0.26 N ATOM 1444 CA ARG A 470 321.289 218.992 168.645 1.00 0.26 C ATOM 1445 C ARG A 470 322.103 218.218 167.659 1.00 0.32 C ATOM 1446 O ARG A 470 321.726 218.040 166.500 1.00 0.39 O ATOM 1447 CB ARG A 470 322.211 220.021 169.250 1.00 0.26 C ATOM 1448 CG ARG A 470 321.426 220.984 170.106 1.00 1.11 C ATOM 1449 CD ARG A 470 322.362 222.100 170.511 1.00 1.60 C ATOM 1450 NE ARG A 470 321.599 223.071 171.275 1.00 2.26 N ATOM 1451 CZ ARG A 470 322.021 224.301 171.443 1.00 2.92 C ATOM 1452 NH1 ARG A 470 323.092 224.705 170.810 1.00 3.18 N ATOM 1453 NH2 ARG A 470 321.356 225.121 172.203 1.00 3.82 N ATOM 0 H ARG A 470 321.156 218.239 170.604 1.00 0.26 H new ATOM 0 HA ARG A 470 320.431 219.480 168.182 1.00 0.26 H new ATOM 0 HB2 ARG A 470 322.974 219.527 169.851 1.00 0.26 H new ATOM 0 HB3 ARG A 470 322.730 220.564 168.460 1.00 0.26 H new ATOM 0 HG2 ARG A 470 320.574 221.380 169.554 1.00 1.11 H new ATOM 0 HG3 ARG A 470 321.029 220.478 170.986 1.00 1.11 H new ATOM 0 HD2 ARG A 470 323.186 221.709 171.107 1.00 1.60 H new ATOM 0 HD3 ARG A 470 322.801 222.568 169.630 1.00 1.60 H new ATOM 0 HE ARG A 470 320.712 222.789 171.692 1.00 2.26 H new ATOM 0 HH11 ARG A 470 323.591 224.065 170.192 1.00 3.18 H new ATOM 0 HH12 ARG A 470 323.428 225.660 170.934 1.00 3.18 H new ATOM 0 HH21 ARG A 470 320.505 224.807 172.669 1.00 3.82 H new ATOM 0 HH22 ARG A 470 321.686 226.077 172.333 1.00 3.82 H new ATOM 1467 N HIS A 471 323.176 217.659 168.179 1.00 0.35 N ATOM 1468 CA HIS A 471 323.988 216.790 167.390 1.00 0.43 C ATOM 1469 C HIS A 471 323.095 215.667 166.969 1.00 0.86 C ATOM 1470 O HIS A 471 322.063 215.424 167.583 1.00 1.39 O ATOM 1471 CB HIS A 471 325.134 216.194 168.228 1.00 0.88 C ATOM 1472 CG HIS A 471 326.423 216.960 168.082 1.00 1.49 C ATOM 1473 ND1 HIS A 471 327.463 216.767 168.975 1.00 2.48 N ATOM 1474 CD2 HIS A 471 326.890 217.872 167.158 1.00 2.24 C ATOM 1475 CE1 HIS A 471 328.491 217.534 168.582 1.00 3.26 C ATOM 1476 NE2 HIS A 471 328.197 218.229 167.480 1.00 3.14 N ATOM 0 H HIS A 471 323.495 217.796 169.138 1.00 0.35 H new ATOM 0 HA HIS A 471 324.422 217.334 166.551 1.00 0.43 H new ATOM 0 HB2 HIS A 471 324.841 216.181 169.278 1.00 0.88 H new ATOM 0 HB3 HIS A 471 325.296 215.158 167.929 1.00 0.88 H new ATOM 0 HD2 HIS A 471 326.329 218.250 166.316 1.00 2.24 H new ATOM 0 HE1 HIS A 471 329.441 217.583 169.094 1.00 3.26 H new ATOM 0 HE2 HIS A 471 328.801 218.882 166.981 1.00 3.14 H new TER 1484 HIS A 471 END