USER MOD reduce.3.24.130724 H: found=0, std=0, add=513, rem=0, adj=11 USER MOD reduce.3.24.130724 removed 516 hydrogens (0 hets) HEADER DOUBLE-STRANDED DNA BINDING DOMAIN 22-JAN-97 1AA3 TITLE C-TERMINAL DOMAIN OF THE E. COLI RECA, NMR, MINIMIZED AVERAGE TITLE 2 STRUCTURE COMPND MOL_ID: 1; COMPND 2 MOLECULE: RECA; COMPND 3 CHAIN: A; COMPND 4 FRAGMENT: C-TERMINAL DOMAIN SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; SOURCE 3 ORGANISM_TAXID: 83333; SOURCE 4 STRAIN: K12 KEYWDS DOUBLE-STRANDED DNA BINDING DOMAIN, RIKEN STRUCTURAL KEYWDS 2 GENOMICS/PROTEOMICS INITIATIVE, RSGI, STRUCTURAL GENOMICS EXPDTA SOLUTION NMR AUTHOR H.AIHARA,Y.ITO,H.KURUMIZAKA,T.TERADA,S.YOKOYAMA,T.SHIBATA,RIKEN AUTHOR 2 STRUCTURAL GENOMICS/PROTEOMICS INITIATIVE (RSGI) REVDAT 3 13-JUL-11 1AA3 1 VERSN REVDAT 2 24-FEB-09 1AA3 1 VERSN REVDAT 1 23-JUL-97 1AA3 0 JRNL AUTH H.AIHARA,Y.ITO,H.KURUMIZAKA,T.TERADA,S.YOKOYAMA,T.SHIBATA JRNL TITL AN INTERACTION BETWEEN A SPECIFIED SURFACE OF THE C-TERMINAL JRNL TITL 2 DOMAIN OF RECA PROTEIN AND DOUBLE-STRANDED DNA FOR JRNL TITL 3 HOMOLOGOUS PAIRING. JRNL REF J.MOL.BIOL. V. 274 213 1997 JRNL REFN ISSN 0022-2836 JRNL PMID 9398528 JRNL DOI 10.1006/JMBI.1997.1403 REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : X-PLOR 3.1 REMARK 3 AUTHORS : BRUNGER REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: SIMULATED ANNEALING REFINEMENT FOR NMR REMARK 3 STRUCTURE DETERMINATION REMARK 4 REMARK 4 1AA3 COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY BNL. REMARK 210 REMARK 210 EXPERIMENTAL DETAILS REMARK 210 EXPERIMENT TYPE : NMR REMARK 210 TEMPERATURE (KELVIN) : 303 REMARK 210 PH : 6.5 REMARK 210 IONIC STRENGTH : NULL REMARK 210 PRESSURE : NULL REMARK 210 SAMPLE CONTENTS : NULL REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : 1H-1H NOESY; 1H-1H TOCSY; 1H-15N REMARK 210 HSQC; HMQC-J; 3D 15N-SEPARATED REMARK 210 TOCSY; 15N-SEPARATED NOESY; HNHB REMARK 210 SPECTROMETER FIELD STRENGTH : 600 MHZ REMARK 210 SPECTROMETER MODEL : AMX600; ARX400 REMARK 210 SPECTROMETER MANUFACTURER : BRUKER REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : AZARA 1.0, FELIX 2.3, X-PLOR 3.1 REMARK 210 METHOD USED : HYBRID DISTANCE GEOMETRY- REMARK 210 SIMULATED ANNEALING REMARK 210 REMARK 210 CONFORMERS, NUMBER CALCULATED : 50 REMARK 210 CONFORMERS, NUMBER SUBMITTED : 1 REMARK 210 CONFORMERS, SELECTION CRITERIA : AVERAGED MINIMIZED 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 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 O TYR A 293 H GLY A 295 1.50 REMARK 500 O GLU A 318 H LYS A 322 1.50 REMARK 500 O LYS A 321 H GLU A 325 1.50 REMARK 500 HZ1 LYS A 286 O GLY A 288 1.52 REMARK 500 O GLU A 320 H ARG A 324 1.58 REMARK 500 O ASN A 312 H ALA A 316 1.60 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: TORSION ANGLES REMARK 500 REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS: REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2) REMARK 500 REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI- REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400 REMARK 500 REMARK 500 M RES CSSEQI PSI PHI REMARK 500 ASN A 269 -100.10 43.89 REMARK 500 PHE A 270 -97.34 160.96 REMARK 500 TYR A 271 -2.24 82.21 REMARK 500 GLU A 281 -76.72 -96.96 REMARK 500 LYS A 282 39.18 167.51 REMARK 500 LYS A 294 52.40 -61.33 REMARK 500 GLN A 300 172.39 -46.75 REMARK 500 ASN A 304 32.94 -161.44 REMARK 500 ASN A 312 61.01 -106.35 REMARK 500 ALA A 316 -22.92 -36.63 REMARK 500 ILE A 319 -70.97 -66.31 REMARK 500 SER A 329 44.28 -86.72 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: PLANAR GROUPS REMARK 500 REMARK 500 PLANAR GROUPS IN THE FOLLOWING RESIDUES HAVE A TOTAL REMARK 500 RMS DISTANCE OF ALL ATOMS FROM THE BEST-FIT PLANE REMARK 500 BY MORE THAN AN EXPECTED VALUE OF 6*RMSD, WITH AN REMARK 500 RMSD 0.02 ANGSTROMS, OR AT LEAST ONE ATOM HAS REMARK 500 AN RMSD GREATER THAN THIS VALUE REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 M RES CSSEQI RMS TYPE REMARK 500 ARG A 324 0.09 SIDE CHAIN REMARK 500 REMARK 500 REMARK: NULL REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: MY_001000015.1 RELATED DB: TARGETDB DBREF 1AA3 A 268 330 UNP P0A7G6 RECA_ECOLI 268 330 SEQRES 1 A 63 ILE ASN PHE TYR GLY GLU LEU VAL ASP LEU GLY VAL LYS SEQRES 2 A 63 GLU LYS LEU ILE GLU LYS ALA GLY ALA TRP TYR SER TYR SEQRES 3 A 63 LYS GLY GLU LYS ILE GLY GLN GLY LYS ALA ASN ALA THR SEQRES 4 A 63 ALA TRP LEU LYS ASP ASN PRO GLU THR ALA LYS GLU ILE SEQRES 5 A 63 GLU LYS LYS VAL ARG GLU LEU LEU LEU SER ASN HELIX 1 H1 PHE A 270 LYS A 280 1 11 HELIX 2 H2 ASN A 304 ASP A 311 1 8 HELIX 3 H3 GLU A 314 GLU A 325 1 12 SHEET 1 S1 2 ILE A 284 ALA A 287 0 SHEET 2 S1 2 TRP A 290 TYR A 293 -1 N SER A 292 O GLU A 285 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 294 LYS NZ :NH3+ -167:sc= 0.237! (180deg=0) USER MOD Set 1.2: A 315 THR OG1 : rot 91:sc= -4.09! USER MOD Single : A 269 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 271 TYR OH : rot 73:sc= -6.43! USER MOD Single : A 280 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 282 LYS NZ :NH3+ -150:sc= -0.0325 (180deg=-0.47) USER MOD Single : A 286 LYS NZ :NH3+ -149:sc= -0.395 (180deg=-1.65!) USER MOD Single : A 291 TYR OH : rot 180:sc= 0 USER MOD Single : A 292 SER OG : rot 180:sc= -4.38! USER MOD Single : A 293 TYR OH : rot -130:sc= -7.03! USER MOD Single : A 297 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 300 GLN : amide:sc= -1.17 K(o=-1.2,f=-3!) USER MOD Single : A 302 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 304 ASN : amide:sc= -5.69! C(o=-5.7!,f=-4.1!) USER MOD Single : A 306 THR OG1 : rot 108:sc= -6.9! USER MOD Single : A 310 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 312 ASN : amide:sc= -11.2! C(o=-11!,f=-8.4!) USER MOD Single : A 317 LYS NZ :NH3+ -162:sc= 0.359 (180deg=0.225) USER MOD Single : A 321 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 322 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 329 SER OG : rot 180:sc= 0 USER MOD Single : A 330 ASN : amide:sc= -0.8! C(o=-0.8!,f=-1.2!) USER MOD ----------------------------------------------------------------- ATOM 1 N ILE A 268 -2.571 14.272 1.612 1.00 3.98 N ATOM 2 CA ILE A 268 -3.055 13.408 2.727 1.00 3.66 C ATOM 3 C ILE A 268 -2.783 11.941 2.393 1.00 2.89 C ATOM 4 O ILE A 268 -1.736 11.409 2.704 1.00 3.01 O ATOM 5 CB ILE A 268 -4.560 13.614 2.933 1.00 4.26 C ATOM 6 CG1 ILE A 268 -5.205 14.069 1.620 1.00 5.00 C ATOM 7 CG2 ILE A 268 -4.787 14.678 4.008 1.00 4.35 C ATOM 8 CD1 ILE A 268 -6.675 13.645 1.599 1.00 6.15 C ATOM 0 HA ILE A 268 -2.528 13.678 3.642 1.00 3.66 H new ATOM 0 HB ILE A 268 -5.012 12.674 3.249 1.00 4.26 H new ATOM 0 HG12 ILE A 268 -5.126 15.152 1.520 1.00 5.00 H new ATOM 0 HG13 ILE A 268 -4.677 13.631 0.773 1.00 5.00 H new ATOM 0 HG21 ILE A 268 -5.857 14.825 4.155 1.00 4.35 H new ATOM 0 HG22 ILE A 268 -4.334 14.352 4.944 1.00 4.35 H new ATOM 0 HG23 ILE A 268 -4.332 15.617 3.692 1.00 4.35 H new ATOM 0 HD11 ILE A 268 -7.134 13.969 0.665 1.00 6.15 H new ATOM 0 HD12 ILE A 268 -6.742 12.560 1.679 1.00 6.15 H new ATOM 0 HD13 ILE A 268 -7.198 14.104 2.438 1.00 6.15 H new ATOM 22 N ASN A 269 -3.719 11.280 1.765 1.00 2.74 N ATOM 23 CA ASN A 269 -3.511 9.845 1.417 1.00 2.59 C ATOM 24 C ASN A 269 -2.893 9.120 2.619 1.00 1.75 C ATOM 25 O ASN A 269 -3.581 8.769 3.557 1.00 2.22 O ATOM 26 CB ASN A 269 -2.575 9.744 0.209 1.00 3.47 C ATOM 27 CG ASN A 269 -3.251 10.360 -1.016 1.00 4.41 C ATOM 28 OD1 ASN A 269 -4.105 9.749 -1.627 1.00 5.00 O ATOM 29 ND2 ASN A 269 -2.901 11.556 -1.404 1.00 4.99 N ATOM 0 H ASN A 269 -4.616 11.671 1.479 1.00 2.74 H new ATOM 0 HA ASN A 269 -4.466 9.382 1.168 1.00 2.59 H new ATOM 0 HB2 ASN A 269 -1.638 10.260 0.418 1.00 3.47 H new ATOM 0 HB3 ASN A 269 -2.327 8.701 0.014 1.00 3.47 H new ATOM 0 HD21 ASN A 269 -3.344 11.978 -2.220 1.00 4.99 H new ATOM 0 HD22 ASN A 269 -2.184 12.069 -0.891 1.00 4.99 H new ATOM 36 N PHE A 270 -1.602 8.903 2.604 1.00 1.16 N ATOM 37 CA PHE A 270 -0.939 8.211 3.747 1.00 0.51 C ATOM 38 C PHE A 270 0.425 7.664 3.302 1.00 0.68 C ATOM 39 O PHE A 270 1.396 8.387 3.292 1.00 1.71 O ATOM 40 CB PHE A 270 -1.819 7.070 4.269 1.00 1.23 C ATOM 41 CG PHE A 270 -2.552 6.362 3.145 1.00 1.00 C ATOM 42 CD1 PHE A 270 -2.112 6.444 1.809 1.00 1.83 C ATOM 43 CD2 PHE A 270 -3.672 5.583 3.457 1.00 1.30 C ATOM 44 CE1 PHE A 270 -2.792 5.756 0.809 1.00 2.14 C ATOM 45 CE2 PHE A 270 -4.343 4.890 2.450 1.00 1.57 C ATOM 46 CZ PHE A 270 -3.901 4.980 1.128 1.00 1.73 C ATOM 0 H PHE A 270 -0.978 9.177 1.845 1.00 1.16 H new ATOM 0 HA PHE A 270 -0.792 8.929 4.554 1.00 0.51 H new ATOM 0 HB2 PHE A 270 -1.201 6.352 4.808 1.00 1.23 H new ATOM 0 HB3 PHE A 270 -2.543 7.466 4.981 1.00 1.23 H new ATOM 0 HD1 PHE A 270 -1.247 7.041 1.561 1.00 1.83 H new ATOM 0 HD2 PHE A 270 -4.017 5.519 4.478 1.00 1.30 H new ATOM 0 HE1 PHE A 270 -2.458 5.825 -0.216 1.00 2.14 H new ATOM 0 HE2 PHE A 270 -5.204 4.284 2.692 1.00 1.57 H new ATOM 0 HZ PHE A 270 -4.423 4.444 0.349 1.00 1.73 H new ATOM 56 N TYR A 271 0.497 6.396 2.948 1.00 0.54 N ATOM 57 CA TYR A 271 1.786 5.771 2.496 1.00 0.59 C ATOM 58 C TYR A 271 2.628 5.363 3.710 1.00 0.85 C ATOM 59 O TYR A 271 3.684 4.778 3.587 1.00 1.81 O ATOM 60 CB TYR A 271 2.577 6.747 1.623 1.00 0.71 C ATOM 61 CG TYR A 271 1.906 6.923 0.278 1.00 0.52 C ATOM 62 CD1 TYR A 271 0.594 6.477 0.076 1.00 1.37 C ATOM 63 CD2 TYR A 271 2.594 7.557 -0.762 1.00 1.19 C ATOM 64 CE1 TYR A 271 -0.029 6.669 -1.162 1.00 1.36 C ATOM 65 CE2 TYR A 271 1.974 7.743 -1.999 1.00 1.22 C ATOM 66 CZ TYR A 271 0.664 7.303 -2.199 1.00 0.56 C ATOM 67 OH TYR A 271 0.056 7.501 -3.416 1.00 0.75 O ATOM 0 H TYR A 271 -0.299 5.758 2.954 1.00 0.54 H new ATOM 0 HA TYR A 271 1.551 4.884 1.908 1.00 0.59 H new ATOM 0 HB2 TYR A 271 2.655 7.711 2.125 1.00 0.71 H new ATOM 0 HB3 TYR A 271 3.593 6.377 1.483 1.00 0.71 H new ATOM 0 HD1 TYR A 271 0.062 5.984 0.877 1.00 1.37 H new ATOM 0 HD2 TYR A 271 3.605 7.903 -0.608 1.00 1.19 H new ATOM 0 HE1 TYR A 271 -1.042 6.329 -1.317 1.00 1.36 H new ATOM 0 HE2 TYR A 271 2.508 8.228 -2.802 1.00 1.22 H new ATOM 0 HH TYR A 271 -0.614 8.211 -3.335 1.00 0.75 H new ATOM 77 N GLY A 272 2.146 5.647 4.875 1.00 0.46 N ATOM 78 CA GLY A 272 2.869 5.278 6.123 1.00 0.62 C ATOM 79 C GLY A 272 1.960 4.360 6.924 1.00 0.61 C ATOM 80 O GLY A 272 2.376 3.362 7.475 1.00 0.77 O ATOM 0 H GLY A 272 1.261 6.131 5.025 1.00 0.46 H new ATOM 0 HA2 GLY A 272 3.808 4.777 5.888 1.00 0.62 H new ATOM 0 HA3 GLY A 272 3.118 6.169 6.699 1.00 0.62 H new ATOM 84 N GLU A 273 0.702 4.684 6.940 1.00 0.49 N ATOM 85 CA GLU A 273 -0.297 3.842 7.638 1.00 0.50 C ATOM 86 C GLU A 273 -0.897 2.939 6.564 1.00 0.47 C ATOM 87 O GLU A 273 -1.376 1.854 6.821 1.00 0.55 O ATOM 88 CB GLU A 273 -1.356 4.759 8.278 1.00 0.56 C ATOM 89 CG GLU A 273 -2.757 4.463 7.731 1.00 1.48 C ATOM 90 CD GLU A 273 -3.784 5.335 8.456 1.00 1.73 C ATOM 91 OE1 GLU A 273 -3.783 5.327 9.676 1.00 2.44 O ATOM 92 OE2 GLU A 273 -4.554 5.995 7.778 1.00 1.89 O ATOM 0 H GLU A 273 0.318 5.514 6.489 1.00 0.49 H new ATOM 0 HA GLU A 273 0.131 3.239 8.439 1.00 0.50 H new ATOM 0 HB2 GLU A 273 -1.350 4.624 9.360 1.00 0.56 H new ATOM 0 HB3 GLU A 273 -1.101 5.801 8.085 1.00 0.56 H new ATOM 0 HG2 GLU A 273 -2.789 4.660 6.659 1.00 1.48 H new ATOM 0 HG3 GLU A 273 -2.997 3.409 7.869 1.00 1.48 H new ATOM 99 N LEU A 274 -0.822 3.399 5.347 1.00 0.40 N ATOM 100 CA LEU A 274 -1.320 2.615 4.195 1.00 0.38 C ATOM 101 C LEU A 274 -0.445 1.377 4.103 1.00 0.34 C ATOM 102 O LEU A 274 -0.913 0.258 4.173 1.00 0.43 O ATOM 103 CB LEU A 274 -1.173 3.453 2.919 1.00 0.39 C ATOM 104 CG LEU A 274 -1.154 2.557 1.698 1.00 0.60 C ATOM 105 CD1 LEU A 274 -2.571 2.028 1.472 1.00 1.47 C ATOM 106 CD2 LEU A 274 -0.682 3.397 0.514 1.00 1.58 C ATOM 0 H LEU A 274 -0.426 4.307 5.102 1.00 0.40 H new ATOM 0 HA LEU A 274 -2.369 2.343 4.314 1.00 0.38 H new ATOM 0 HB2 LEU A 274 -1.998 4.162 2.845 1.00 0.39 H new ATOM 0 HB3 LEU A 274 -0.254 4.037 2.964 1.00 0.39 H new ATOM 0 HG LEU A 274 -0.482 1.708 1.823 1.00 0.60 H new ATOM 0 HD11 LEU A 274 -2.582 1.379 0.596 1.00 1.47 H new ATOM 0 HD12 LEU A 274 -2.892 1.462 2.347 1.00 1.47 H new ATOM 0 HD13 LEU A 274 -3.251 2.865 1.312 1.00 1.47 H new ATOM 0 HD21 LEU A 274 -0.657 2.779 -0.384 1.00 1.58 H new ATOM 0 HD22 LEU A 274 -1.368 4.230 0.362 1.00 1.58 H new ATOM 0 HD23 LEU A 274 0.317 3.783 0.717 1.00 1.58 H new ATOM 118 N VAL A 275 0.840 1.578 3.985 1.00 0.29 N ATOM 119 CA VAL A 275 1.749 0.416 3.934 1.00 0.28 C ATOM 120 C VAL A 275 1.573 -0.319 5.256 1.00 0.26 C ATOM 121 O VAL A 275 1.693 -1.522 5.344 1.00 0.29 O ATOM 122 CB VAL A 275 3.197 0.895 3.785 1.00 0.31 C ATOM 123 CG1 VAL A 275 4.130 -0.312 3.674 1.00 0.41 C ATOM 124 CG2 VAL A 275 3.322 1.748 2.521 1.00 0.53 C ATOM 0 H VAL A 275 1.289 2.492 3.923 1.00 0.29 H new ATOM 0 HA VAL A 275 1.525 -0.233 3.087 1.00 0.28 H new ATOM 0 HB VAL A 275 3.473 1.487 4.657 1.00 0.31 H new ATOM 0 HG11 VAL A 275 5.159 0.032 3.568 1.00 0.41 H new ATOM 0 HG12 VAL A 275 4.042 -0.923 4.572 1.00 0.41 H new ATOM 0 HG13 VAL A 275 3.855 -0.906 2.802 1.00 0.41 H new ATOM 0 HG21 VAL A 275 4.351 2.090 2.413 1.00 0.53 H new ATOM 0 HG22 VAL A 275 3.044 1.153 1.651 1.00 0.53 H new ATOM 0 HG23 VAL A 275 2.659 2.610 2.597 1.00 0.53 H new ATOM 134 N ASP A 276 1.261 0.419 6.287 1.00 0.30 N ATOM 135 CA ASP A 276 1.049 -0.201 7.617 1.00 0.41 C ATOM 136 C ASP A 276 -0.312 -0.899 7.640 1.00 0.47 C ATOM 137 O ASP A 276 -0.577 -1.739 8.477 1.00 0.60 O ATOM 138 CB ASP A 276 1.083 0.882 8.697 1.00 0.44 C ATOM 139 CG ASP A 276 1.373 0.242 10.055 1.00 0.65 C ATOM 140 OD1 ASP A 276 0.583 -0.586 10.480 1.00 1.40 O ATOM 141 OD2 ASP A 276 2.381 0.590 10.649 1.00 1.25 O ATOM 0 H ASP A 276 1.144 1.432 6.260 1.00 0.30 H new ATOM 0 HA ASP A 276 1.837 -0.929 7.808 1.00 0.41 H new ATOM 0 HB2 ASP A 276 1.848 1.621 8.461 1.00 0.44 H new ATOM 0 HB3 ASP A 276 0.129 1.409 8.728 1.00 0.44 H new ATOM 146 N LEU A 277 -1.177 -0.555 6.726 1.00 0.52 N ATOM 147 CA LEU A 277 -2.514 -1.188 6.686 1.00 0.63 C ATOM 148 C LEU A 277 -2.459 -2.402 5.766 1.00 0.66 C ATOM 149 O LEU A 277 -3.016 -3.432 6.063 1.00 0.95 O ATOM 150 CB LEU A 277 -3.537 -0.181 6.159 1.00 0.79 C ATOM 151 CG LEU A 277 -4.838 -0.311 6.955 1.00 1.06 C ATOM 152 CD1 LEU A 277 -5.237 -1.784 7.047 1.00 1.59 C ATOM 153 CD2 LEU A 277 -4.630 0.249 8.364 1.00 1.64 C ATOM 0 H LEU A 277 -1.008 0.143 6.002 1.00 0.52 H new ATOM 0 HA LEU A 277 -2.808 -1.503 7.687 1.00 0.63 H new ATOM 0 HB2 LEU A 277 -3.144 0.832 6.247 1.00 0.79 H new ATOM 0 HB3 LEU A 277 -3.726 -0.359 5.100 1.00 0.79 H new ATOM 0 HG LEU A 277 -5.628 0.248 6.453 1.00 1.06 H new ATOM 0 HD11 LEU A 277 -6.163 -1.875 7.614 1.00 1.59 H new ATOM 0 HD12 LEU A 277 -5.384 -2.184 6.044 1.00 1.59 H new ATOM 0 HD13 LEU A 277 -4.448 -2.344 7.549 1.00 1.59 H new ATOM 0 HD21 LEU A 277 -5.556 0.157 8.932 1.00 1.64 H new ATOM 0 HD22 LEU A 277 -3.840 -0.310 8.865 1.00 1.64 H new ATOM 0 HD23 LEU A 277 -4.346 1.299 8.300 1.00 1.64 H new ATOM 165 N GLY A 278 -1.789 -2.279 4.648 1.00 0.51 N ATOM 166 CA GLY A 278 -1.692 -3.422 3.692 1.00 0.58 C ATOM 167 C GLY A 278 -0.762 -4.496 4.260 1.00 0.49 C ATOM 168 O GLY A 278 -1.157 -5.613 4.497 1.00 0.61 O ATOM 0 H GLY A 278 -1.303 -1.431 4.356 1.00 0.51 H new ATOM 0 HA2 GLY A 278 -2.681 -3.843 3.513 1.00 0.58 H new ATOM 0 HA3 GLY A 278 -1.315 -3.073 2.731 1.00 0.58 H new ATOM 172 N VAL A 279 0.466 -4.165 4.493 1.00 0.37 N ATOM 173 CA VAL A 279 1.407 -5.166 5.066 1.00 0.36 C ATOM 174 C VAL A 279 0.693 -5.845 6.234 1.00 0.42 C ATOM 175 O VAL A 279 0.919 -6.998 6.542 1.00 0.60 O ATOM 176 CB VAL A 279 2.681 -4.470 5.557 1.00 0.29 C ATOM 177 CG1 VAL A 279 3.765 -5.519 5.811 1.00 0.46 C ATOM 178 CG2 VAL A 279 3.179 -3.481 4.495 1.00 0.25 C ATOM 0 H VAL A 279 0.866 -3.244 4.313 1.00 0.37 H new ATOM 0 HA VAL A 279 1.695 -5.900 4.313 1.00 0.36 H new ATOM 0 HB VAL A 279 2.461 -3.931 6.478 1.00 0.29 H new ATOM 0 HG11 VAL A 279 4.673 -5.027 6.160 1.00 0.46 H new ATOM 0 HG12 VAL A 279 3.420 -6.223 6.568 1.00 0.46 H new ATOM 0 HG13 VAL A 279 3.976 -6.055 4.886 1.00 0.46 H new ATOM 0 HG21 VAL A 279 4.085 -2.990 4.851 1.00 0.25 H new ATOM 0 HG22 VAL A 279 3.396 -4.018 3.571 1.00 0.25 H new ATOM 0 HG23 VAL A 279 2.410 -2.732 4.307 1.00 0.25 H new ATOM 188 N LYS A 280 -0.204 -5.128 6.858 1.00 0.34 N ATOM 189 CA LYS A 280 -0.991 -5.699 7.979 1.00 0.42 C ATOM 190 C LYS A 280 -2.253 -6.326 7.387 1.00 0.48 C ATOM 191 O LYS A 280 -2.779 -7.302 7.885 1.00 0.64 O ATOM 192 CB LYS A 280 -1.374 -4.581 8.945 1.00 0.47 C ATOM 193 CG LYS A 280 -2.302 -5.137 10.027 1.00 0.96 C ATOM 194 CD LYS A 280 -1.527 -5.270 11.337 1.00 1.61 C ATOM 195 CE LYS A 280 -1.528 -6.733 11.786 1.00 2.40 C ATOM 196 NZ LYS A 280 -0.381 -6.971 12.706 1.00 3.27 N ATOM 0 H LYS A 280 -0.424 -4.158 6.632 1.00 0.34 H new ATOM 0 HA LYS A 280 -0.412 -6.448 8.519 1.00 0.42 H new ATOM 0 HB2 LYS A 280 -0.479 -4.157 9.401 1.00 0.47 H new ATOM 0 HB3 LYS A 280 -1.869 -3.774 8.406 1.00 0.47 H new ATOM 0 HG2 LYS A 280 -3.158 -4.476 10.163 1.00 0.96 H new ATOM 0 HG3 LYS A 280 -2.694 -6.108 9.723 1.00 0.96 H new ATOM 0 HD2 LYS A 280 -0.503 -4.921 11.203 1.00 1.61 H new ATOM 0 HD3 LYS A 280 -1.980 -4.643 12.105 1.00 1.61 H new ATOM 0 HE2 LYS A 280 -2.466 -6.970 12.288 1.00 2.40 H new ATOM 0 HE3 LYS A 280 -1.456 -7.390 10.920 1.00 2.40 H new ATOM 0 HZ1 LYS A 280 -0.381 -7.965 13.011 1.00 3.27 H new ATOM 0 HZ2 LYS A 280 0.510 -6.761 12.212 1.00 3.27 H new ATOM 0 HZ3 LYS A 280 -0.469 -6.353 13.538 1.00 3.27 H new ATOM 210 N GLU A 281 -2.717 -5.777 6.295 1.00 0.44 N ATOM 211 CA GLU A 281 -3.913 -6.324 5.612 1.00 0.56 C ATOM 212 C GLU A 281 -3.410 -7.219 4.497 1.00 0.60 C ATOM 213 O GLU A 281 -3.387 -8.427 4.620 1.00 1.35 O ATOM 214 CB GLU A 281 -4.736 -5.185 5.008 1.00 0.63 C ATOM 215 CG GLU A 281 -5.668 -4.604 6.074 1.00 0.73 C ATOM 216 CD GLU A 281 -6.489 -5.730 6.708 1.00 1.43 C ATOM 217 OE1 GLU A 281 -6.589 -6.781 6.095 1.00 1.95 O ATOM 218 OE2 GLU A 281 -7.005 -5.522 7.793 1.00 2.07 O ATOM 0 H GLU A 281 -2.306 -4.959 5.845 1.00 0.44 H new ATOM 0 HA GLU A 281 -4.542 -6.872 6.313 1.00 0.56 H new ATOM 0 HB2 GLU A 281 -4.074 -4.408 4.626 1.00 0.63 H new ATOM 0 HB3 GLU A 281 -5.318 -5.552 4.163 1.00 0.63 H new ATOM 0 HG2 GLU A 281 -5.086 -4.090 6.839 1.00 0.73 H new ATOM 0 HG3 GLU A 281 -6.332 -3.864 5.627 1.00 0.73 H new ATOM 225 N LYS A 282 -2.961 -6.632 3.423 1.00 0.50 N ATOM 226 CA LYS A 282 -2.413 -7.458 2.327 1.00 0.48 C ATOM 227 C LYS A 282 -2.221 -6.647 1.043 1.00 0.50 C ATOM 228 O LYS A 282 -2.430 -7.146 -0.045 1.00 0.88 O ATOM 229 CB LYS A 282 -3.354 -8.633 2.060 1.00 0.57 C ATOM 230 CG LYS A 282 -4.810 -8.164 2.159 1.00 1.63 C ATOM 231 CD LYS A 282 -5.414 -8.078 0.755 1.00 2.21 C ATOM 232 CE LYS A 282 -6.526 -9.119 0.612 1.00 3.02 C ATOM 233 NZ LYS A 282 -5.965 -10.478 0.853 1.00 3.78 N ATOM 0 H LYS A 282 -2.952 -5.625 3.263 1.00 0.50 H new ATOM 0 HA LYS A 282 -1.433 -7.822 2.636 1.00 0.48 H new ATOM 0 HB2 LYS A 282 -3.162 -9.047 1.070 1.00 0.57 H new ATOM 0 HB3 LYS A 282 -3.169 -9.430 2.780 1.00 0.57 H new ATOM 0 HG2 LYS A 282 -5.386 -8.857 2.773 1.00 1.63 H new ATOM 0 HG3 LYS A 282 -4.858 -7.191 2.647 1.00 1.63 H new ATOM 0 HD2 LYS A 282 -5.812 -7.079 0.580 1.00 2.21 H new ATOM 0 HD3 LYS A 282 -4.642 -8.250 0.005 1.00 2.21 H new ATOM 0 HE2 LYS A 282 -7.326 -8.913 1.323 1.00 3.02 H new ATOM 0 HE3 LYS A 282 -6.963 -9.066 -0.385 1.00 3.02 H new ATOM 0 HZ1 LYS A 282 -6.499 -11.177 0.299 1.00 3.78 H new ATOM 0 HZ2 LYS A 282 -4.966 -10.497 0.564 1.00 3.78 H new ATOM 0 HZ3 LYS A 282 -6.037 -10.709 1.864 1.00 3.78 H new ATOM 247 N LEU A 283 -1.781 -5.424 1.143 1.00 0.34 N ATOM 248 CA LEU A 283 -1.533 -4.641 -0.095 1.00 0.32 C ATOM 249 C LEU A 283 -0.042 -4.722 -0.400 1.00 0.25 C ATOM 250 O LEU A 283 0.365 -4.866 -1.535 1.00 0.27 O ATOM 251 CB LEU A 283 -1.944 -3.177 0.083 1.00 0.36 C ATOM 252 CG LEU A 283 -3.470 -3.080 0.155 1.00 0.46 C ATOM 253 CD1 LEU A 283 -3.929 -3.256 1.602 1.00 1.42 C ATOM 254 CD2 LEU A 283 -3.919 -1.710 -0.358 1.00 1.32 C ATOM 0 H LEU A 283 -1.585 -4.939 2.018 1.00 0.34 H new ATOM 0 HA LEU A 283 -2.125 -5.051 -0.913 1.00 0.32 H new ATOM 0 HB2 LEU A 283 -1.500 -2.772 0.992 1.00 0.36 H new ATOM 0 HB3 LEU A 283 -1.570 -2.580 -0.748 1.00 0.36 H new ATOM 0 HG LEU A 283 -3.911 -3.863 -0.462 1.00 0.46 H new ATOM 0 HD11 LEU A 283 -5.016 -3.186 1.650 1.00 1.42 H new ATOM 0 HD12 LEU A 283 -3.611 -4.232 1.968 1.00 1.42 H new ATOM 0 HD13 LEU A 283 -3.488 -2.475 2.221 1.00 1.42 H new ATOM 0 HD21 LEU A 283 -5.006 -1.641 -0.307 1.00 1.32 H new ATOM 0 HD22 LEU A 283 -3.476 -0.928 0.258 1.00 1.32 H new ATOM 0 HD23 LEU A 283 -3.596 -1.585 -1.391 1.00 1.32 H new ATOM 266 N ILE A 284 0.779 -4.640 0.614 1.00 0.22 N ATOM 267 CA ILE A 284 2.241 -4.724 0.388 1.00 0.20 C ATOM 268 C ILE A 284 2.748 -6.124 0.708 1.00 0.22 C ATOM 269 O ILE A 284 2.719 -6.555 1.844 1.00 0.28 O ATOM 270 CB ILE A 284 2.971 -3.771 1.321 1.00 0.22 C ATOM 271 CG1 ILE A 284 2.185 -2.465 1.474 1.00 0.47 C ATOM 272 CG2 ILE A 284 4.354 -3.492 0.748 1.00 0.23 C ATOM 273 CD1 ILE A 284 1.985 -1.821 0.106 1.00 0.62 C ATOM 0 H ILE A 284 0.495 -4.519 1.586 1.00 0.22 H new ATOM 0 HA ILE A 284 2.427 -4.472 -0.656 1.00 0.20 H new ATOM 0 HB ILE A 284 3.065 -4.224 2.308 1.00 0.22 H new ATOM 0 HG12 ILE A 284 1.219 -2.663 1.938 1.00 0.47 H new ATOM 0 HG13 ILE A 284 2.721 -1.782 2.133 1.00 0.47 H new ATOM 0 HG21 ILE A 284 4.890 -2.809 1.407 1.00 0.23 H new ATOM 0 HG22 ILE A 284 4.909 -4.427 0.665 1.00 0.23 H new ATOM 0 HG23 ILE A 284 4.255 -3.040 -0.239 1.00 0.23 H new ATOM 0 HD11 ILE A 284 1.426 -0.892 0.219 1.00 0.62 H new ATOM 0 HD12 ILE A 284 2.956 -1.607 -0.341 1.00 0.62 H new ATOM 0 HD13 ILE A 284 1.430 -2.502 -0.539 1.00 0.62 H new ATOM 285 N GLU A 285 3.272 -6.819 -0.256 1.00 0.24 N ATOM 286 CA GLU A 285 3.838 -8.153 0.052 1.00 0.31 C ATOM 287 C GLU A 285 5.294 -7.922 0.419 1.00 0.25 C ATOM 288 O GLU A 285 6.022 -7.278 -0.300 1.00 0.26 O ATOM 289 CB GLU A 285 3.756 -9.073 -1.160 1.00 0.44 C ATOM 290 CG GLU A 285 2.524 -8.720 -1.995 1.00 0.65 C ATOM 291 CD GLU A 285 2.073 -9.950 -2.785 1.00 0.72 C ATOM 292 OE1 GLU A 285 2.748 -10.963 -2.704 1.00 1.49 O ATOM 293 OE2 GLU A 285 1.059 -9.859 -3.458 1.00 1.38 O ATOM 0 H GLU A 285 3.333 -6.526 -1.231 1.00 0.24 H new ATOM 0 HA GLU A 285 3.283 -8.629 0.860 1.00 0.31 H new ATOM 0 HB2 GLU A 285 4.657 -8.974 -1.765 1.00 0.44 H new ATOM 0 HB3 GLU A 285 3.702 -10.112 -0.836 1.00 0.44 H new ATOM 0 HG2 GLU A 285 1.718 -8.376 -1.346 1.00 0.65 H new ATOM 0 HG3 GLU A 285 2.756 -7.902 -2.677 1.00 0.65 H new ATOM 300 N LYS A 286 5.723 -8.397 1.541 1.00 0.33 N ATOM 301 CA LYS A 286 7.134 -8.140 1.936 1.00 0.35 C ATOM 302 C LYS A 286 7.731 -9.350 2.652 1.00 0.48 C ATOM 303 O LYS A 286 7.039 -10.118 3.290 1.00 0.57 O ATOM 304 CB LYS A 286 7.170 -6.917 2.840 1.00 0.38 C ATOM 305 CG LYS A 286 6.547 -7.255 4.196 1.00 0.76 C ATOM 306 CD LYS A 286 7.521 -6.882 5.315 1.00 0.65 C ATOM 307 CE LYS A 286 7.305 -7.814 6.509 1.00 0.72 C ATOM 308 NZ LYS A 286 7.885 -7.195 7.735 1.00 1.13 N ATOM 0 H LYS A 286 5.171 -8.946 2.200 1.00 0.33 H new ATOM 0 HA LYS A 286 7.732 -7.960 1.043 1.00 0.35 H new ATOM 0 HB2 LYS A 286 8.199 -6.584 2.975 1.00 0.38 H new ATOM 0 HB3 LYS A 286 6.627 -6.094 2.375 1.00 0.38 H new ATOM 0 HG2 LYS A 286 5.609 -6.714 4.321 1.00 0.76 H new ATOM 0 HG3 LYS A 286 6.311 -8.318 4.245 1.00 0.76 H new ATOM 0 HD2 LYS A 286 8.548 -6.961 4.959 1.00 0.65 H new ATOM 0 HD3 LYS A 286 7.367 -5.846 5.616 1.00 0.65 H new ATOM 0 HE2 LYS A 286 6.240 -7.999 6.651 1.00 0.72 H new ATOM 0 HE3 LYS A 286 7.774 -8.780 6.320 1.00 0.72 H new ATOM 0 HZ1 LYS A 286 8.220 -7.942 8.376 1.00 1.13 H new ATOM 0 HZ2 LYS A 286 8.682 -6.582 7.470 1.00 1.13 H new ATOM 0 HZ3 LYS A 286 7.157 -6.628 8.215 1.00 1.13 H new ATOM 322 N ALA A 287 9.020 -9.523 2.538 1.00 0.60 N ATOM 323 CA ALA A 287 9.690 -10.678 3.195 1.00 0.75 C ATOM 324 C ALA A 287 10.274 -10.237 4.538 1.00 0.85 C ATOM 325 O ALA A 287 11.260 -10.775 5.003 1.00 1.63 O ATOM 326 CB ALA A 287 10.820 -11.178 2.293 1.00 0.84 C ATOM 0 H ALA A 287 9.641 -8.908 2.013 1.00 0.60 H new ATOM 0 HA ALA A 287 8.965 -11.475 3.360 1.00 0.75 H new ATOM 0 HB1 ALA A 287 11.316 -12.025 2.767 1.00 0.84 H new ATOM 0 HB2 ALA A 287 10.408 -11.490 1.333 1.00 0.84 H new ATOM 0 HB3 ALA A 287 11.541 -10.376 2.135 1.00 0.84 H new ATOM 332 N GLY A 288 9.678 -9.262 5.165 1.00 1.04 N ATOM 333 CA GLY A 288 10.206 -8.788 6.475 1.00 1.06 C ATOM 334 C GLY A 288 10.676 -7.340 6.340 1.00 1.05 C ATOM 335 O GLY A 288 10.160 -6.447 6.982 1.00 1.74 O ATOM 0 H GLY A 288 8.849 -8.773 4.828 1.00 1.04 H new ATOM 0 HA2 GLY A 288 9.432 -8.861 7.239 1.00 1.06 H new ATOM 0 HA3 GLY A 288 11.032 -9.422 6.797 1.00 1.06 H new ATOM 339 N ALA A 289 11.651 -7.101 5.508 1.00 0.57 N ATOM 340 CA ALA A 289 12.154 -5.710 5.328 1.00 0.54 C ATOM 341 C ALA A 289 11.824 -5.233 3.913 1.00 0.45 C ATOM 342 O ALA A 289 11.281 -4.163 3.720 1.00 0.56 O ATOM 343 CB ALA A 289 13.669 -5.683 5.535 1.00 0.65 C ATOM 0 H ALA A 289 12.122 -7.809 4.944 1.00 0.57 H new ATOM 0 HA ALA A 289 11.678 -5.053 6.056 1.00 0.54 H new ATOM 0 HB1 ALA A 289 14.036 -4.665 5.403 1.00 0.65 H new ATOM 0 HB2 ALA A 289 13.905 -6.026 6.542 1.00 0.65 H new ATOM 0 HB3 ALA A 289 14.147 -6.338 4.807 1.00 0.65 H new ATOM 349 N TRP A 290 12.145 -6.018 2.921 1.00 0.33 N ATOM 350 CA TRP A 290 11.844 -5.602 1.522 1.00 0.25 C ATOM 351 C TRP A 290 10.337 -5.678 1.286 1.00 0.25 C ATOM 352 O TRP A 290 9.718 -6.697 1.521 1.00 0.37 O ATOM 353 CB TRP A 290 12.556 -6.531 0.538 1.00 0.28 C ATOM 354 CG TRP A 290 13.695 -5.799 -0.083 1.00 0.28 C ATOM 355 CD1 TRP A 290 14.998 -5.951 0.240 1.00 0.32 C ATOM 356 CD2 TRP A 290 13.645 -4.796 -1.130 1.00 0.28 C ATOM 357 NE1 TRP A 290 15.753 -5.099 -0.546 1.00 0.34 N ATOM 358 CE2 TRP A 290 14.961 -4.365 -1.407 1.00 0.32 C ATOM 359 CE3 TRP A 290 12.589 -4.227 -1.855 1.00 0.30 C ATOM 360 CZ2 TRP A 290 15.221 -3.396 -2.376 1.00 0.37 C ATOM 361 CZ3 TRP A 290 12.845 -3.251 -2.831 1.00 0.36 C ATOM 362 CH2 TRP A 290 14.159 -2.835 -3.091 1.00 0.39 C ATOM 0 H TRP A 290 12.601 -6.925 3.018 1.00 0.33 H new ATOM 0 HA TRP A 290 12.192 -4.581 1.368 1.00 0.25 H new ATOM 0 HB2 TRP A 290 12.917 -7.421 1.054 1.00 0.28 H new ATOM 0 HB3 TRP A 290 11.861 -6.868 -0.231 1.00 0.28 H new ATOM 0 HD1 TRP A 290 15.386 -6.626 0.988 1.00 0.32 H new ATOM 0 HE1 TRP A 290 16.769 -5.022 -0.496 1.00 0.34 H new ATOM 0 HE3 TRP A 290 11.574 -4.541 -1.662 1.00 0.30 H new ATOM 0 HZ2 TRP A 290 16.235 -3.081 -2.572 1.00 0.37 H new ATOM 0 HZ3 TRP A 290 12.025 -2.818 -3.385 1.00 0.36 H new ATOM 0 HH2 TRP A 290 14.350 -2.083 -3.842 1.00 0.39 H new ATOM 373 N TYR A 291 9.735 -4.613 0.827 1.00 0.17 N ATOM 374 CA TYR A 291 8.267 -4.656 0.589 1.00 0.19 C ATOM 375 C TYR A 291 8.012 -4.930 -0.871 1.00 0.21 C ATOM 376 O TYR A 291 8.914 -4.922 -1.674 1.00 0.27 O ATOM 377 CB TYR A 291 7.606 -3.335 0.987 1.00 0.20 C ATOM 378 CG TYR A 291 7.415 -3.340 2.471 1.00 0.19 C ATOM 379 CD1 TYR A 291 8.411 -3.882 3.281 1.00 0.35 C ATOM 380 CD2 TYR A 291 6.257 -2.807 3.039 1.00 0.13 C ATOM 381 CE1 TYR A 291 8.262 -3.907 4.656 1.00 0.37 C ATOM 382 CE2 TYR A 291 6.103 -2.824 4.433 1.00 0.14 C ATOM 383 CZ TYR A 291 7.107 -3.376 5.243 1.00 0.22 C ATOM 384 OH TYR A 291 6.955 -3.398 6.615 1.00 0.26 O ATOM 0 H TYR A 291 10.191 -3.727 0.610 1.00 0.17 H new ATOM 0 HA TYR A 291 7.837 -5.449 1.201 1.00 0.19 H new ATOM 0 HB2 TYR A 291 8.228 -2.492 0.686 1.00 0.20 H new ATOM 0 HB3 TYR A 291 6.648 -3.221 0.480 1.00 0.20 H new ATOM 0 HD1 TYR A 291 9.306 -4.286 2.832 1.00 0.35 H new ATOM 0 HD2 TYR A 291 5.486 -2.385 2.411 1.00 0.13 H new ATOM 0 HE1 TYR A 291 9.036 -4.336 5.276 1.00 0.37 H new ATOM 0 HE2 TYR A 291 5.212 -2.412 4.883 1.00 0.14 H new ATOM 0 HH TYR A 291 6.098 -2.989 6.856 1.00 0.26 H new ATOM 394 N SER A 292 6.793 -5.187 -1.215 1.00 0.22 N ATOM 395 CA SER A 292 6.474 -5.476 -2.628 1.00 0.27 C ATOM 396 C SER A 292 5.050 -5.049 -2.920 1.00 0.29 C ATOM 397 O SER A 292 4.238 -4.929 -2.028 1.00 0.40 O ATOM 398 CB SER A 292 6.581 -6.968 -2.868 1.00 0.35 C ATOM 399 OG SER A 292 7.321 -7.212 -4.057 1.00 1.18 O ATOM 0 H SER A 292 5.999 -5.210 -0.576 1.00 0.22 H new ATOM 0 HA SER A 292 7.169 -4.937 -3.272 1.00 0.27 H new ATOM 0 HB2 SER A 292 7.069 -7.448 -2.020 1.00 0.35 H new ATOM 0 HB3 SER A 292 5.586 -7.405 -2.952 1.00 0.35 H new ATOM 0 HG SER A 292 7.389 -8.178 -4.207 1.00 1.18 H new ATOM 405 N TYR A 293 4.716 -4.845 -4.156 1.00 0.28 N ATOM 406 CA TYR A 293 3.322 -4.460 -4.440 1.00 0.36 C ATOM 407 C TYR A 293 2.713 -5.349 -5.510 1.00 0.53 C ATOM 408 O TYR A 293 3.387 -6.060 -6.227 1.00 1.12 O ATOM 409 CB TYR A 293 3.226 -3.007 -4.888 1.00 0.37 C ATOM 410 CG TYR A 293 1.941 -2.463 -4.337 1.00 0.51 C ATOM 411 CD1 TYR A 293 1.667 -2.603 -2.973 1.00 1.45 C ATOM 412 CD2 TYR A 293 1.011 -1.852 -5.182 1.00 1.18 C ATOM 413 CE1 TYR A 293 0.466 -2.135 -2.455 1.00 1.59 C ATOM 414 CE2 TYR A 293 -0.195 -1.376 -4.658 1.00 1.22 C ATOM 415 CZ TYR A 293 -0.468 -1.520 -3.296 1.00 0.88 C ATOM 416 OH TYR A 293 -1.665 -1.069 -2.789 1.00 1.09 O ATOM 0 H TYR A 293 5.334 -4.926 -4.963 1.00 0.28 H new ATOM 0 HA TYR A 293 2.766 -4.583 -3.510 1.00 0.36 H new ATOM 0 HB2 TYR A 293 4.077 -2.433 -4.521 1.00 0.37 H new ATOM 0 HB3 TYR A 293 3.240 -2.937 -5.976 1.00 0.37 H new ATOM 0 HD1 TYR A 293 2.389 -3.075 -2.323 1.00 1.45 H new ATOM 0 HD2 TYR A 293 1.223 -1.748 -6.236 1.00 1.18 H new ATOM 0 HE1 TYR A 293 0.253 -2.246 -1.402 1.00 1.59 H new ATOM 0 HE2 TYR A 293 -0.914 -0.898 -5.306 1.00 1.22 H new ATOM 0 HH TYR A 293 -2.401 -1.402 -3.343 1.00 1.09 H new ATOM 426 N LYS A 294 1.422 -5.292 -5.592 1.00 0.60 N ATOM 427 CA LYS A 294 0.643 -6.091 -6.580 1.00 0.67 C ATOM 428 C LYS A 294 1.036 -5.718 -8.016 1.00 0.76 C ATOM 429 O LYS A 294 0.196 -5.418 -8.840 1.00 1.39 O ATOM 430 CB LYS A 294 -0.852 -5.799 -6.377 1.00 0.72 C ATOM 431 CG LYS A 294 -1.098 -4.283 -6.213 1.00 0.75 C ATOM 432 CD LYS A 294 -1.031 -3.601 -7.576 1.00 1.75 C ATOM 433 CE LYS A 294 -1.750 -2.255 -7.508 1.00 1.97 C ATOM 434 NZ LYS A 294 -2.887 -2.249 -8.471 1.00 3.08 N ATOM 0 H LYS A 294 0.846 -4.701 -4.992 1.00 0.60 H new ATOM 0 HA LYS A 294 0.855 -7.149 -6.426 1.00 0.67 H new ATOM 0 HB2 LYS A 294 -1.419 -6.174 -7.229 1.00 0.72 H new ATOM 0 HB3 LYS A 294 -1.214 -6.328 -5.495 1.00 0.72 H new ATOM 0 HG2 LYS A 294 -2.073 -4.110 -5.757 1.00 0.75 H new ATOM 0 HG3 LYS A 294 -0.352 -3.854 -5.544 1.00 0.75 H new ATOM 0 HD2 LYS A 294 0.008 -3.456 -7.871 1.00 1.75 H new ATOM 0 HD3 LYS A 294 -1.492 -4.234 -8.334 1.00 1.75 H new ATOM 0 HE2 LYS A 294 -2.115 -2.077 -6.497 1.00 1.97 H new ATOM 0 HE3 LYS A 294 -1.056 -1.448 -7.743 1.00 1.97 H new ATOM 0 HZ1 LYS A 294 -3.237 -1.277 -8.588 1.00 3.08 H new ATOM 0 HZ2 LYS A 294 -2.566 -2.615 -9.390 1.00 3.08 H new ATOM 0 HZ3 LYS A 294 -3.653 -2.851 -8.108 1.00 3.08 H new ATOM 448 N GLY A 295 2.298 -5.744 -8.331 1.00 0.58 N ATOM 449 CA GLY A 295 2.720 -5.393 -9.712 1.00 0.58 C ATOM 450 C GLY A 295 4.206 -5.057 -9.722 1.00 0.50 C ATOM 451 O GLY A 295 4.925 -5.401 -10.639 1.00 0.56 O ATOM 0 H GLY A 295 3.054 -5.993 -7.693 1.00 0.58 H new ATOM 0 HA2 GLY A 295 2.520 -6.225 -10.387 1.00 0.58 H new ATOM 0 HA3 GLY A 295 2.142 -4.543 -10.075 1.00 0.58 H new ATOM 455 N GLU A 296 4.668 -4.363 -8.723 1.00 0.44 N ATOM 456 CA GLU A 296 6.104 -3.983 -8.698 1.00 0.35 C ATOM 457 C GLU A 296 6.588 -3.837 -7.277 1.00 0.26 C ATOM 458 O GLU A 296 5.929 -3.221 -6.463 1.00 0.37 O ATOM 459 CB GLU A 296 6.253 -2.616 -9.338 1.00 0.43 C ATOM 460 CG GLU A 296 7.708 -2.156 -9.235 1.00 1.24 C ATOM 461 CD GLU A 296 8.086 -1.371 -10.492 1.00 1.76 C ATOM 462 OE1 GLU A 296 8.360 -2.002 -11.500 1.00 2.23 O ATOM 463 OE2 GLU A 296 8.095 -0.153 -10.426 1.00 2.31 O ATOM 0 H GLU A 296 4.116 -4.044 -7.927 1.00 0.44 H new ATOM 0 HA GLU A 296 6.672 -4.753 -9.220 1.00 0.35 H new ATOM 0 HB2 GLU A 296 5.948 -2.658 -10.384 1.00 0.43 H new ATOM 0 HB3 GLU A 296 5.598 -1.899 -8.843 1.00 0.43 H new ATOM 0 HG2 GLU A 296 7.842 -1.533 -8.351 1.00 1.24 H new ATOM 0 HG3 GLU A 296 8.366 -3.018 -9.120 1.00 1.24 H new ATOM 470 N LYS A 297 7.751 -4.338 -6.965 1.00 0.22 N ATOM 471 CA LYS A 297 8.253 -4.136 -5.608 1.00 0.34 C ATOM 472 C LYS A 297 8.059 -2.682 -5.242 1.00 0.34 C ATOM 473 O LYS A 297 8.236 -1.798 -6.056 1.00 0.63 O ATOM 474 CB LYS A 297 9.729 -4.431 -5.526 1.00 0.55 C ATOM 475 CG LYS A 297 9.997 -4.766 -4.083 1.00 0.58 C ATOM 476 CD LYS A 297 9.690 -6.248 -3.913 1.00 1.42 C ATOM 477 CE LYS A 297 10.976 -7.013 -3.599 1.00 2.25 C ATOM 478 NZ LYS A 297 11.471 -7.680 -4.835 1.00 3.00 N ATOM 0 H LYS A 297 8.357 -4.869 -7.591 1.00 0.22 H new ATOM 0 HA LYS A 297 7.714 -4.803 -4.936 1.00 0.34 H new ATOM 0 HB2 LYS A 297 9.999 -5.262 -6.178 1.00 0.55 H new ATOM 0 HB3 LYS A 297 10.319 -3.571 -5.845 1.00 0.55 H new ATOM 0 HG2 LYS A 297 11.034 -4.553 -3.823 1.00 0.58 H new ATOM 0 HG3 LYS A 297 9.373 -4.163 -3.423 1.00 0.58 H new ATOM 0 HD2 LYS A 297 8.967 -6.389 -3.109 1.00 1.42 H new ATOM 0 HD3 LYS A 297 9.236 -6.641 -4.823 1.00 1.42 H new ATOM 0 HE2 LYS A 297 11.733 -6.330 -3.213 1.00 2.25 H new ATOM 0 HE3 LYS A 297 10.790 -7.755 -2.822 1.00 2.25 H new ATOM 0 HZ1 LYS A 297 12.346 -8.201 -4.622 1.00 3.00 H new ATOM 0 HZ2 LYS A 297 10.750 -8.343 -5.184 1.00 3.00 H new ATOM 0 HZ3 LYS A 297 11.664 -6.963 -5.563 1.00 3.00 H new ATOM 492 N ILE A 298 7.696 -2.417 -4.041 1.00 0.23 N ATOM 493 CA ILE A 298 7.498 -1.009 -3.663 1.00 0.25 C ATOM 494 C ILE A 298 8.828 -0.450 -3.150 1.00 0.28 C ATOM 495 O ILE A 298 9.155 0.703 -3.344 1.00 0.35 O ATOM 496 CB ILE A 298 6.434 -0.896 -2.569 1.00 0.26 C ATOM 497 CG1 ILE A 298 5.644 -2.188 -2.452 1.00 0.25 C ATOM 498 CG2 ILE A 298 5.453 0.188 -2.947 1.00 0.30 C ATOM 499 CD1 ILE A 298 4.319 -1.906 -1.768 1.00 0.32 C ATOM 0 H ILE A 298 7.528 -3.104 -3.306 1.00 0.23 H new ATOM 0 HA ILE A 298 7.161 -0.442 -4.531 1.00 0.25 H new ATOM 0 HB ILE A 298 6.937 -0.677 -1.627 1.00 0.26 H new ATOM 0 HG12 ILE A 298 5.473 -2.614 -3.441 1.00 0.25 H new ATOM 0 HG13 ILE A 298 6.211 -2.924 -1.882 1.00 0.25 H new ATOM 0 HG21 ILE A 298 4.691 0.275 -2.173 1.00 0.30 H new ATOM 0 HG22 ILE A 298 5.980 1.137 -3.046 1.00 0.30 H new ATOM 0 HG23 ILE A 298 4.979 -0.065 -3.895 1.00 0.30 H new ATOM 0 HD11 ILE A 298 3.749 -2.831 -1.682 1.00 0.32 H new ATOM 0 HD12 ILE A 298 4.502 -1.499 -0.773 1.00 0.32 H new ATOM 0 HD13 ILE A 298 3.752 -1.184 -2.356 1.00 0.32 H new ATOM 511 N GLY A 299 9.589 -1.274 -2.483 1.00 0.31 N ATOM 512 CA GLY A 299 10.896 -0.832 -1.932 1.00 0.38 C ATOM 513 C GLY A 299 10.998 -1.369 -0.511 1.00 0.46 C ATOM 514 O GLY A 299 10.080 -1.991 -0.024 1.00 1.15 O ATOM 0 H GLY A 299 9.354 -2.249 -2.295 1.00 0.31 H new ATOM 0 HA2 GLY A 299 11.717 -1.207 -2.544 1.00 0.38 H new ATOM 0 HA3 GLY A 299 10.966 0.256 -1.937 1.00 0.38 H new ATOM 518 N GLN A 300 12.087 -1.144 0.164 1.00 0.48 N ATOM 519 CA GLN A 300 12.192 -1.648 1.557 1.00 0.40 C ATOM 520 C GLN A 300 10.894 -1.286 2.295 1.00 0.40 C ATOM 521 O GLN A 300 10.054 -0.588 1.769 1.00 0.49 O ATOM 522 CB GLN A 300 13.396 -0.995 2.231 1.00 0.42 C ATOM 523 CG GLN A 300 14.031 -1.980 3.214 1.00 0.46 C ATOM 524 CD GLN A 300 15.127 -1.272 4.012 1.00 1.01 C ATOM 525 OE1 GLN A 300 15.974 -0.608 3.448 1.00 1.94 O ATOM 526 NE2 GLN A 300 15.146 -1.384 5.313 1.00 1.35 N ATOM 0 H GLN A 300 12.901 -0.638 -0.184 1.00 0.48 H new ATOM 0 HA GLN A 300 12.329 -2.729 1.574 1.00 0.40 H new ATOM 0 HB2 GLN A 300 14.126 -0.693 1.480 1.00 0.42 H new ATOM 0 HB3 GLN A 300 13.086 -0.091 2.755 1.00 0.42 H new ATOM 0 HG2 GLN A 300 13.273 -2.375 3.890 1.00 0.46 H new ATOM 0 HG3 GLN A 300 14.451 -2.829 2.674 1.00 0.46 H new ATOM 0 HE21 GLN A 300 14.435 -1.941 5.787 1.00 1.35 H new ATOM 0 HE22 GLN A 300 15.871 -0.914 5.855 1.00 1.35 H new ATOM 535 N GLY A 301 10.701 -1.761 3.491 1.00 0.40 N ATOM 536 CA GLY A 301 9.440 -1.449 4.213 1.00 0.47 C ATOM 537 C GLY A 301 9.486 -0.045 4.772 1.00 0.60 C ATOM 538 O GLY A 301 8.482 0.620 4.923 1.00 1.33 O ATOM 0 H GLY A 301 11.360 -2.351 3.999 1.00 0.40 H new ATOM 0 HA2 GLY A 301 8.592 -1.550 3.536 1.00 0.47 H new ATOM 0 HA3 GLY A 301 9.290 -2.164 5.022 1.00 0.47 H new ATOM 542 N LYS A 302 10.643 0.386 5.121 1.00 0.61 N ATOM 543 CA LYS A 302 10.776 1.735 5.720 1.00 0.66 C ATOM 544 C LYS A 302 11.713 2.582 4.870 1.00 0.78 C ATOM 545 O LYS A 302 11.658 3.795 4.886 1.00 1.64 O ATOM 546 CB LYS A 302 11.329 1.607 7.148 1.00 0.67 C ATOM 547 CG LYS A 302 12.119 0.292 7.304 1.00 0.69 C ATOM 548 CD LYS A 302 12.216 -0.071 8.788 1.00 1.14 C ATOM 549 CE LYS A 302 11.415 -1.349 9.053 1.00 1.54 C ATOM 550 NZ LYS A 302 11.619 -1.784 10.464 1.00 2.12 N ATOM 0 H LYS A 302 11.515 -0.134 5.021 1.00 0.61 H new ATOM 0 HA LYS A 302 9.799 2.217 5.757 1.00 0.66 H new ATOM 0 HB2 LYS A 302 11.976 2.456 7.372 1.00 0.67 H new ATOM 0 HB3 LYS A 302 10.509 1.633 7.866 1.00 0.67 H new ATOM 0 HG2 LYS A 302 11.625 -0.509 6.754 1.00 0.69 H new ATOM 0 HG3 LYS A 302 13.117 0.402 6.879 1.00 0.69 H new ATOM 0 HD2 LYS A 302 13.259 -0.217 9.070 1.00 1.14 H new ATOM 0 HD3 LYS A 302 11.832 0.746 9.399 1.00 1.14 H new ATOM 0 HE2 LYS A 302 10.356 -1.172 8.866 1.00 1.54 H new ATOM 0 HE3 LYS A 302 11.732 -2.137 8.370 1.00 1.54 H new ATOM 0 HZ1 LYS A 302 11.074 -2.652 10.642 1.00 2.12 H new ATOM 0 HZ2 LYS A 302 12.629 -1.970 10.627 1.00 2.12 H new ATOM 0 HZ3 LYS A 302 11.296 -1.034 11.109 1.00 2.12 H new ATOM 564 N ALA A 303 12.566 1.954 4.122 1.00 0.78 N ATOM 565 CA ALA A 303 13.496 2.725 3.264 1.00 0.83 C ATOM 566 C ALA A 303 12.803 3.049 1.939 1.00 0.64 C ATOM 567 O ALA A 303 13.127 4.021 1.287 1.00 0.77 O ATOM 568 CB ALA A 303 14.754 1.897 2.995 1.00 0.96 C ATOM 0 H ALA A 303 12.660 0.940 4.067 1.00 0.78 H new ATOM 0 HA ALA A 303 13.777 3.650 3.768 1.00 0.83 H new ATOM 0 HB1 ALA A 303 15.436 2.466 2.364 1.00 0.96 H new ATOM 0 HB2 ALA A 303 15.244 1.663 3.940 1.00 0.96 H new ATOM 0 HB3 ALA A 303 14.479 0.971 2.489 1.00 0.96 H new ATOM 574 N ASN A 304 11.859 2.239 1.524 1.00 0.41 N ATOM 575 CA ASN A 304 11.178 2.515 0.233 1.00 0.27 C ATOM 576 C ASN A 304 9.851 1.765 0.152 1.00 0.24 C ATOM 577 O ASN A 304 9.437 1.360 -0.916 1.00 0.24 O ATOM 578 CB ASN A 304 12.074 2.024 -0.894 1.00 0.31 C ATOM 579 CG ASN A 304 13.280 2.953 -1.045 1.00 0.48 C ATOM 580 OD1 ASN A 304 13.242 3.900 -1.805 1.00 1.27 O ATOM 581 ND2 ASN A 304 14.359 2.719 -0.348 1.00 1.17 N ATOM 0 H ASN A 304 11.537 1.409 2.022 1.00 0.41 H new ATOM 0 HA ASN A 304 10.987 3.585 0.153 1.00 0.27 H new ATOM 0 HB2 ASN A 304 12.411 1.008 -0.686 1.00 0.31 H new ATOM 0 HB3 ASN A 304 11.512 1.989 -1.827 1.00 0.31 H new ATOM 0 HD21 ASN A 304 15.169 3.331 -0.442 1.00 1.17 H new ATOM 0 HD22 ASN A 304 14.391 1.924 0.290 1.00 1.17 H new ATOM 588 N ALA A 305 9.163 1.569 1.243 1.00 0.25 N ATOM 589 CA ALA A 305 7.872 0.842 1.133 1.00 0.26 C ATOM 590 C ALA A 305 6.937 1.656 0.252 1.00 0.28 C ATOM 591 O ALA A 305 6.552 1.233 -0.818 1.00 0.29 O ATOM 592 CB ALA A 305 7.236 0.661 2.505 1.00 0.30 C ATOM 0 H ALA A 305 9.430 1.872 2.180 1.00 0.25 H new ATOM 0 HA ALA A 305 8.050 -0.143 0.703 1.00 0.26 H new ATOM 0 HB1 ALA A 305 6.292 0.126 2.401 1.00 0.30 H new ATOM 0 HB2 ALA A 305 7.908 0.089 3.145 1.00 0.30 H new ATOM 0 HB3 ALA A 305 7.052 1.638 2.953 1.00 0.30 H new ATOM 598 N THR A 306 6.564 2.824 0.690 1.00 0.31 N ATOM 599 CA THR A 306 5.651 3.645 -0.135 1.00 0.35 C ATOM 600 C THR A 306 6.431 4.567 -1.069 1.00 0.31 C ATOM 601 O THR A 306 5.863 5.453 -1.662 1.00 0.33 O ATOM 602 CB THR A 306 4.747 4.495 0.745 1.00 0.46 C ATOM 603 OG1 THR A 306 4.162 5.498 -0.073 1.00 0.65 O ATOM 604 CG2 THR A 306 5.565 5.140 1.873 1.00 0.47 C ATOM 0 H THR A 306 6.851 3.239 1.576 1.00 0.31 H new ATOM 0 HA THR A 306 5.047 2.958 -0.728 1.00 0.35 H new ATOM 0 HB THR A 306 3.971 3.879 1.200 1.00 0.46 H new ATOM 0 HG1 THR A 306 3.212 5.298 -0.208 1.00 0.65 H new ATOM 0 HG21 THR A 306 4.909 5.746 2.497 1.00 0.47 H new ATOM 0 HG22 THR A 306 6.025 4.361 2.480 1.00 0.47 H new ATOM 0 HG23 THR A 306 6.343 5.772 1.443 1.00 0.47 H new ATOM 612 N ALA A 307 7.711 4.382 -1.237 1.00 0.27 N ATOM 613 CA ALA A 307 8.432 5.280 -2.182 1.00 0.26 C ATOM 614 C ALA A 307 7.957 4.917 -3.580 1.00 0.21 C ATOM 615 O ALA A 307 7.634 5.767 -4.386 1.00 0.21 O ATOM 616 CB ALA A 307 9.933 5.087 -2.072 1.00 0.27 C ATOM 0 H ALA A 307 8.276 3.669 -0.776 1.00 0.27 H new ATOM 0 HA ALA A 307 8.224 6.325 -1.953 1.00 0.26 H new ATOM 0 HB1 ALA A 307 10.438 5.753 -2.772 1.00 0.27 H new ATOM 0 HB2 ALA A 307 10.256 5.315 -1.056 1.00 0.27 H new ATOM 0 HB3 ALA A 307 10.185 4.053 -2.309 1.00 0.27 H new ATOM 622 N TRP A 308 7.832 3.647 -3.838 1.00 0.17 N ATOM 623 CA TRP A 308 7.285 3.197 -5.136 1.00 0.14 C ATOM 624 C TRP A 308 5.811 3.533 -5.103 1.00 0.16 C ATOM 625 O TRP A 308 5.165 3.674 -6.119 1.00 0.16 O ATOM 626 CB TRP A 308 7.520 1.707 -5.245 1.00 0.15 C ATOM 627 CG TRP A 308 6.578 1.111 -6.217 1.00 0.12 C ATOM 628 CD1 TRP A 308 6.934 0.602 -7.408 1.00 0.13 C ATOM 629 CD2 TRP A 308 5.139 0.944 -6.106 1.00 0.15 C ATOM 630 NE1 TRP A 308 5.810 0.123 -8.031 1.00 0.15 N ATOM 631 CE2 TRP A 308 4.680 0.294 -7.260 1.00 0.17 C ATOM 632 CE3 TRP A 308 4.196 1.278 -5.123 1.00 0.21 C ATOM 633 CZ2 TRP A 308 3.337 -0.023 -7.424 1.00 0.23 C ATOM 634 CZ3 TRP A 308 2.853 0.967 -5.291 1.00 0.26 C ATOM 635 CH2 TRP A 308 2.422 0.312 -6.432 1.00 0.27 C ATOM 0 H TRP A 308 8.089 2.898 -3.196 1.00 0.17 H new ATOM 0 HA TRP A 308 7.753 3.674 -5.997 1.00 0.14 H new ATOM 0 HB2 TRP A 308 8.546 1.515 -5.558 1.00 0.15 H new ATOM 0 HB3 TRP A 308 7.392 1.239 -4.269 1.00 0.15 H new ATOM 0 HD1 TRP A 308 7.937 0.575 -7.808 1.00 0.13 H new ATOM 0 HE1 TRP A 308 5.810 -0.309 -8.955 1.00 0.15 H new ATOM 0 HE3 TRP A 308 4.518 1.783 -4.224 1.00 0.21 H new ATOM 0 HZ2 TRP A 308 3.005 -0.528 -8.319 1.00 0.23 H new ATOM 0 HZ3 TRP A 308 2.140 1.238 -4.526 1.00 0.26 H new ATOM 0 HH2 TRP A 308 1.378 0.062 -6.551 1.00 0.27 H new ATOM 646 N LEU A 309 5.295 3.708 -3.920 1.00 0.20 N ATOM 647 CA LEU A 309 3.880 4.091 -3.765 1.00 0.24 C ATOM 648 C LEU A 309 3.835 5.621 -3.775 1.00 0.25 C ATOM 649 O LEU A 309 2.792 6.231 -3.885 1.00 0.29 O ATOM 650 CB LEU A 309 3.368 3.518 -2.436 1.00 0.32 C ATOM 651 CG LEU A 309 1.835 3.622 -2.317 1.00 0.56 C ATOM 652 CD1 LEU A 309 1.166 3.643 -3.696 1.00 0.98 C ATOM 653 CD2 LEU A 309 1.319 2.411 -1.536 1.00 1.20 C ATOM 0 H LEU A 309 5.808 3.598 -3.045 1.00 0.20 H new ATOM 0 HA LEU A 309 3.248 3.703 -4.564 1.00 0.24 H new ATOM 0 HB2 LEU A 309 3.669 2.474 -2.351 1.00 0.32 H new ATOM 0 HB3 LEU A 309 3.833 4.052 -1.607 1.00 0.32 H new ATOM 0 HG LEU A 309 1.592 4.552 -1.803 1.00 0.56 H new ATOM 0 HD11 LEU A 309 0.085 3.717 -3.575 1.00 0.98 H new ATOM 0 HD12 LEU A 309 1.527 4.501 -4.263 1.00 0.98 H new ATOM 0 HD13 LEU A 309 1.409 2.726 -4.232 1.00 0.98 H new ATOM 0 HD21 LEU A 309 0.235 2.472 -1.444 1.00 1.20 H new ATOM 0 HD22 LEU A 309 1.587 1.496 -2.064 1.00 1.20 H new ATOM 0 HD23 LEU A 309 1.767 2.401 -0.542 1.00 1.20 H new ATOM 665 N LYS A 310 4.993 6.234 -3.685 1.00 0.24 N ATOM 666 CA LYS A 310 5.089 7.712 -3.708 1.00 0.27 C ATOM 667 C LYS A 310 4.825 8.191 -5.134 1.00 0.24 C ATOM 668 O LYS A 310 4.106 9.143 -5.364 1.00 0.27 O ATOM 669 CB LYS A 310 6.497 8.138 -3.284 1.00 0.34 C ATOM 670 CG LYS A 310 6.472 9.603 -2.843 1.00 0.60 C ATOM 671 CD LYS A 310 7.843 9.995 -2.289 1.00 1.23 C ATOM 672 CE LYS A 310 7.667 11.010 -1.157 1.00 1.92 C ATOM 673 NZ LYS A 310 7.761 12.392 -1.708 1.00 2.60 N ATOM 0 H LYS A 310 5.888 5.753 -3.595 1.00 0.24 H new ATOM 0 HA LYS A 310 4.360 8.146 -3.023 1.00 0.27 H new ATOM 0 HB2 LYS A 310 6.850 7.507 -2.468 1.00 0.34 H new ATOM 0 HB3 LYS A 310 7.194 8.008 -4.112 1.00 0.34 H new ATOM 0 HG2 LYS A 310 6.213 10.243 -3.686 1.00 0.60 H new ATOM 0 HG3 LYS A 310 5.705 9.752 -2.083 1.00 0.60 H new ATOM 0 HD2 LYS A 310 8.364 9.111 -1.921 1.00 1.23 H new ATOM 0 HD3 LYS A 310 8.458 10.421 -3.081 1.00 1.23 H new ATOM 0 HE2 LYS A 310 6.702 10.866 -0.672 1.00 1.92 H new ATOM 0 HE3 LYS A 310 8.432 10.858 -0.396 1.00 1.92 H new ATOM 0 HZ1 LYS A 310 7.641 13.081 -0.939 1.00 2.60 H new ATOM 0 HZ2 LYS A 310 8.692 12.526 -2.152 1.00 2.60 H new ATOM 0 HZ3 LYS A 310 7.015 12.534 -2.419 1.00 2.60 H new ATOM 687 N ASP A 311 5.405 7.521 -6.095 1.00 0.25 N ATOM 688 CA ASP A 311 5.200 7.911 -7.516 1.00 0.28 C ATOM 689 C ASP A 311 4.179 6.967 -8.154 1.00 0.24 C ATOM 690 O ASP A 311 4.133 6.807 -9.357 1.00 0.29 O ATOM 691 CB ASP A 311 6.527 7.813 -8.272 1.00 0.36 C ATOM 692 CG ASP A 311 6.853 9.166 -8.907 1.00 1.36 C ATOM 693 OD1 ASP A 311 7.459 9.983 -8.234 1.00 2.06 O ATOM 694 OD2 ASP A 311 6.490 9.363 -10.055 1.00 2.13 O ATOM 0 H ASP A 311 6.015 6.716 -5.953 1.00 0.25 H new ATOM 0 HA ASP A 311 4.833 8.936 -7.564 1.00 0.28 H new ATOM 0 HB2 ASP A 311 7.325 7.517 -7.591 1.00 0.36 H new ATOM 0 HB3 ASP A 311 6.463 7.044 -9.042 1.00 0.36 H new ATOM 699 N ASN A 312 3.361 6.340 -7.354 1.00 0.20 N ATOM 700 CA ASN A 312 2.339 5.401 -7.907 1.00 0.22 C ATOM 701 C ASN A 312 0.936 6.011 -7.843 1.00 0.26 C ATOM 702 O ASN A 312 0.075 5.444 -7.215 1.00 0.29 O ATOM 703 CB ASN A 312 2.329 4.118 -7.066 1.00 0.24 C ATOM 704 CG ASN A 312 2.342 2.900 -7.989 1.00 0.42 C ATOM 705 OD1 ASN A 312 3.373 2.531 -8.515 1.00 1.36 O ATOM 706 ND2 ASN A 312 1.230 2.254 -8.208 1.00 0.98 N ATOM 0 H ASN A 312 3.355 6.436 -6.339 1.00 0.20 H new ATOM 0 HA ASN A 312 2.597 5.195 -8.946 1.00 0.22 H new ATOM 0 HB2 ASN A 312 3.197 4.097 -6.407 1.00 0.24 H new ATOM 0 HB3 ASN A 312 1.444 4.095 -6.430 1.00 0.24 H new ATOM 0 HD21 ASN A 312 1.226 1.439 -8.821 1.00 0.98 H new ATOM 0 HD22 ASN A 312 0.365 2.564 -7.766 1.00 0.98 H new ATOM 713 N PRO A 313 0.713 7.119 -8.505 1.00 0.30 N ATOM 714 CA PRO A 313 -0.616 7.748 -8.506 1.00 0.36 C ATOM 715 C PRO A 313 -1.592 6.864 -9.271 1.00 0.39 C ATOM 716 O PRO A 313 -2.796 6.990 -9.163 1.00 0.44 O ATOM 717 CB PRO A 313 -0.389 9.093 -9.202 1.00 0.42 C ATOM 718 CG PRO A 313 0.905 8.926 -10.029 1.00 0.42 C ATOM 719 CD PRO A 313 1.720 7.828 -9.320 1.00 0.34 C ATOM 0 HA PRO A 313 -1.043 7.883 -7.512 1.00 0.36 H new ATOM 0 HB2 PRO A 313 -1.233 9.349 -9.843 1.00 0.42 H new ATOM 0 HB3 PRO A 313 -0.287 9.898 -8.474 1.00 0.42 H new ATOM 0 HG2 PRO A 313 0.678 8.642 -11.057 1.00 0.42 H new ATOM 0 HG3 PRO A 313 1.464 9.861 -10.073 1.00 0.42 H new ATOM 0 HD2 PRO A 313 2.199 7.160 -10.035 1.00 0.34 H new ATOM 0 HD3 PRO A 313 2.510 8.252 -8.701 1.00 0.34 H new ATOM 727 N GLU A 314 -1.065 5.957 -10.030 1.00 0.41 N ATOM 728 CA GLU A 314 -1.914 5.026 -10.808 1.00 0.48 C ATOM 729 C GLU A 314 -2.599 4.037 -9.858 1.00 0.48 C ATOM 730 O GLU A 314 -3.786 3.795 -9.944 1.00 0.56 O ATOM 731 CB GLU A 314 -1.016 4.262 -11.772 1.00 0.52 C ATOM 732 CG GLU A 314 0.105 3.574 -10.989 1.00 1.05 C ATOM 733 CD GLU A 314 1.313 3.367 -11.904 1.00 1.57 C ATOM 734 OE1 GLU A 314 1.410 4.075 -12.893 1.00 2.23 O ATOM 735 OE2 GLU A 314 2.119 2.504 -11.602 1.00 1.98 O ATOM 0 H GLU A 314 -0.061 5.818 -10.147 1.00 0.41 H new ATOM 0 HA GLU A 314 -2.678 5.579 -11.354 1.00 0.48 H new ATOM 0 HB2 GLU A 314 -1.599 3.521 -12.320 1.00 0.52 H new ATOM 0 HB3 GLU A 314 -0.593 4.944 -12.510 1.00 0.52 H new ATOM 0 HG2 GLU A 314 0.387 4.180 -10.128 1.00 1.05 H new ATOM 0 HG3 GLU A 314 -0.241 2.615 -10.604 1.00 1.05 H new ATOM 742 N THR A 315 -1.849 3.461 -8.958 1.00 0.42 N ATOM 743 CA THR A 315 -2.435 2.479 -8.000 1.00 0.48 C ATOM 744 C THR A 315 -2.564 3.141 -6.616 1.00 0.43 C ATOM 745 O THR A 315 -3.373 2.757 -5.803 1.00 0.44 O ATOM 746 CB THR A 315 -1.531 1.230 -7.974 1.00 0.58 C ATOM 747 OG1 THR A 315 -2.297 0.103 -8.366 1.00 0.94 O ATOM 748 CG2 THR A 315 -0.947 0.978 -6.583 1.00 0.68 C ATOM 0 H THR A 315 -0.849 3.629 -8.844 1.00 0.42 H new ATOM 0 HA THR A 315 -3.434 2.168 -8.305 1.00 0.48 H new ATOM 0 HB THR A 315 -0.701 1.397 -8.661 1.00 0.58 H new ATOM 0 HG1 THR A 315 -2.231 -0.016 -9.336 1.00 0.94 H new ATOM 0 HG21 THR A 315 -0.317 0.089 -6.609 1.00 0.68 H new ATOM 0 HG22 THR A 315 -0.350 1.838 -6.278 1.00 0.68 H new ATOM 0 HG23 THR A 315 -1.758 0.827 -5.870 1.00 0.68 H new ATOM 756 N ALA A 316 -1.755 4.129 -6.360 1.00 0.44 N ATOM 757 CA ALA A 316 -1.784 4.864 -5.057 1.00 0.47 C ATOM 758 C ALA A 316 -3.204 5.023 -4.517 1.00 0.48 C ATOM 759 O ALA A 316 -3.400 5.208 -3.332 1.00 0.55 O ATOM 760 CB ALA A 316 -1.182 6.254 -5.235 1.00 0.56 C ATOM 0 H ALA A 316 -1.053 4.470 -7.017 1.00 0.44 H new ATOM 0 HA ALA A 316 -1.205 4.275 -4.345 1.00 0.47 H new ATOM 0 HB1 ALA A 316 -1.205 6.785 -4.283 1.00 0.56 H new ATOM 0 HB2 ALA A 316 -0.150 6.163 -5.574 1.00 0.56 H new ATOM 0 HB3 ALA A 316 -1.760 6.809 -5.974 1.00 0.56 H new ATOM 766 N LYS A 317 -4.199 4.962 -5.339 1.00 0.48 N ATOM 767 CA LYS A 317 -5.566 5.088 -4.813 1.00 0.56 C ATOM 768 C LYS A 317 -6.054 3.681 -4.502 1.00 0.50 C ATOM 769 O LYS A 317 -6.735 3.437 -3.526 1.00 0.55 O ATOM 770 CB LYS A 317 -6.457 5.707 -5.875 1.00 0.66 C ATOM 771 CG LYS A 317 -5.629 6.550 -6.843 1.00 1.07 C ATOM 772 CD LYS A 317 -5.334 5.715 -8.090 1.00 0.84 C ATOM 773 CE LYS A 317 -6.092 6.296 -9.285 1.00 0.97 C ATOM 774 NZ LYS A 317 -6.480 5.196 -10.214 1.00 1.62 N ATOM 0 H LYS A 317 -4.124 4.831 -6.348 1.00 0.48 H new ATOM 0 HA LYS A 317 -5.589 5.717 -3.923 1.00 0.56 H new ATOM 0 HB2 LYS A 317 -6.980 4.922 -6.422 1.00 0.66 H new ATOM 0 HB3 LYS A 317 -7.218 6.328 -5.403 1.00 0.66 H new ATOM 0 HG2 LYS A 317 -6.171 7.456 -7.114 1.00 1.07 H new ATOM 0 HG3 LYS A 317 -4.699 6.865 -6.370 1.00 1.07 H new ATOM 0 HD2 LYS A 317 -4.263 5.711 -8.293 1.00 0.84 H new ATOM 0 HD3 LYS A 317 -5.632 4.679 -7.926 1.00 0.84 H new ATOM 0 HE2 LYS A 317 -6.980 6.826 -8.942 1.00 0.97 H new ATOM 0 HE3 LYS A 317 -5.468 7.023 -9.806 1.00 0.97 H new ATOM 0 HZ1 LYS A 317 -6.713 5.595 -11.146 1.00 1.62 H new ATOM 0 HZ2 LYS A 317 -5.689 4.528 -10.311 1.00 1.62 H new ATOM 0 HZ3 LYS A 317 -7.310 4.697 -9.834 1.00 1.62 H new ATOM 788 N GLU A 318 -5.681 2.750 -5.334 1.00 0.44 N ATOM 789 CA GLU A 318 -6.080 1.342 -5.115 1.00 0.44 C ATOM 790 C GLU A 318 -5.552 0.889 -3.755 1.00 0.41 C ATOM 791 O GLU A 318 -6.087 -0.015 -3.144 1.00 0.48 O ATOM 792 CB GLU A 318 -5.477 0.464 -6.210 1.00 0.50 C ATOM 793 CG GLU A 318 -6.600 -0.168 -7.037 1.00 0.77 C ATOM 794 CD GLU A 318 -7.038 0.806 -8.131 1.00 1.34 C ATOM 795 OE1 GLU A 318 -7.039 1.998 -7.871 1.00 1.94 O ATOM 796 OE2 GLU A 318 -7.367 0.344 -9.212 1.00 2.16 O ATOM 0 H GLU A 318 -5.111 2.911 -6.164 1.00 0.44 H new ATOM 0 HA GLU A 318 -7.166 1.256 -5.142 1.00 0.44 H new ATOM 0 HB2 GLU A 318 -4.829 1.060 -6.853 1.00 0.50 H new ATOM 0 HB3 GLU A 318 -4.856 -0.314 -5.766 1.00 0.50 H new ATOM 0 HG2 GLU A 318 -6.257 -1.102 -7.483 1.00 0.77 H new ATOM 0 HG3 GLU A 318 -7.445 -0.414 -6.394 1.00 0.77 H new ATOM 803 N ILE A 319 -4.517 1.523 -3.259 1.00 0.41 N ATOM 804 CA ILE A 319 -3.997 1.127 -1.930 1.00 0.49 C ATOM 805 C ILE A 319 -5.087 1.483 -0.917 1.00 0.63 C ATOM 806 O ILE A 319 -5.760 0.625 -0.380 1.00 0.78 O ATOM 807 CB ILE A 319 -2.700 1.884 -1.583 1.00 0.48 C ATOM 808 CG1 ILE A 319 -2.187 2.719 -2.744 1.00 0.46 C ATOM 809 CG2 ILE A 319 -1.597 0.903 -1.202 1.00 0.59 C ATOM 810 CD1 ILE A 319 -1.742 1.810 -3.887 1.00 0.87 C ATOM 0 H ILE A 319 -4.020 2.287 -3.717 1.00 0.41 H new ATOM 0 HA ILE A 319 -3.759 0.063 -1.919 1.00 0.49 H new ATOM 0 HB ILE A 319 -2.947 2.543 -0.751 1.00 0.48 H new ATOM 0 HG12 ILE A 319 -2.969 3.395 -3.090 1.00 0.46 H new ATOM 0 HG13 ILE A 319 -1.353 3.339 -2.416 1.00 0.46 H new ATOM 0 HG21 ILE A 319 -0.688 1.454 -0.960 1.00 0.59 H new ATOM 0 HG22 ILE A 319 -1.911 0.321 -0.335 1.00 0.59 H new ATOM 0 HG23 ILE A 319 -1.403 0.231 -2.038 1.00 0.59 H new ATOM 0 HD11 ILE A 319 -1.376 2.418 -4.714 1.00 0.87 H new ATOM 0 HD12 ILE A 319 -0.945 1.152 -3.540 1.00 0.87 H new ATOM 0 HD13 ILE A 319 -2.587 1.209 -4.224 1.00 0.87 H new ATOM 822 N GLU A 320 -5.285 2.753 -0.681 1.00 0.65 N ATOM 823 CA GLU A 320 -6.355 3.192 0.265 1.00 0.87 C ATOM 824 C GLU A 320 -7.641 2.406 -0.004 1.00 0.78 C ATOM 825 O GLU A 320 -8.397 2.099 0.895 1.00 0.94 O ATOM 826 CB GLU A 320 -6.654 4.677 0.027 1.00 1.03 C ATOM 827 CG GLU A 320 -6.932 5.369 1.363 1.00 1.27 C ATOM 828 CD GLU A 320 -8.273 6.102 1.288 1.00 1.46 C ATOM 829 OE1 GLU A 320 -9.178 5.579 0.658 1.00 2.20 O ATOM 830 OE2 GLU A 320 -8.373 7.174 1.863 1.00 1.83 O ATOM 0 H GLU A 320 -4.749 3.510 -1.105 1.00 0.65 H new ATOM 0 HA GLU A 320 -6.017 3.021 1.287 1.00 0.87 H new ATOM 0 HB2 GLU A 320 -5.809 5.153 -0.471 1.00 1.03 H new ATOM 0 HB3 GLU A 320 -7.514 4.783 -0.634 1.00 1.03 H new ATOM 0 HG2 GLU A 320 -6.951 4.635 2.168 1.00 1.27 H new ATOM 0 HG3 GLU A 320 -6.133 6.073 1.593 1.00 1.27 H new ATOM 837 N LYS A 321 -7.897 2.102 -1.244 1.00 0.58 N ATOM 838 CA LYS A 321 -9.140 1.363 -1.606 1.00 0.54 C ATOM 839 C LYS A 321 -8.978 -0.113 -1.269 1.00 0.61 C ATOM 840 O LYS A 321 -9.828 -0.709 -0.638 1.00 0.76 O ATOM 841 CB LYS A 321 -9.410 1.518 -3.104 1.00 0.63 C ATOM 842 CG LYS A 321 -10.920 1.523 -3.354 1.00 1.14 C ATOM 843 CD LYS A 321 -11.512 2.852 -2.881 1.00 1.64 C ATOM 844 CE LYS A 321 -11.382 3.894 -3.994 1.00 1.92 C ATOM 845 NZ LYS A 321 -12.182 5.101 -3.640 1.00 2.33 N ATOM 0 H LYS A 321 -7.293 2.336 -2.032 1.00 0.58 H new ATOM 0 HA LYS A 321 -9.978 1.771 -1.041 1.00 0.54 H new ATOM 0 HB2 LYS A 321 -8.967 2.444 -3.470 1.00 0.63 H new ATOM 0 HB3 LYS A 321 -8.942 0.702 -3.655 1.00 0.63 H new ATOM 0 HG2 LYS A 321 -11.124 1.379 -4.415 1.00 1.14 H new ATOM 0 HG3 LYS A 321 -11.390 0.694 -2.824 1.00 1.14 H new ATOM 0 HD2 LYS A 321 -12.560 2.720 -2.612 1.00 1.64 H new ATOM 0 HD3 LYS A 321 -10.994 3.195 -1.985 1.00 1.64 H new ATOM 0 HE2 LYS A 321 -10.335 4.166 -4.132 1.00 1.92 H new ATOM 0 HE3 LYS A 321 -11.731 3.478 -4.939 1.00 1.92 H new ATOM 0 HZ1 LYS A 321 -12.094 5.810 -4.396 1.00 2.33 H new ATOM 0 HZ2 LYS A 321 -13.181 4.835 -3.529 1.00 2.33 H new ATOM 0 HZ3 LYS A 321 -11.829 5.502 -2.747 1.00 2.33 H new ATOM 859 N LYS A 322 -7.891 -0.711 -1.665 1.00 0.63 N ATOM 860 CA LYS A 322 -7.694 -2.140 -1.335 1.00 0.86 C ATOM 861 C LYS A 322 -7.932 -2.296 0.154 1.00 1.01 C ATOM 862 O LYS A 322 -8.414 -3.305 0.628 1.00 1.21 O ATOM 863 CB LYS A 322 -6.262 -2.531 -1.660 1.00 0.98 C ATOM 864 CG LYS A 322 -6.245 -3.443 -2.887 1.00 1.03 C ATOM 865 CD LYS A 322 -7.098 -4.682 -2.611 1.00 1.43 C ATOM 866 CE LYS A 322 -8.000 -4.960 -3.815 1.00 1.94 C ATOM 867 NZ LYS A 322 -7.506 -6.166 -4.539 1.00 2.64 N ATOM 0 H LYS A 322 -7.139 -0.274 -2.198 1.00 0.63 H new ATOM 0 HA LYS A 322 -8.375 -2.772 -1.905 1.00 0.86 H new ATOM 0 HB2 LYS A 322 -5.665 -1.639 -1.849 1.00 0.98 H new ATOM 0 HB3 LYS A 322 -5.812 -3.041 -0.809 1.00 0.98 H new ATOM 0 HG2 LYS A 322 -6.630 -2.909 -3.756 1.00 1.03 H new ATOM 0 HG3 LYS A 322 -5.222 -3.737 -3.121 1.00 1.03 H new ATOM 0 HD2 LYS A 322 -6.457 -5.542 -2.417 1.00 1.43 H new ATOM 0 HD3 LYS A 322 -7.703 -4.528 -1.718 1.00 1.43 H new ATOM 0 HE2 LYS A 322 -9.027 -5.116 -3.485 1.00 1.94 H new ATOM 0 HE3 LYS A 322 -8.008 -4.099 -4.484 1.00 1.94 H new ATOM 0 HZ1 LYS A 322 -8.119 -6.355 -5.357 1.00 2.64 H new ATOM 0 HZ2 LYS A 322 -6.533 -6.000 -4.866 1.00 2.64 H new ATOM 0 HZ3 LYS A 322 -7.521 -6.986 -3.899 1.00 2.64 H new ATOM 881 N VAL A 323 -7.599 -1.278 0.890 1.00 0.99 N ATOM 882 CA VAL A 323 -7.803 -1.321 2.366 1.00 1.23 C ATOM 883 C VAL A 323 -9.194 -0.770 2.696 1.00 1.27 C ATOM 884 O VAL A 323 -9.909 -1.317 3.513 1.00 1.55 O ATOM 885 CB VAL A 323 -6.713 -0.487 3.058 1.00 1.30 C ATOM 886 CG1 VAL A 323 -7.219 0.054 4.400 1.00 1.59 C ATOM 887 CG2 VAL A 323 -5.493 -1.374 3.309 1.00 1.33 C ATOM 0 H VAL A 323 -7.192 -0.413 0.534 1.00 0.99 H new ATOM 0 HA VAL A 323 -7.735 -2.348 2.724 1.00 1.23 H new ATOM 0 HB VAL A 323 -6.450 0.353 2.415 1.00 1.30 H new ATOM 0 HG11 VAL A 323 -6.433 0.642 4.875 1.00 1.59 H new ATOM 0 HG12 VAL A 323 -8.092 0.684 4.232 1.00 1.59 H new ATOM 0 HG13 VAL A 323 -7.491 -0.779 5.049 1.00 1.59 H new ATOM 0 HG21 VAL A 323 -4.714 -0.791 3.800 1.00 1.33 H new ATOM 0 HG22 VAL A 323 -5.777 -2.211 3.947 1.00 1.33 H new ATOM 0 HG23 VAL A 323 -5.118 -1.754 2.359 1.00 1.33 H new ATOM 897 N ARG A 324 -9.584 0.307 2.072 1.00 1.06 N ATOM 898 CA ARG A 324 -10.927 0.881 2.361 1.00 1.17 C ATOM 899 C ARG A 324 -12.007 -0.111 1.926 1.00 1.26 C ATOM 900 O ARG A 324 -12.995 -0.306 2.606 1.00 1.62 O ATOM 901 CB ARG A 324 -11.105 2.198 1.601 1.00 1.13 C ATOM 902 CG ARG A 324 -12.275 2.979 2.202 1.00 1.52 C ATOM 903 CD ARG A 324 -11.738 4.157 3.018 1.00 1.49 C ATOM 904 NE ARG A 324 -12.618 5.343 2.819 1.00 1.77 N ATOM 905 CZ ARG A 324 -12.305 6.488 3.363 1.00 2.06 C ATOM 906 NH1 ARG A 324 -11.089 6.697 3.790 1.00 2.59 N ATOM 907 NH2 ARG A 324 -13.206 7.425 3.479 1.00 2.53 N ATOM 0 H ARG A 324 -9.033 0.812 1.378 1.00 1.06 H new ATOM 0 HA ARG A 324 -11.014 1.072 3.431 1.00 1.17 H new ATOM 0 HB2 ARG A 324 -10.191 2.790 1.658 1.00 1.13 H new ATOM 0 HB3 ARG A 324 -11.291 1.999 0.545 1.00 1.13 H new ATOM 0 HG2 ARG A 324 -12.930 3.341 1.409 1.00 1.52 H new ATOM 0 HG3 ARG A 324 -12.874 2.326 2.837 1.00 1.52 H new ATOM 0 HD2 ARG A 324 -11.699 3.893 4.075 1.00 1.49 H new ATOM 0 HD3 ARG A 324 -10.719 4.392 2.710 1.00 1.49 H new ATOM 0 HE ARG A 324 -13.465 5.260 2.257 1.00 1.77 H new ATOM 0 HH11 ARG A 324 -10.384 5.966 3.699 1.00 2.59 H new ATOM 0 HH12 ARG A 324 -10.844 7.591 4.215 1.00 2.59 H new ATOM 0 HH21 ARG A 324 -14.156 7.263 3.145 1.00 2.53 H new ATOM 0 HH22 ARG A 324 -12.960 8.319 3.904 1.00 2.53 H new ATOM 921 N GLU A 325 -11.826 -0.742 0.798 1.00 1.15 N ATOM 922 CA GLU A 325 -12.840 -1.725 0.321 1.00 1.49 C ATOM 923 C GLU A 325 -12.572 -3.084 0.960 1.00 1.83 C ATOM 924 O GLU A 325 -13.386 -3.983 0.901 1.00 2.17 O ATOM 925 CB GLU A 325 -12.749 -1.853 -1.198 1.00 1.56 C ATOM 926 CG GLU A 325 -13.650 -0.806 -1.854 1.00 1.80 C ATOM 927 CD GLU A 325 -14.523 -1.476 -2.916 1.00 2.22 C ATOM 928 OE1 GLU A 325 -14.080 -1.568 -4.048 1.00 2.76 O ATOM 929 OE2 GLU A 325 -15.622 -1.887 -2.578 1.00 2.56 O ATOM 0 H GLU A 325 -11.019 -0.619 0.186 1.00 1.15 H new ATOM 0 HA GLU A 325 -13.836 -1.382 0.599 1.00 1.49 H new ATOM 0 HB2 GLU A 325 -11.718 -1.716 -1.524 1.00 1.56 H new ATOM 0 HB3 GLU A 325 -13.051 -2.853 -1.508 1.00 1.56 H new ATOM 0 HG2 GLU A 325 -14.277 -0.328 -1.101 1.00 1.80 H new ATOM 0 HG3 GLU A 325 -13.044 -0.022 -2.308 1.00 1.80 H new ATOM 936 N LEU A 326 -11.439 -3.235 1.579 1.00 1.98 N ATOM 937 CA LEU A 326 -11.116 -4.529 2.235 1.00 2.44 C ATOM 938 C LEU A 326 -12.277 -4.913 3.144 1.00 2.97 C ATOM 939 O LEU A 326 -12.596 -6.073 3.318 1.00 3.50 O ATOM 940 CB LEU A 326 -9.854 -4.367 3.078 1.00 2.33 C ATOM 941 CG LEU A 326 -9.270 -5.743 3.396 1.00 2.46 C ATOM 942 CD1 LEU A 326 -8.484 -6.258 2.189 1.00 2.94 C ATOM 943 CD2 LEU A 326 -8.336 -5.630 4.601 1.00 2.64 C ATOM 0 H LEU A 326 -10.720 -2.516 1.660 1.00 1.98 H new ATOM 0 HA LEU A 326 -10.954 -5.300 1.482 1.00 2.44 H new ATOM 0 HB2 LEU A 326 -9.121 -3.765 2.541 1.00 2.33 H new ATOM 0 HB3 LEU A 326 -10.087 -3.837 4.002 1.00 2.33 H new ATOM 0 HG LEU A 326 -10.079 -6.437 3.624 1.00 2.46 H new ATOM 0 HD11 LEU A 326 -8.068 -7.239 2.417 1.00 2.94 H new ATOM 0 HD12 LEU A 326 -9.149 -6.337 1.329 1.00 2.94 H new ATOM 0 HD13 LEU A 326 -7.674 -5.565 1.960 1.00 2.94 H new ATOM 0 HD21 LEU A 326 -7.918 -6.610 4.830 1.00 2.64 H new ATOM 0 HD22 LEU A 326 -7.528 -4.935 4.371 1.00 2.64 H new ATOM 0 HD23 LEU A 326 -8.895 -5.264 5.462 1.00 2.64 H new ATOM 955 N LEU A 327 -12.909 -3.935 3.724 1.00 2.97 N ATOM 956 CA LEU A 327 -14.053 -4.214 4.627 1.00 3.64 C ATOM 957 C LEU A 327 -15.194 -3.246 4.312 1.00 4.11 C ATOM 958 O LEU A 327 -16.196 -3.214 4.999 1.00 4.84 O ATOM 959 CB LEU A 327 -13.613 -4.031 6.080 1.00 3.82 C ATOM 960 CG LEU A 327 -14.081 -5.226 6.911 1.00 4.05 C ATOM 961 CD1 LEU A 327 -12.867 -5.952 7.492 1.00 4.66 C ATOM 962 CD2 LEU A 327 -14.974 -4.733 8.052 1.00 4.36 C ATOM 0 H LEU A 327 -12.680 -2.948 3.610 1.00 2.97 H new ATOM 0 HA LEU A 327 -14.393 -5.239 4.479 1.00 3.64 H new ATOM 0 HB2 LEU A 327 -12.528 -3.940 6.134 1.00 3.82 H new ATOM 0 HB3 LEU A 327 -14.030 -3.108 6.484 1.00 3.82 H new ATOM 0 HG LEU A 327 -14.644 -5.911 6.277 1.00 4.05 H new ATOM 0 HD11 LEU A 327 -13.201 -6.804 8.084 1.00 4.66 H new ATOM 0 HD12 LEU A 327 -12.230 -6.302 6.680 1.00 4.66 H new ATOM 0 HD13 LEU A 327 -12.303 -5.268 8.126 1.00 4.66 H new ATOM 0 HD21 LEU A 327 -15.309 -5.584 8.646 1.00 4.36 H new ATOM 0 HD22 LEU A 327 -14.410 -4.048 8.685 1.00 4.36 H new ATOM 0 HD23 LEU A 327 -15.840 -4.216 7.639 1.00 4.36 H new ATOM 974 N LEU A 328 -15.051 -2.454 3.280 1.00 3.76 N ATOM 975 CA LEU A 328 -16.134 -1.489 2.928 1.00 4.28 C ATOM 976 C LEU A 328 -17.494 -2.179 3.054 1.00 5.15 C ATOM 977 O LEU A 328 -18.281 -1.867 3.926 1.00 5.36 O ATOM 978 CB LEU A 328 -15.941 -1.002 1.490 1.00 4.75 C ATOM 979 CG LEU A 328 -17.202 -0.274 1.020 1.00 4.79 C ATOM 980 CD1 LEU A 328 -16.808 0.918 0.146 1.00 4.46 C ATOM 981 CD2 LEU A 328 -18.071 -1.234 0.205 1.00 5.68 C ATOM 0 H LEU A 328 -14.235 -2.434 2.669 1.00 3.76 H new ATOM 0 HA LEU A 328 -16.093 -0.637 3.607 1.00 4.28 H new ATOM 0 HB2 LEU A 328 -15.081 -0.334 1.434 1.00 4.75 H new ATOM 0 HB3 LEU A 328 -15.731 -1.847 0.834 1.00 4.75 H new ATOM 0 HG LEU A 328 -17.761 0.078 1.887 1.00 4.79 H new ATOM 0 HD11 LEU A 328 -17.706 1.436 -0.189 1.00 4.46 H new ATOM 0 HD12 LEU A 328 -16.187 1.603 0.723 1.00 4.46 H new ATOM 0 HD13 LEU A 328 -16.249 0.565 -0.720 1.00 4.46 H new ATOM 0 HD21 LEU A 328 -18.970 -0.716 -0.130 1.00 5.68 H new ATOM 0 HD22 LEU A 328 -17.511 -1.586 -0.661 1.00 5.68 H new ATOM 0 HD23 LEU A 328 -18.353 -2.085 0.825 1.00 5.68 H new ATOM 993 N SER A 329 -17.776 -3.117 2.192 1.00 5.96 N ATOM 994 CA SER A 329 -19.084 -3.826 2.266 1.00 7.03 C ATOM 995 C SER A 329 -18.969 -5.004 3.235 1.00 7.47 C ATOM 996 O SER A 329 -19.430 -6.094 2.960 1.00 8.28 O ATOM 997 CB SER A 329 -19.465 -4.340 0.877 1.00 7.74 C ATOM 998 OG SER A 329 -20.848 -4.100 0.651 1.00 7.89 O ATOM 0 H SER A 329 -17.158 -3.423 1.441 1.00 5.96 H new ATOM 0 HA SER A 329 -19.852 -3.138 2.620 1.00 7.03 H new ATOM 0 HB2 SER A 329 -18.868 -3.839 0.115 1.00 7.74 H new ATOM 0 HB3 SER A 329 -19.252 -5.406 0.800 1.00 7.74 H new ATOM 0 HG SER A 329 -21.096 -4.427 -0.239 1.00 7.89 H new ATOM 1004 N ASN A 330 -18.356 -4.794 4.367 1.00 7.16 N ATOM 1005 CA ASN A 330 -18.210 -5.900 5.354 1.00 7.84 C ATOM 1006 C ASN A 330 -19.594 -6.344 5.832 1.00 8.10 C ATOM 1007 O ASN A 330 -19.731 -7.502 6.191 1.00 8.68 O ATOM 1008 CB ASN A 330 -17.390 -5.410 6.549 1.00 8.49 C ATOM 1009 CG ASN A 330 -18.218 -4.414 7.364 1.00 8.56 C ATOM 1010 OD1 ASN A 330 -18.817 -4.773 8.358 1.00 8.19 O ATOM 1011 ND2 ASN A 330 -18.276 -3.167 6.983 1.00 9.27 N ATOM 1012 OXT ASN A 330 -20.492 -5.518 5.831 1.00 7.96 O ATOM 0 H ASN A 330 -17.949 -3.903 4.651 1.00 7.16 H new ATOM 0 HA ASN A 330 -17.702 -6.742 4.884 1.00 7.84 H new ATOM 0 HB2 ASN A 330 -17.099 -6.254 7.174 1.00 8.49 H new ATOM 0 HB3 ASN A 330 -16.471 -4.937 6.203 1.00 8.49 H new ATOM 0 HD21 ASN A 330 -18.824 -2.495 7.520 1.00 9.27 H new ATOM 0 HD22 ASN A 330 -17.773 -2.865 6.149 1.00 9.27 H new TER 1019 ASN A 330 END