USER MOD reduce.3.24.130724 H: found=0, std=0, add=414, rem=0, adj=8 USER MOD reduce.3.24.130724 removed 417 hydrogens (0 hets) HEADER RNA BINDING PROTEIN 08-AUG-13 2MBY TITLE NMR STRUCTURE OF RRP7 C-TERMINAL DOMAIN COMPND MOL_ID: 1; COMPND 2 MOLECULE: RIBOSOMAL RNA-PROCESSING PROTEIN 7; COMPND 3 CHAIN: A; COMPND 4 FRAGMENT: UNP RESIDUES 256-297; COMPND 5 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; SOURCE 3 ORGANISM_COMMON: YEAST; SOURCE 4 ORGANISM_TAXID: 559292; SOURCE 5 STRAIN: ATCC 204508 / S288C; SOURCE 6 GENE: RRP7, YCL031C, YCL184, YCL31C; SOURCE 7 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 8 EXPRESSION_SYSTEM_TAXID: 562; SOURCE 9 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 0 EXPRESSION_SYSTEM_PLASMID: PETDUET KEYWDS 90S PRERIBOSOME, NUCLEOLUS, RNA BINDING PROTEIN EXPDTA SOLUTION NMR AUTHOR J.LIN,Y.FENG,K.YE REVDAT 2 06-NOV-13 2MBY 1 JRNL REVDAT 1 25-SEP-13 2MBY 0 JRNL AUTH J.LIN,J.LU,Y.FENG,M.SUN,K.YE JRNL TITL AN RNA-BINDING COMPLEX INVOLVED IN RIBOSOME BIOGENESIS JRNL TITL 2 CONTAINS A PROTEIN WITH HOMOLOGY TO TRNA CCA-ADDING ENZYME. JRNL REF PLOS BIOL. V. 11 01669 2013 JRNL REFN ISSN 1544-9173 JRNL PMID 24130456 JRNL DOI 10.1371/JOURNAL.PBIO.1001669 REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : CNS REMARK 3 AUTHORS : BRUNGER, ADAMS, CLORE, GROS, NILGES AND READ REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 2MBY COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 09-AUG-13. REMARK 100 THE RCSB ID CODE IS RCSB103455. REMARK 210 REMARK 210 EXPERIMENTAL DETAILS REMARK 210 EXPERIMENT TYPE : NMR REMARK 210 TEMPERATURE (KELVIN) : 298 REMARK 210 PH : 6 REMARK 210 IONIC STRENGTH : 0.05 REMARK 210 PRESSURE : AMBIENT REMARK 210 SAMPLE CONTENTS : 1 MM [U-100% 13C; U-100% 15N] REMARK 210 PROTEIN, 50 MM POTASSIUM REMARK 210 PHOSPHATE, 0.05 % SODIUM AZIDE, REMARK 210 90% H2O/10% D2O REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : 2D 1H-15N HSQC; 3D 1H-15N TOCSY; REMARK 210 3D CBCA(CO)NH; 3D HNCACB; 3D REMARK 210 HNCO; 3D HN(CO)CA; 3D HBHA(CO)NH; REMARK 210 3D HCCH-TOCSY; 3D 1H-15N NOESY; REMARK 210 3D 1H-13C NOESY REMARK 210 SPECTROMETER FIELD STRENGTH : 600 MHZ REMARK 210 SPECTROMETER MODEL : DMX REMARK 210 SPECTROMETER MANUFACTURER : BRUKER REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : CYANA, NMRVIEW, FELIX REMARK 210 METHOD USED : SIMULATED ANNEALING REMARK 210 REMARK 210 CONFORMERS, NUMBER CALCULATED : 100 REMARK 210 CONFORMERS, NUMBER SUBMITTED : 1 REMARK 210 CONFORMERS, SELECTION CRITERIA : STRUCTURES WITH THE LOWEST ENERGY REMARK 210 REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : 1 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: 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 265 -80.62 -57.38 REMARK 500 LYS A 266 -177.35 177.26 REMARK 500 ALA A 289 -79.37 61.15 REMARK 500 LYS A 292 51.39 -92.01 REMARK 500 REMARK 500 REMARK: NULL REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 4M5D RELATED DB: PDB REMARK 900 CRYSTAL STRUCTURE OF RRP7 N-TERMINAL DOMAIN REMARK 900 RELATED ID: 19416 RELATED DB: BMRB DBREF 2MBY A 256 297 UNP P25368 RRP7_YEAST 256 297 SEQADV 2MBY GLY A 252 UNP P25368 EXPRESSION TAG SEQADV 2MBY PRO A 253 UNP P25368 EXPRESSION TAG SEQADV 2MBY GLU A 254 UNP P25368 EXPRESSION TAG SEQADV 2MBY ALA A 255 UNP P25368 EXPRESSION TAG SEQRES 1 A 46 GLY PRO GLU ALA ASP PHE TYR ARG PHE GLN VAL ARG GLU SEQRES 2 A 46 ARG LYS LYS GLN GLU ILE ASN GLN LEU LEU SER LYS PHE SEQRES 3 A 46 LYS GLU ASP GLN GLU ARG ILE LYS VAL MET LYS ALA LYS SEQRES 4 A 46 ARG LYS PHE ASN PRO TYR THR HELIX 1 1 GLY A 252 LYS A 266 1 15 HELIX 2 2 GLN A 268 ALA A 289 1 22 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 ASN : amide:sc= 0 X(o=-0.13,f=-0.13) USER MOD Set 1.2: A 297 THR OG1 : rot 180:sc= -0.129 USER MOD Set 2.1: A 285 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 292 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.1: A 267 LYS NZ :NH3+ -172:sc= 0.232 (180deg=-0.0409) USER MOD Set 3.2: A 271 ASN : amide:sc= -2.63 K(o=-2.4,f=-12!) USER MOD Set 4.1: A 266 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 4.2: A 268 GLN : amide:sc= -0.0461 K(o=-0.046,f=-0.66) USER MOD Single : A 258 TYR OH : rot 180:sc= 0 USER MOD Single : A 261 GLN : amide:sc= -0.715 K(o=-0.72,f=-5.3!) USER MOD Single : A 272 GLN : amide:sc= -0.0628 K(o=-0.063,f=-1.1) USER MOD Single : A 275 SER OG : rot -51:sc= 0.915 USER MOD Single : A 276 LYS NZ :NH3+ 141:sc= 0.212 (180deg=0) USER MOD Single : A 278 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 281 GLN :FLIP amide:sc= -0.724 F(o=-1.3!,f=-0.72) USER MOD Single : A 287 MET CE :methyl -114:sc= -0.291 (180deg=-2.3!) USER MOD Single : A 288 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 290 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 296 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 252 -10.543 -31.271 -18.059 1.00 0.00 N ATOM 2 CA GLY A 252 -11.778 -31.382 -18.884 1.00 0.00 C ATOM 3 C GLY A 252 -11.877 -30.288 -19.931 1.00 0.00 C ATOM 4 O GLY A 252 -11.086 -29.346 -19.924 1.00 0.00 O ATOM 0 HA2 GLY A 252 -11.796 -32.354 -19.376 1.00 0.00 H new ATOM 0 HA3 GLY A 252 -12.651 -31.338 -18.233 1.00 0.00 H new ATOM 10 N PRO A 253 -12.850 -30.387 -20.854 1.00 0.00 N ATOM 11 CA PRO A 253 -13.040 -29.389 -21.911 1.00 0.00 C ATOM 12 C PRO A 253 -13.564 -28.063 -21.370 1.00 0.00 C ATOM 13 O PRO A 253 -13.277 -27.000 -21.919 1.00 0.00 O ATOM 14 CB PRO A 253 -14.077 -30.037 -22.830 1.00 0.00 C ATOM 15 CG PRO A 253 -14.830 -30.974 -21.950 1.00 0.00 C ATOM 16 CD PRO A 253 -13.840 -31.478 -20.937 1.00 0.00 C ATOM 0 HA PRO A 253 -12.103 -29.142 -22.410 1.00 0.00 H new ATOM 0 HB2 PRO A 253 -14.738 -29.290 -23.270 1.00 0.00 H new ATOM 0 HB3 PRO A 253 -13.600 -30.566 -23.655 1.00 0.00 H new ATOM 0 HG2 PRO A 253 -15.663 -30.467 -21.463 1.00 0.00 H new ATOM 0 HG3 PRO A 253 -15.251 -31.797 -22.527 1.00 0.00 H new ATOM 0 HD2 PRO A 253 -14.312 -31.666 -19.973 1.00 0.00 H new ATOM 0 HD3 PRO A 253 -13.381 -32.414 -21.255 1.00 0.00 H new ATOM 24 N GLU A 254 -14.334 -28.135 -20.289 1.00 0.00 N ATOM 25 CA GLU A 254 -14.898 -26.940 -19.672 1.00 0.00 C ATOM 26 C GLU A 254 -13.841 -26.187 -18.875 1.00 0.00 C ATOM 27 O GLU A 254 -13.599 -25.002 -19.104 1.00 0.00 O ATOM 28 CB GLU A 254 -16.067 -27.317 -18.760 1.00 0.00 C ATOM 29 CG GLU A 254 -17.052 -28.279 -19.401 1.00 0.00 C ATOM 30 CD GLU A 254 -18.096 -27.570 -20.243 1.00 0.00 C ATOM 31 OE1 GLU A 254 -17.795 -26.475 -20.763 1.00 0.00 O1- ATOM 32 OE2 GLU A 254 -19.214 -28.110 -20.380 1.00 0.00 O ATOM 0 H GLU A 254 -14.582 -29.008 -19.823 1.00 0.00 H new ATOM 0 HA GLU A 254 -15.259 -26.288 -20.467 1.00 0.00 H new ATOM 0 HB2 GLU A 254 -15.675 -27.766 -17.847 1.00 0.00 H new ATOM 0 HB3 GLU A 254 -16.596 -26.410 -18.467 1.00 0.00 H new ATOM 0 HG2 GLU A 254 -16.508 -28.988 -20.025 1.00 0.00 H new ATOM 0 HG3 GLU A 254 -17.550 -28.856 -18.622 1.00 0.00 H new ATOM 39 N ALA A 255 -13.216 -26.889 -17.941 1.00 0.00 N ATOM 40 CA ALA A 255 -12.180 -26.298 -17.103 1.00 0.00 C ATOM 41 C ALA A 255 -11.044 -25.736 -17.950 1.00 0.00 C ATOM 42 O ALA A 255 -10.400 -24.758 -17.573 1.00 0.00 O ATOM 43 CB ALA A 255 -11.646 -27.327 -16.118 1.00 0.00 C ATOM 0 H ALA A 255 -13.408 -27.871 -17.743 1.00 0.00 H new ATOM 0 HA ALA A 255 -12.625 -25.474 -16.545 1.00 0.00 H new ATOM 0 HB1 ALA A 255 -10.873 -26.871 -15.499 1.00 0.00 H new ATOM 0 HB2 ALA A 255 -12.459 -27.679 -15.483 1.00 0.00 H new ATOM 0 HB3 ALA A 255 -11.223 -28.169 -16.665 1.00 0.00 H new ATOM 49 N ASP A 256 -10.808 -26.358 -19.100 1.00 0.00 N ATOM 50 CA ASP A 256 -9.752 -25.916 -20.003 1.00 0.00 C ATOM 51 C ASP A 256 -10.084 -24.552 -20.595 1.00 0.00 C ATOM 52 O ASP A 256 -9.217 -23.685 -20.713 1.00 0.00 O ATOM 53 CB ASP A 256 -9.549 -26.936 -21.125 1.00 0.00 C ATOM 54 CG ASP A 256 -8.499 -27.973 -20.780 1.00 0.00 C ATOM 55 OD1 ASP A 256 -7.444 -27.591 -20.231 1.00 0.00 O ATOM 56 OD2 ASP A 256 -8.731 -29.170 -21.057 1.00 0.00 O1- ATOM 0 H ASP A 256 -11.333 -27.169 -19.428 1.00 0.00 H new ATOM 0 HA ASP A 256 -8.829 -25.831 -19.430 1.00 0.00 H new ATOM 0 HB2 ASP A 256 -10.495 -27.436 -21.333 1.00 0.00 H new ATOM 0 HB3 ASP A 256 -9.256 -26.416 -22.037 1.00 0.00 H new ATOM 61 N PHE A 257 -11.348 -24.366 -20.964 1.00 0.00 N ATOM 62 CA PHE A 257 -11.799 -23.106 -21.541 1.00 0.00 C ATOM 63 C PHE A 257 -11.723 -21.982 -20.511 1.00 0.00 C ATOM 64 O PHE A 257 -11.113 -20.942 -20.757 1.00 0.00 O ATOM 65 CB PHE A 257 -13.231 -23.243 -22.062 1.00 0.00 C ATOM 66 CG PHE A 257 -13.318 -23.362 -23.557 1.00 0.00 C ATOM 67 CD1 PHE A 257 -12.562 -24.305 -24.234 1.00 0.00 C ATOM 68 CD2 PHE A 257 -14.156 -22.532 -24.283 1.00 0.00 C ATOM 69 CE1 PHE A 257 -12.640 -24.418 -25.609 1.00 0.00 C ATOM 70 CE2 PHE A 257 -14.237 -22.639 -25.658 1.00 0.00 C ATOM 71 CZ PHE A 257 -13.479 -23.583 -26.322 1.00 0.00 C ATOM 0 H PHE A 257 -12.078 -25.073 -20.873 1.00 0.00 H new ATOM 0 HA PHE A 257 -11.141 -22.858 -22.374 1.00 0.00 H new ATOM 0 HB2 PHE A 257 -13.691 -24.121 -21.609 1.00 0.00 H new ATOM 0 HB3 PHE A 257 -13.810 -22.377 -21.740 1.00 0.00 H new ATOM 0 HD1 PHE A 257 -11.904 -24.959 -23.681 1.00 0.00 H new ATOM 0 HD2 PHE A 257 -14.753 -21.793 -23.769 1.00 0.00 H new ATOM 0 HE1 PHE A 257 -12.046 -25.158 -26.126 1.00 0.00 H new ATOM 0 HE2 PHE A 257 -14.893 -21.985 -26.213 1.00 0.00 H new ATOM 0 HZ PHE A 257 -13.542 -23.669 -27.397 1.00 0.00 H new ATOM 81 N TYR A 258 -12.347 -22.201 -19.359 1.00 0.00 N ATOM 82 CA TYR A 258 -12.349 -21.207 -18.290 1.00 0.00 C ATOM 83 C TYR A 258 -10.928 -20.904 -17.825 1.00 0.00 C ATOM 84 O TYR A 258 -10.628 -19.789 -17.398 1.00 0.00 O ATOM 85 CB TYR A 258 -13.194 -21.700 -17.112 1.00 0.00 C ATOM 86 CG TYR A 258 -14.443 -20.882 -16.877 1.00 0.00 C ATOM 87 CD1 TYR A 258 -15.418 -20.769 -17.861 1.00 0.00 C ATOM 88 CD2 TYR A 258 -14.649 -20.222 -15.672 1.00 0.00 C ATOM 89 CE1 TYR A 258 -16.561 -20.021 -17.650 1.00 0.00 C ATOM 90 CE2 TYR A 258 -15.790 -19.474 -15.452 1.00 0.00 C ATOM 91 CZ TYR A 258 -16.743 -19.377 -16.445 1.00 0.00 C ATOM 92 OH TYR A 258 -17.880 -18.632 -16.232 1.00 0.00 O ATOM 0 H TYR A 258 -12.858 -23.057 -19.141 1.00 0.00 H new ATOM 0 HA TYR A 258 -12.785 -20.287 -18.681 1.00 0.00 H new ATOM 0 HB2 TYR A 258 -13.478 -22.738 -17.289 1.00 0.00 H new ATOM 0 HB3 TYR A 258 -12.585 -21.685 -16.208 1.00 0.00 H new ATOM 0 HD1 TYR A 258 -15.280 -21.274 -18.806 1.00 0.00 H new ATOM 0 HD2 TYR A 258 -13.904 -20.295 -14.893 1.00 0.00 H new ATOM 0 HE1 TYR A 258 -17.308 -19.941 -18.426 1.00 0.00 H new ATOM 0 HE2 TYR A 258 -15.935 -18.969 -14.509 1.00 0.00 H new ATOM 0 HH TYR A 258 -17.854 -18.245 -15.332 1.00 0.00 H new ATOM 102 N ARG A 259 -10.056 -21.903 -17.911 1.00 0.00 N ATOM 103 CA ARG A 259 -8.667 -21.740 -17.498 1.00 0.00 C ATOM 104 C ARG A 259 -7.938 -20.764 -18.416 1.00 0.00 C ATOM 105 O ARG A 259 -7.439 -19.729 -17.970 1.00 0.00 O ATOM 106 CB ARG A 259 -7.951 -23.094 -17.501 1.00 0.00 C ATOM 107 CG ARG A 259 -7.871 -23.742 -16.127 1.00 0.00 C ATOM 108 CD ARG A 259 -6.521 -23.499 -15.473 1.00 0.00 C ATOM 109 NE ARG A 259 -5.648 -24.667 -15.570 1.00 0.00 N ATOM 110 CZ ARG A 259 -5.741 -25.730 -14.774 1.00 0.00 C ATOM 111 NH1 ARG A 259 -6.666 -25.778 -13.824 1.00 0.00 N1+ ATOM 112 NH2 ARG A 259 -4.907 -26.749 -14.930 1.00 0.00 N ATOM 0 H ARG A 259 -10.286 -22.833 -18.262 1.00 0.00 H new ATOM 0 HA ARG A 259 -8.659 -21.334 -16.486 1.00 0.00 H new ATOM 0 HB2 ARG A 259 -8.470 -23.769 -18.182 1.00 0.00 H new ATOM 0 HB3 ARG A 259 -6.942 -22.961 -17.891 1.00 0.00 H new ATOM 0 HG2 ARG A 259 -8.661 -23.345 -15.490 1.00 0.00 H new ATOM 0 HG3 ARG A 259 -8.044 -24.814 -16.219 1.00 0.00 H new ATOM 0 HD2 ARG A 259 -6.037 -22.644 -15.946 1.00 0.00 H new ATOM 0 HD3 ARG A 259 -6.667 -23.242 -14.424 1.00 0.00 H new ATOM 0 HE ARG A 259 -4.925 -24.668 -16.290 1.00 0.00 H new ATOM 0 HH11 ARG A 259 -7.311 -24.998 -13.700 1.00 0.00 H new ATOM 0 HH12 ARG A 259 -6.732 -26.595 -13.217 1.00 0.00 H new ATOM 0 HH21 ARG A 259 -4.195 -26.718 -15.660 1.00 0.00 H new ATOM 0 HH22 ARG A 259 -4.978 -27.564 -14.320 1.00 0.00 H new ATOM 126 N PHE A 260 -7.883 -21.099 -19.700 1.00 0.00 N ATOM 127 CA PHE A 260 -7.217 -20.254 -20.684 1.00 0.00 C ATOM 128 C PHE A 260 -7.838 -18.861 -20.716 1.00 0.00 C ATOM 129 O PHE A 260 -7.133 -17.856 -20.646 1.00 0.00 O ATOM 130 CB PHE A 260 -7.298 -20.892 -22.072 1.00 0.00 C ATOM 131 CG PHE A 260 -6.516 -22.170 -22.192 1.00 0.00 C ATOM 132 CD1 PHE A 260 -5.180 -22.216 -21.829 1.00 0.00 C ATOM 133 CD2 PHE A 260 -7.118 -23.322 -22.668 1.00 0.00 C ATOM 134 CE1 PHE A 260 -4.457 -23.390 -21.939 1.00 0.00 C ATOM 135 CE2 PHE A 260 -6.402 -24.499 -22.781 1.00 0.00 C ATOM 136 CZ PHE A 260 -5.070 -24.533 -22.415 1.00 0.00 C ATOM 0 H PHE A 260 -8.292 -21.951 -20.084 1.00 0.00 H new ATOM 0 HA PHE A 260 -6.170 -20.159 -20.395 1.00 0.00 H new ATOM 0 HB2 PHE A 260 -8.343 -21.091 -22.311 1.00 0.00 H new ATOM 0 HB3 PHE A 260 -6.932 -20.180 -22.812 1.00 0.00 H new ATOM 0 HD1 PHE A 260 -4.697 -21.325 -21.456 1.00 0.00 H new ATOM 0 HD2 PHE A 260 -8.159 -23.301 -22.954 1.00 0.00 H new ATOM 0 HE1 PHE A 260 -3.416 -23.413 -21.653 1.00 0.00 H new ATOM 0 HE2 PHE A 260 -6.883 -25.391 -23.155 1.00 0.00 H new ATOM 0 HZ PHE A 260 -4.509 -25.452 -22.501 1.00 0.00 H new ATOM 146 N GLN A 261 -9.161 -18.809 -20.824 1.00 0.00 N ATOM 147 CA GLN A 261 -9.876 -17.539 -20.867 1.00 0.00 C ATOM 148 C GLN A 261 -9.599 -16.708 -19.616 1.00 0.00 C ATOM 149 O GLN A 261 -9.530 -15.481 -19.676 1.00 0.00 O ATOM 150 CB GLN A 261 -11.382 -17.784 -21.028 1.00 0.00 C ATOM 151 CG GLN A 261 -12.106 -18.094 -19.725 1.00 0.00 C ATOM 152 CD GLN A 261 -12.670 -16.852 -19.062 1.00 0.00 C ATOM 153 OE1 GLN A 261 -12.161 -16.394 -18.039 1.00 0.00 O ATOM 154 NE2 GLN A 261 -13.729 -16.300 -19.643 1.00 0.00 N ATOM 0 H GLN A 261 -9.760 -19.632 -20.883 1.00 0.00 H new ATOM 0 HA GLN A 261 -9.517 -16.976 -21.728 1.00 0.00 H new ATOM 0 HB2 GLN A 261 -11.836 -16.903 -21.482 1.00 0.00 H new ATOM 0 HB3 GLN A 261 -11.532 -18.613 -21.720 1.00 0.00 H new ATOM 0 HG2 GLN A 261 -12.916 -18.796 -19.922 1.00 0.00 H new ATOM 0 HG3 GLN A 261 -11.417 -18.587 -19.039 1.00 0.00 H new ATOM 0 HE21 GLN A 261 -14.119 -16.713 -20.490 1.00 0.00 H new ATOM 0 HE22 GLN A 261 -14.152 -15.463 -19.242 1.00 0.00 H new ATOM 163 N VAL A 262 -9.442 -17.388 -18.485 1.00 0.00 N ATOM 164 CA VAL A 262 -9.174 -16.716 -17.220 1.00 0.00 C ATOM 165 C VAL A 262 -7.831 -15.993 -17.257 1.00 0.00 C ATOM 166 O VAL A 262 -7.760 -14.778 -17.073 1.00 0.00 O ATOM 167 CB VAL A 262 -9.198 -17.723 -16.042 1.00 0.00 C ATOM 168 CG1 VAL A 262 -8.217 -17.330 -14.944 1.00 0.00 C ATOM 169 CG2 VAL A 262 -10.607 -17.845 -15.481 1.00 0.00 C ATOM 0 H VAL A 262 -9.496 -18.404 -18.419 1.00 0.00 H new ATOM 0 HA VAL A 262 -9.962 -15.979 -17.067 1.00 0.00 H new ATOM 0 HB VAL A 262 -8.885 -18.693 -16.428 1.00 0.00 H new ATOM 0 HG11 VAL A 262 -8.263 -18.060 -14.136 1.00 0.00 H new ATOM 0 HG12 VAL A 262 -7.206 -17.303 -15.351 1.00 0.00 H new ATOM 0 HG13 VAL A 262 -8.479 -16.345 -14.558 1.00 0.00 H new ATOM 0 HG21 VAL A 262 -10.609 -18.555 -14.654 1.00 0.00 H new ATOM 0 HG22 VAL A 262 -10.942 -16.871 -15.124 1.00 0.00 H new ATOM 0 HG23 VAL A 262 -11.281 -18.196 -16.263 1.00 0.00 H new ATOM 179 N ARG A 263 -6.772 -16.755 -17.484 1.00 0.00 N ATOM 180 CA ARG A 263 -5.423 -16.201 -17.535 1.00 0.00 C ATOM 181 C ARG A 263 -5.203 -15.380 -18.803 1.00 0.00 C ATOM 182 O ARG A 263 -4.738 -14.242 -18.742 1.00 0.00 O ATOM 183 CB ARG A 263 -4.394 -17.328 -17.456 1.00 0.00 C ATOM 184 CG ARG A 263 -4.018 -17.708 -16.034 1.00 0.00 C ATOM 185 CD ARG A 263 -3.261 -16.588 -15.339 1.00 0.00 C ATOM 186 NE ARG A 263 -3.607 -16.489 -13.923 1.00 0.00 N ATOM 187 CZ ARG A 263 -3.107 -17.285 -12.980 1.00 0.00 C ATOM 188 NH1 ARG A 263 -2.242 -18.240 -13.298 1.00 0.00 N1+ ATOM 189 NH2 ARG A 263 -3.473 -17.124 -11.715 1.00 0.00 N ATOM 0 H ARG A 263 -6.819 -17.762 -17.637 1.00 0.00 H new ATOM 0 HA ARG A 263 -5.300 -15.536 -16.680 1.00 0.00 H new ATOM 0 HB2 ARG A 263 -4.790 -18.207 -17.966 1.00 0.00 H new ATOM 0 HB3 ARG A 263 -3.495 -17.026 -17.993 1.00 0.00 H new ATOM 0 HG2 ARG A 263 -4.920 -17.944 -15.469 1.00 0.00 H new ATOM 0 HG3 ARG A 263 -3.405 -18.609 -16.047 1.00 0.00 H new ATOM 0 HD2 ARG A 263 -2.189 -16.759 -15.439 1.00 0.00 H new ATOM 0 HD3 ARG A 263 -3.481 -15.641 -15.833 1.00 0.00 H new ATOM 0 HE ARG A 263 -4.271 -15.768 -13.640 1.00 0.00 H new ATOM 0 HH11 ARG A 263 -1.957 -18.367 -14.269 1.00 0.00 H new ATOM 0 HH12 ARG A 263 -1.862 -18.847 -12.571 1.00 0.00 H new ATOM 0 HH21 ARG A 263 -4.137 -16.391 -11.466 1.00 0.00 H new ATOM 0 HH22 ARG A 263 -3.091 -17.733 -10.992 1.00 0.00 H new ATOM 203 N GLU A 264 -5.533 -15.965 -19.951 1.00 0.00 N ATOM 204 CA GLU A 264 -5.365 -15.285 -21.233 1.00 0.00 C ATOM 205 C GLU A 264 -6.068 -13.929 -21.240 1.00 0.00 C ATOM 206 O GLU A 264 -5.678 -13.024 -21.977 1.00 0.00 O ATOM 207 CB GLU A 264 -5.903 -16.155 -22.370 1.00 0.00 C ATOM 208 CG GLU A 264 -5.426 -15.720 -23.747 1.00 0.00 C ATOM 209 CD GLU A 264 -6.563 -15.569 -24.739 1.00 0.00 C ATOM 210 OE1 GLU A 264 -7.494 -14.784 -24.460 1.00 0.00 O1- ATOM 211 OE2 GLU A 264 -6.525 -16.238 -25.793 1.00 0.00 O ATOM 0 H GLU A 264 -5.918 -16.907 -20.021 1.00 0.00 H new ATOM 0 HA GLU A 264 -4.298 -15.116 -21.382 1.00 0.00 H new ATOM 0 HB2 GLU A 264 -5.601 -17.188 -22.200 1.00 0.00 H new ATOM 0 HB3 GLU A 264 -6.993 -16.134 -22.348 1.00 0.00 H new ATOM 0 HG2 GLU A 264 -4.896 -14.771 -23.661 1.00 0.00 H new ATOM 0 HG3 GLU A 264 -4.712 -16.450 -24.127 1.00 0.00 H new ATOM 218 N ARG A 265 -7.104 -13.796 -20.417 1.00 0.00 N ATOM 219 CA ARG A 265 -7.856 -12.547 -20.335 1.00 0.00 C ATOM 220 C ARG A 265 -6.941 -11.380 -19.970 1.00 0.00 C ATOM 221 O ARG A 265 -6.517 -10.618 -20.839 1.00 0.00 O ATOM 222 CB ARG A 265 -8.986 -12.675 -19.309 1.00 0.00 C ATOM 223 CG ARG A 265 -10.365 -12.799 -19.936 1.00 0.00 C ATOM 224 CD ARG A 265 -10.749 -11.537 -20.693 1.00 0.00 C ATOM 225 NE ARG A 265 -10.843 -10.377 -19.810 1.00 0.00 N ATOM 226 CZ ARG A 265 -11.274 -9.180 -20.203 1.00 0.00 C ATOM 227 NH1 ARG A 265 -11.651 -8.983 -21.461 1.00 0.00 N1+ ATOM 228 NH2 ARG A 265 -11.328 -8.178 -19.336 1.00 0.00 N ATOM 0 H ARG A 265 -7.441 -14.534 -19.799 1.00 0.00 H new ATOM 0 HA ARG A 265 -8.289 -12.346 -21.315 1.00 0.00 H new ATOM 0 HB2 ARG A 265 -8.800 -13.548 -18.683 1.00 0.00 H new ATOM 0 HB3 ARG A 265 -8.971 -11.804 -18.654 1.00 0.00 H new ATOM 0 HG2 ARG A 265 -10.382 -13.651 -20.615 1.00 0.00 H new ATOM 0 HG3 ARG A 265 -11.103 -12.997 -19.158 1.00 0.00 H new ATOM 0 HD2 ARG A 265 -10.011 -11.342 -21.471 1.00 0.00 H new ATOM 0 HD3 ARG A 265 -11.705 -11.691 -21.193 1.00 0.00 H new ATOM 0 HE ARG A 265 -10.562 -10.491 -18.836 1.00 0.00 H new ATOM 0 HH11 ARG A 265 -11.611 -9.751 -22.131 1.00 0.00 H new ATOM 0 HH12 ARG A 265 -11.980 -8.064 -21.757 1.00 0.00 H new ATOM 0 HH21 ARG A 265 -11.039 -8.324 -18.369 1.00 0.00 H new ATOM 0 HH22 ARG A 265 -11.658 -7.261 -19.636 1.00 0.00 H new ATOM 242 N LYS A 266 -6.638 -11.246 -18.682 1.00 0.00 N ATOM 243 CA LYS A 266 -5.773 -10.170 -18.206 1.00 0.00 C ATOM 244 C LYS A 266 -5.643 -10.206 -16.687 1.00 0.00 C ATOM 245 O LYS A 266 -6.187 -11.093 -16.028 1.00 0.00 O ATOM 246 CB LYS A 266 -6.318 -8.811 -18.648 1.00 0.00 C ATOM 247 CG LYS A 266 -7.798 -8.634 -18.358 1.00 0.00 C ATOM 248 CD LYS A 266 -8.028 -7.763 -17.132 1.00 0.00 C ATOM 249 CE LYS A 266 -9.121 -6.733 -17.374 1.00 0.00 C ATOM 250 NZ LYS A 266 -10.147 -6.749 -16.296 1.00 0.00 N1+ ATOM 0 H LYS A 266 -6.978 -11.869 -17.949 1.00 0.00 H new ATOM 0 HA LYS A 266 -4.785 -10.317 -18.642 1.00 0.00 H new ATOM 0 HB2 LYS A 266 -5.759 -8.022 -18.144 1.00 0.00 H new ATOM 0 HB3 LYS A 266 -6.147 -8.689 -19.718 1.00 0.00 H new ATOM 0 HG2 LYS A 266 -8.287 -8.184 -19.222 1.00 0.00 H new ATOM 0 HG3 LYS A 266 -8.258 -9.610 -18.203 1.00 0.00 H new ATOM 0 HD2 LYS A 266 -8.301 -8.392 -16.284 1.00 0.00 H new ATOM 0 HD3 LYS A 266 -7.101 -7.255 -16.867 1.00 0.00 H new ATOM 0 HE2 LYS A 266 -8.676 -5.740 -17.437 1.00 0.00 H new ATOM 0 HE3 LYS A 266 -9.599 -6.930 -18.333 1.00 0.00 H new ATOM 0 HZ1 LYS A 266 -10.874 -6.033 -16.498 1.00 0.00 H new ATOM 0 HZ2 LYS A 266 -10.590 -7.689 -16.252 1.00 0.00 H new ATOM 0 HZ3 LYS A 266 -9.695 -6.536 -15.384 1.00 0.00 H new ATOM 264 N LYS A 267 -4.920 -9.236 -16.137 1.00 0.00 N ATOM 265 CA LYS A 267 -4.720 -9.154 -14.695 1.00 0.00 C ATOM 266 C LYS A 267 -4.810 -7.709 -14.214 1.00 0.00 C ATOM 267 O LYS A 267 -4.022 -6.857 -14.628 1.00 0.00 O ATOM 268 CB LYS A 267 -3.363 -9.747 -14.311 1.00 0.00 C ATOM 269 CG LYS A 267 -2.228 -9.290 -15.214 1.00 0.00 C ATOM 270 CD LYS A 267 -1.236 -8.413 -14.467 1.00 0.00 C ATOM 271 CE LYS A 267 -0.197 -7.822 -15.407 1.00 0.00 C ATOM 272 NZ LYS A 267 -0.765 -6.732 -16.246 1.00 0.00 N1+ ATOM 0 H LYS A 267 -4.463 -8.495 -16.669 1.00 0.00 H new ATOM 0 HA LYS A 267 -5.510 -9.729 -14.212 1.00 0.00 H new ATOM 0 HB2 LYS A 267 -3.132 -9.472 -13.282 1.00 0.00 H new ATOM 0 HB3 LYS A 267 -3.428 -10.835 -14.343 1.00 0.00 H new ATOM 0 HG2 LYS A 267 -1.712 -10.160 -15.619 1.00 0.00 H new ATOM 0 HG3 LYS A 267 -2.636 -8.739 -16.061 1.00 0.00 H new ATOM 0 HD2 LYS A 267 -1.769 -7.609 -13.960 1.00 0.00 H new ATOM 0 HD3 LYS A 267 -0.738 -9.001 -13.696 1.00 0.00 H new ATOM 0 HE2 LYS A 267 0.640 -7.434 -14.826 1.00 0.00 H new ATOM 0 HE3 LYS A 267 0.199 -8.607 -16.051 1.00 0.00 H new ATOM 0 HZ1 LYS A 267 -0.069 -6.448 -16.964 1.00 0.00 H new ATOM 0 HZ2 LYS A 267 -1.629 -7.070 -16.716 1.00 0.00 H new ATOM 0 HZ3 LYS A 267 -0.995 -5.915 -15.645 1.00 0.00 H new ATOM 286 N GLN A 268 -5.776 -7.438 -13.342 1.00 0.00 N ATOM 287 CA GLN A 268 -5.969 -6.095 -12.807 1.00 0.00 C ATOM 288 C GLN A 268 -5.809 -6.084 -11.291 1.00 0.00 C ATOM 289 O GLN A 268 -4.876 -5.478 -10.760 1.00 0.00 O ATOM 290 CB GLN A 268 -7.353 -5.566 -13.190 1.00 0.00 C ATOM 291 CG GLN A 268 -7.625 -4.157 -12.693 1.00 0.00 C ATOM 292 CD GLN A 268 -9.084 -3.763 -12.823 1.00 0.00 C ATOM 293 OE1 GLN A 268 -9.831 -4.355 -13.601 1.00 0.00 O ATOM 294 NE2 GLN A 268 -9.497 -2.759 -12.058 1.00 0.00 N ATOM 0 H GLN A 268 -6.437 -8.131 -12.991 1.00 0.00 H new ATOM 0 HA GLN A 268 -5.207 -5.446 -13.238 1.00 0.00 H new ATOM 0 HB2 GLN A 268 -7.452 -5.585 -14.275 1.00 0.00 H new ATOM 0 HB3 GLN A 268 -8.113 -6.237 -12.789 1.00 0.00 H new ATOM 0 HG2 GLN A 268 -7.324 -4.080 -11.648 1.00 0.00 H new ATOM 0 HG3 GLN A 268 -7.011 -3.453 -13.255 1.00 0.00 H new ATOM 0 HE21 GLN A 268 -8.843 -2.296 -11.427 1.00 0.00 H new ATOM 0 HE22 GLN A 268 -10.468 -2.451 -12.102 1.00 0.00 H new ATOM 303 N GLU A 269 -6.723 -6.754 -10.598 1.00 0.00 N ATOM 304 CA GLU A 269 -6.684 -6.819 -9.141 1.00 0.00 C ATOM 305 C GLU A 269 -5.368 -7.421 -8.659 1.00 0.00 C ATOM 306 O GLU A 269 -4.681 -6.842 -7.818 1.00 0.00 O ATOM 307 CB GLU A 269 -7.860 -7.644 -8.615 1.00 0.00 C ATOM 308 CG GLU A 269 -9.161 -6.864 -8.532 1.00 0.00 C ATOM 309 CD GLU A 269 -9.692 -6.469 -9.895 1.00 0.00 C ATOM 310 OE1 GLU A 269 -10.185 -7.358 -10.621 1.00 0.00 O1- ATOM 311 OE2 GLU A 269 -9.613 -5.271 -10.239 1.00 0.00 O ATOM 0 H GLU A 269 -7.501 -7.260 -11.022 1.00 0.00 H new ATOM 0 HA GLU A 269 -6.761 -5.803 -8.754 1.00 0.00 H new ATOM 0 HB2 GLU A 269 -8.005 -8.509 -9.263 1.00 0.00 H new ATOM 0 HB3 GLU A 269 -7.611 -8.026 -7.625 1.00 0.00 H new ATOM 0 HG2 GLU A 269 -9.909 -7.466 -8.015 1.00 0.00 H new ATOM 0 HG3 GLU A 269 -9.005 -5.967 -7.933 1.00 0.00 H new ATOM 318 N ILE A 270 -5.024 -8.586 -9.197 1.00 0.00 N ATOM 319 CA ILE A 270 -3.791 -9.265 -8.821 1.00 0.00 C ATOM 320 C ILE A 270 -2.570 -8.408 -9.140 1.00 0.00 C ATOM 321 O ILE A 270 -1.524 -8.540 -8.505 1.00 0.00 O ATOM 322 CB ILE A 270 -3.654 -10.621 -9.541 1.00 0.00 C ATOM 323 CG1 ILE A 270 -3.677 -10.424 -11.057 1.00 0.00 C ATOM 324 CG2 ILE A 270 -4.763 -11.566 -9.106 1.00 0.00 C ATOM 325 CD1 ILE A 270 -3.400 -11.693 -11.834 1.00 0.00 C ATOM 0 H ILE A 270 -5.582 -9.079 -9.894 1.00 0.00 H new ATOM 0 HA ILE A 270 -3.840 -9.435 -7.746 1.00 0.00 H new ATOM 0 HB ILE A 270 -2.697 -11.066 -9.267 1.00 0.00 H new ATOM 0 HG12 ILE A 270 -4.651 -10.033 -11.350 1.00 0.00 H new ATOM 0 HG13 ILE A 270 -2.937 -9.672 -11.329 1.00 0.00 H new ATOM 0 HG21 ILE A 270 -4.653 -12.519 -9.623 1.00 0.00 H new ATOM 0 HG22 ILE A 270 -4.702 -11.728 -8.030 1.00 0.00 H new ATOM 0 HG23 ILE A 270 -5.731 -11.129 -9.353 1.00 0.00 H new ATOM 0 HD11 ILE A 270 -3.432 -11.480 -12.902 1.00 0.00 H new ATOM 0 HD12 ILE A 270 -2.414 -12.074 -11.569 1.00 0.00 H new ATOM 0 HD13 ILE A 270 -4.155 -12.441 -11.591 1.00 0.00 H new ATOM 337 N ASN A 271 -2.709 -7.529 -10.129 1.00 0.00 N ATOM 338 CA ASN A 271 -1.616 -6.651 -10.530 1.00 0.00 C ATOM 339 C ASN A 271 -1.206 -5.733 -9.383 1.00 0.00 C ATOM 340 O ASN A 271 -0.086 -5.816 -8.877 1.00 0.00 O ATOM 341 CB ASN A 271 -2.024 -5.816 -11.746 1.00 0.00 C ATOM 342 CG ASN A 271 -0.828 -5.295 -12.517 1.00 0.00 C ATOM 343 OD1 ASN A 271 -0.553 -5.739 -13.631 1.00 0.00 O ATOM 344 ND2 ASN A 271 -0.109 -4.348 -11.926 1.00 0.00 N ATOM 0 H ASN A 271 -3.567 -7.407 -10.666 1.00 0.00 H new ATOM 0 HA ASN A 271 -0.762 -7.274 -10.796 1.00 0.00 H new ATOM 0 HB2 ASN A 271 -2.644 -6.421 -12.408 1.00 0.00 H new ATOM 0 HB3 ASN A 271 -2.635 -4.975 -11.418 1.00 0.00 H new ATOM 0 HD21 ASN A 271 0.708 -3.959 -12.397 1.00 0.00 H new ATOM 0 HD22 ASN A 271 -0.374 -4.009 -11.001 1.00 0.00 H new ATOM 351 N GLN A 272 -2.120 -4.858 -8.976 1.00 0.00 N ATOM 352 CA GLN A 272 -1.854 -3.924 -7.888 1.00 0.00 C ATOM 353 C GLN A 272 -1.521 -4.671 -6.600 1.00 0.00 C ATOM 354 O GLN A 272 -0.679 -4.232 -5.816 1.00 0.00 O ATOM 355 CB GLN A 272 -3.060 -3.008 -7.668 1.00 0.00 C ATOM 356 CG GLN A 272 -2.842 -1.589 -8.170 1.00 0.00 C ATOM 357 CD GLN A 272 -3.852 -0.610 -7.606 1.00 0.00 C ATOM 358 OE1 GLN A 272 -4.307 -0.754 -6.471 1.00 0.00 O ATOM 359 NE2 GLN A 272 -4.209 0.396 -8.398 1.00 0.00 N ATOM 0 H GLN A 272 -3.052 -4.776 -9.383 1.00 0.00 H new ATOM 0 HA GLN A 272 -0.993 -3.316 -8.165 1.00 0.00 H new ATOM 0 HB2 GLN A 272 -3.927 -3.434 -8.172 1.00 0.00 H new ATOM 0 HB3 GLN A 272 -3.294 -2.977 -6.604 1.00 0.00 H new ATOM 0 HG2 GLN A 272 -1.837 -1.263 -7.902 1.00 0.00 H new ATOM 0 HG3 GLN A 272 -2.901 -1.579 -9.258 1.00 0.00 H new ATOM 0 HE21 GLN A 272 -3.807 0.477 -9.332 1.00 0.00 H new ATOM 0 HE22 GLN A 272 -4.885 1.087 -8.072 1.00 0.00 H new ATOM 368 N LEU A 273 -2.185 -5.802 -6.388 1.00 0.00 N ATOM 369 CA LEU A 273 -1.959 -6.610 -5.197 1.00 0.00 C ATOM 370 C LEU A 273 -0.502 -7.057 -5.114 1.00 0.00 C ATOM 371 O LEU A 273 0.166 -6.847 -4.103 1.00 0.00 O ATOM 372 CB LEU A 273 -2.880 -7.831 -5.199 1.00 0.00 C ATOM 373 CG LEU A 273 -2.714 -8.772 -4.005 1.00 0.00 C ATOM 374 CD1 LEU A 273 -3.316 -8.156 -2.752 1.00 0.00 C ATOM 375 CD2 LEU A 273 -3.351 -10.121 -4.298 1.00 0.00 C ATOM 0 H LEU A 273 -2.885 -6.180 -7.027 1.00 0.00 H new ATOM 0 HA LEU A 273 -2.184 -5.997 -4.324 1.00 0.00 H new ATOM 0 HB2 LEU A 273 -3.914 -7.487 -5.229 1.00 0.00 H new ATOM 0 HB3 LEU A 273 -2.706 -8.397 -6.114 1.00 0.00 H new ATOM 0 HG LEU A 273 -1.649 -8.926 -3.833 1.00 0.00 H new ATOM 0 HD11 LEU A 273 -3.188 -8.840 -1.913 1.00 0.00 H new ATOM 0 HD12 LEU A 273 -2.813 -7.214 -2.532 1.00 0.00 H new ATOM 0 HD13 LEU A 273 -4.378 -7.972 -2.912 1.00 0.00 H new ATOM 0 HD21 LEU A 273 -3.223 -10.778 -3.438 1.00 0.00 H new ATOM 0 HD22 LEU A 273 -4.414 -9.986 -4.497 1.00 0.00 H new ATOM 0 HD23 LEU A 273 -2.873 -10.568 -5.170 1.00 0.00 H new ATOM 387 N LEU A 274 -0.018 -7.674 -6.187 1.00 0.00 N ATOM 388 CA LEU A 274 1.359 -8.150 -6.238 1.00 0.00 C ATOM 389 C LEU A 274 2.337 -6.989 -6.073 1.00 0.00 C ATOM 390 O LEU A 274 3.364 -7.121 -5.408 1.00 0.00 O ATOM 391 CB LEU A 274 1.623 -8.877 -7.560 1.00 0.00 C ATOM 392 CG LEU A 274 1.516 -10.401 -7.490 1.00 0.00 C ATOM 393 CD1 LEU A 274 0.149 -10.818 -6.971 1.00 0.00 C ATOM 394 CD2 LEU A 274 1.780 -11.016 -8.857 1.00 0.00 C ATOM 0 H LEU A 274 -0.559 -7.856 -7.032 1.00 0.00 H new ATOM 0 HA LEU A 274 1.509 -8.849 -5.415 1.00 0.00 H new ATOM 0 HB2 LEU A 274 0.917 -8.512 -8.306 1.00 0.00 H new ATOM 0 HB3 LEU A 274 2.621 -8.613 -7.910 1.00 0.00 H new ATOM 0 HG LEU A 274 2.272 -10.768 -6.795 1.00 0.00 H new ATOM 0 HD11 LEU A 274 0.092 -11.906 -6.928 1.00 0.00 H new ATOM 0 HD12 LEU A 274 -0.002 -10.407 -5.973 1.00 0.00 H new ATOM 0 HD13 LEU A 274 -0.625 -10.440 -7.639 1.00 0.00 H new ATOM 0 HD21 LEU A 274 1.700 -12.101 -8.789 1.00 0.00 H new ATOM 0 HD22 LEU A 274 1.047 -10.642 -9.572 1.00 0.00 H new ATOM 0 HD23 LEU A 274 2.782 -10.746 -9.190 1.00 0.00 H new ATOM 406 N SER A 275 2.008 -5.854 -6.681 1.00 0.00 N ATOM 407 CA SER A 275 2.856 -4.671 -6.598 1.00 0.00 C ATOM 408 C SER A 275 3.017 -4.226 -5.149 1.00 0.00 C ATOM 409 O SER A 275 4.109 -3.853 -4.719 1.00 0.00 O ATOM 410 CB SER A 275 2.266 -3.533 -7.432 1.00 0.00 C ATOM 411 OG SER A 275 1.216 -2.882 -6.737 1.00 0.00 O ATOM 0 H SER A 275 1.161 -5.729 -7.236 1.00 0.00 H new ATOM 0 HA SER A 275 3.838 -4.927 -6.995 1.00 0.00 H new ATOM 0 HB2 SER A 275 3.047 -2.813 -7.674 1.00 0.00 H new ATOM 0 HB3 SER A 275 1.892 -3.927 -8.377 1.00 0.00 H new ATOM 0 HG SER A 275 0.573 -3.549 -6.416 1.00 0.00 H new ATOM 417 N LYS A 276 1.922 -4.276 -4.402 1.00 0.00 N ATOM 418 CA LYS A 276 1.935 -3.885 -2.999 1.00 0.00 C ATOM 419 C LYS A 276 2.816 -4.828 -2.191 1.00 0.00 C ATOM 420 O LYS A 276 3.660 -4.394 -1.407 1.00 0.00 O ATOM 421 CB LYS A 276 0.514 -3.888 -2.436 1.00 0.00 C ATOM 422 CG LYS A 276 0.327 -2.960 -1.246 1.00 0.00 C ATOM 423 CD LYS A 276 0.348 -1.499 -1.670 1.00 0.00 C ATOM 424 CE LYS A 276 1.649 -0.821 -1.275 1.00 0.00 C ATOM 425 NZ LYS A 276 1.817 0.495 -1.950 1.00 0.00 N1+ ATOM 0 H LYS A 276 1.012 -4.584 -4.745 1.00 0.00 H new ATOM 0 HA LYS A 276 2.343 -2.877 -2.926 1.00 0.00 H new ATOM 0 HB2 LYS A 276 -0.181 -3.598 -3.224 1.00 0.00 H new ATOM 0 HB3 LYS A 276 0.253 -4.903 -2.138 1.00 0.00 H new ATOM 0 HG2 LYS A 276 -0.620 -3.184 -0.754 1.00 0.00 H new ATOM 0 HG3 LYS A 276 1.116 -3.139 -0.516 1.00 0.00 H new ATOM 0 HD2 LYS A 276 0.215 -1.431 -2.750 1.00 0.00 H new ATOM 0 HD3 LYS A 276 -0.490 -0.974 -1.212 1.00 0.00 H new ATOM 0 HE2 LYS A 276 1.671 -0.680 -0.194 1.00 0.00 H new ATOM 0 HE3 LYS A 276 2.488 -1.469 -1.529 1.00 0.00 H new ATOM 0 HZ1 LYS A 276 2.237 1.175 -1.285 1.00 0.00 H new ATOM 0 HZ2 LYS A 276 2.442 0.385 -2.774 1.00 0.00 H new ATOM 0 HZ3 LYS A 276 0.889 0.845 -2.263 1.00 0.00 H new ATOM 439 N PHE A 277 2.614 -6.123 -2.397 1.00 0.00 N ATOM 440 CA PHE A 277 3.391 -7.140 -1.698 1.00 0.00 C ATOM 441 C PHE A 277 4.880 -6.957 -1.968 1.00 0.00 C ATOM 442 O PHE A 277 5.708 -7.091 -1.066 1.00 0.00 O ATOM 443 CB PHE A 277 2.944 -8.539 -2.129 1.00 0.00 C ATOM 444 CG PHE A 277 2.550 -9.423 -0.981 1.00 0.00 C ATOM 445 CD1 PHE A 277 3.449 -9.702 0.036 1.00 0.00 C ATOM 446 CD2 PHE A 277 1.282 -9.977 -0.921 1.00 0.00 C ATOM 447 CE1 PHE A 277 3.088 -10.515 1.094 1.00 0.00 C ATOM 448 CE2 PHE A 277 0.915 -10.792 0.133 1.00 0.00 C ATOM 449 CZ PHE A 277 1.820 -11.061 1.142 1.00 0.00 C ATOM 0 H PHE A 277 1.918 -6.495 -3.043 1.00 0.00 H new ATOM 0 HA PHE A 277 3.218 -7.030 -0.628 1.00 0.00 H new ATOM 0 HB2 PHE A 277 2.100 -8.447 -2.813 1.00 0.00 H new ATOM 0 HB3 PHE A 277 3.753 -9.015 -2.683 1.00 0.00 H new ATOM 0 HD1 PHE A 277 4.442 -9.280 0.002 1.00 0.00 H new ATOM 0 HD2 PHE A 277 0.571 -9.770 -1.707 1.00 0.00 H new ATOM 0 HE1 PHE A 277 3.796 -10.723 1.882 1.00 0.00 H new ATOM 0 HE2 PHE A 277 -0.077 -11.218 0.168 1.00 0.00 H new ATOM 0 HZ PHE A 277 1.536 -11.697 1.967 1.00 0.00 H new ATOM 459 N LYS A 278 5.210 -6.642 -3.215 1.00 0.00 N ATOM 460 CA LYS A 278 6.598 -6.432 -3.606 1.00 0.00 C ATOM 461 C LYS A 278 7.187 -5.247 -2.854 1.00 0.00 C ATOM 462 O LYS A 278 8.306 -5.312 -2.346 1.00 0.00 O ATOM 463 CB LYS A 278 6.697 -6.199 -5.115 1.00 0.00 C ATOM 464 CG LYS A 278 7.101 -7.440 -5.894 1.00 0.00 C ATOM 465 CD LYS A 278 6.389 -7.514 -7.236 1.00 0.00 C ATOM 466 CE LYS A 278 5.944 -8.933 -7.555 1.00 0.00 C ATOM 467 NZ LYS A 278 6.202 -9.288 -8.978 1.00 0.00 N1+ ATOM 0 H LYS A 278 4.536 -6.527 -3.972 1.00 0.00 H new ATOM 0 HA LYS A 278 7.167 -7.326 -3.352 1.00 0.00 H new ATOM 0 HB2 LYS A 278 5.734 -5.845 -5.484 1.00 0.00 H new ATOM 0 HB3 LYS A 278 7.422 -5.408 -5.306 1.00 0.00 H new ATOM 0 HG2 LYS A 278 8.179 -7.436 -6.053 1.00 0.00 H new ATOM 0 HG3 LYS A 278 6.869 -8.330 -5.309 1.00 0.00 H new ATOM 0 HD2 LYS A 278 5.522 -6.854 -7.226 1.00 0.00 H new ATOM 0 HD3 LYS A 278 7.054 -7.155 -8.022 1.00 0.00 H new ATOM 0 HE2 LYS A 278 6.469 -9.633 -6.905 1.00 0.00 H new ATOM 0 HE3 LYS A 278 4.880 -9.037 -7.342 1.00 0.00 H new ATOM 0 HZ1 LYS A 278 5.885 -10.262 -9.156 1.00 0.00 H new ATOM 0 HZ2 LYS A 278 5.681 -8.636 -9.598 1.00 0.00 H new ATOM 0 HZ3 LYS A 278 7.220 -9.214 -9.175 1.00 0.00 H new ATOM 481 N GLU A 279 6.419 -4.167 -2.777 1.00 0.00 N ATOM 482 CA GLU A 279 6.857 -2.966 -2.076 1.00 0.00 C ATOM 483 C GLU A 279 7.185 -3.293 -0.625 1.00 0.00 C ATOM 484 O GLU A 279 8.190 -2.831 -0.082 1.00 0.00 O ATOM 485 CB GLU A 279 5.776 -1.886 -2.140 1.00 0.00 C ATOM 486 CG GLU A 279 5.920 -0.951 -3.330 1.00 0.00 C ATOM 487 CD GLU A 279 4.832 -1.151 -4.366 1.00 0.00 C ATOM 488 OE1 GLU A 279 3.666 -0.806 -4.078 1.00 0.00 O ATOM 489 OE2 GLU A 279 5.144 -1.654 -5.466 1.00 0.00 O1- ATOM 0 H GLU A 279 5.490 -4.098 -3.191 1.00 0.00 H new ATOM 0 HA GLU A 279 7.756 -2.589 -2.564 1.00 0.00 H new ATOM 0 HB2 GLU A 279 4.798 -2.365 -2.181 1.00 0.00 H new ATOM 0 HB3 GLU A 279 5.805 -1.299 -1.222 1.00 0.00 H new ATOM 0 HG2 GLU A 279 5.898 0.081 -2.981 1.00 0.00 H new ATOM 0 HG3 GLU A 279 6.893 -1.109 -3.796 1.00 0.00 H new ATOM 496 N ASP A 280 6.334 -4.104 -0.008 1.00 0.00 N ATOM 497 CA ASP A 280 6.534 -4.508 1.376 1.00 0.00 C ATOM 498 C ASP A 280 7.798 -5.344 1.505 1.00 0.00 C ATOM 499 O ASP A 280 8.528 -5.235 2.488 1.00 0.00 O ATOM 500 CB ASP A 280 5.330 -5.297 1.886 1.00 0.00 C ATOM 501 CG ASP A 280 4.018 -4.580 1.637 1.00 0.00 C ATOM 502 OD1 ASP A 280 3.972 -3.345 1.824 1.00 0.00 O ATOM 503 OD2 ASP A 280 3.037 -5.251 1.255 1.00 0.00 O1- ATOM 0 H ASP A 280 5.499 -4.494 -0.445 1.00 0.00 H new ATOM 0 HA ASP A 280 6.642 -3.609 1.983 1.00 0.00 H new ATOM 0 HB2 ASP A 280 5.306 -6.272 1.399 1.00 0.00 H new ATOM 0 HB3 ASP A 280 5.444 -5.478 2.955 1.00 0.00 H new ATOM 508 N GLN A 281 8.058 -6.172 0.502 1.00 0.00 N ATOM 509 CA GLN A 281 9.244 -7.011 0.503 1.00 0.00 C ATOM 510 C GLN A 281 10.498 -6.155 0.364 1.00 0.00 C ATOM 511 O GLN A 281 11.569 -6.512 0.856 1.00 0.00 O ATOM 512 CB GLN A 281 9.174 -8.033 -0.628 1.00 0.00 C ATOM 513 CG GLN A 281 8.825 -9.431 -0.150 1.00 0.00 C ATOM 514 CD GLN A 281 9.718 -9.905 0.981 1.00 0.00 C ATOM 515 OE1 GLN A 281 9.265 -9.707 2.214 1.00 0.00 O flip ATOM 516 NE2 GLN A 281 10.801 -10.443 0.749 1.00 0.00 N flip ATOM 0 H GLN A 281 7.464 -6.279 -0.320 1.00 0.00 H new ATOM 0 HA GLN A 281 9.289 -7.545 1.452 1.00 0.00 H new ATOM 0 HB2 GLN A 281 8.431 -7.709 -1.356 1.00 0.00 H new ATOM 0 HB3 GLN A 281 10.134 -8.061 -1.143 1.00 0.00 H new ATOM 0 HG2 GLN A 281 7.787 -9.448 0.181 1.00 0.00 H new ATOM 0 HG3 GLN A 281 8.905 -10.126 -0.986 1.00 0.00 H new ATOM 0 HE21 GLN A 281 11.109 -10.575 -0.214 1.00 0.00 H new ATOM 0 HE22 GLN A 281 11.390 -10.757 1.520 1.00 0.00 H new ATOM 525 N GLU A 282 10.348 -5.017 -0.309 1.00 0.00 N ATOM 526 CA GLU A 282 11.454 -4.100 -0.520 1.00 0.00 C ATOM 527 C GLU A 282 11.844 -3.415 0.783 1.00 0.00 C ATOM 528 O GLU A 282 13.010 -3.433 1.182 1.00 0.00 O ATOM 529 CB GLU A 282 11.080 -3.052 -1.571 1.00 0.00 C ATOM 530 CG GLU A 282 11.458 -3.449 -2.988 1.00 0.00 C ATOM 531 CD GLU A 282 10.455 -2.960 -4.016 1.00 0.00 C ATOM 532 OE1 GLU A 282 9.408 -3.620 -4.184 1.00 0.00 O ATOM 533 OE2 GLU A 282 10.719 -1.918 -4.652 1.00 0.00 O1- ATOM 0 H GLU A 282 9.465 -4.711 -0.718 1.00 0.00 H new ATOM 0 HA GLU A 282 12.309 -4.673 -0.878 1.00 0.00 H new ATOM 0 HB2 GLU A 282 10.006 -2.873 -1.527 1.00 0.00 H new ATOM 0 HB3 GLU A 282 11.570 -2.110 -1.323 1.00 0.00 H new ATOM 0 HG2 GLU A 282 12.442 -3.045 -3.225 1.00 0.00 H new ATOM 0 HG3 GLU A 282 11.536 -4.534 -3.049 1.00 0.00 H new ATOM 540 N ARG A 283 10.862 -2.817 1.450 1.00 0.00 N ATOM 541 CA ARG A 283 11.116 -2.137 2.710 1.00 0.00 C ATOM 542 C ARG A 283 11.583 -3.135 3.754 1.00 0.00 C ATOM 543 O ARG A 283 12.570 -2.907 4.446 1.00 0.00 O ATOM 544 CB ARG A 283 9.861 -1.411 3.197 1.00 0.00 C ATOM 545 CG ARG A 283 8.684 -2.337 3.431 1.00 0.00 C ATOM 546 CD ARG A 283 7.359 -1.609 3.280 1.00 0.00 C ATOM 547 NE ARG A 283 6.295 -2.243 4.055 1.00 0.00 N ATOM 548 CZ ARG A 283 6.129 -2.072 5.365 1.00 0.00 C ATOM 549 NH1 ARG A 283 6.952 -1.287 6.048 1.00 0.00 N1+ ATOM 550 NH2 ARG A 283 5.137 -2.688 5.993 1.00 0.00 N ATOM 0 H ARG A 283 9.891 -2.791 1.140 1.00 0.00 H new ATOM 0 HA ARG A 283 11.899 -1.396 2.551 1.00 0.00 H new ATOM 0 HB2 ARG A 283 10.091 -0.886 4.124 1.00 0.00 H new ATOM 0 HB3 ARG A 283 9.579 -0.655 2.464 1.00 0.00 H new ATOM 0 HG2 ARG A 283 8.727 -3.166 2.724 1.00 0.00 H new ATOM 0 HG3 ARG A 283 8.752 -2.766 4.431 1.00 0.00 H new ATOM 0 HD2 ARG A 283 7.475 -0.574 3.602 1.00 0.00 H new ATOM 0 HD3 ARG A 283 7.076 -1.585 2.228 1.00 0.00 H new ATOM 0 HE ARG A 283 5.641 -2.852 3.564 1.00 0.00 H new ATOM 0 HH11 ARG A 283 7.717 -0.811 5.570 1.00 0.00 H new ATOM 0 HH12 ARG A 283 6.820 -1.160 7.051 1.00 0.00 H new ATOM 0 HH21 ARG A 283 4.501 -3.293 5.473 1.00 0.00 H new ATOM 0 HH22 ARG A 283 5.009 -2.557 6.997 1.00 0.00 H new ATOM 564 N ILE A 284 10.873 -4.250 3.847 1.00 0.00 N ATOM 565 CA ILE A 284 11.212 -5.305 4.794 1.00 0.00 C ATOM 566 C ILE A 284 12.667 -5.724 4.633 1.00 0.00 C ATOM 567 O ILE A 284 13.399 -5.860 5.615 1.00 0.00 O ATOM 568 CB ILE A 284 10.296 -6.533 4.605 1.00 0.00 C ATOM 569 CG1 ILE A 284 8.856 -6.184 5.003 1.00 0.00 C ATOM 570 CG2 ILE A 284 10.810 -7.728 5.404 1.00 0.00 C ATOM 571 CD1 ILE A 284 8.573 -6.319 6.485 1.00 0.00 C ATOM 0 H ILE A 284 10.053 -4.449 3.274 1.00 0.00 H new ATOM 0 HA ILE A 284 11.064 -4.908 5.798 1.00 0.00 H new ATOM 0 HB ILE A 284 10.306 -6.813 3.552 1.00 0.00 H new ATOM 0 HG12 ILE A 284 8.644 -5.160 4.695 1.00 0.00 H new ATOM 0 HG13 ILE A 284 8.172 -6.830 4.453 1.00 0.00 H new ATOM 0 HG21 ILE A 284 10.146 -8.579 5.253 1.00 0.00 H new ATOM 0 HG22 ILE A 284 11.814 -7.986 5.067 1.00 0.00 H new ATOM 0 HG23 ILE A 284 10.837 -7.473 6.463 1.00 0.00 H new ATOM 0 HD11 ILE A 284 7.534 -6.054 6.683 1.00 0.00 H new ATOM 0 HD12 ILE A 284 8.751 -7.348 6.797 1.00 0.00 H new ATOM 0 HD13 ILE A 284 9.230 -5.652 7.043 1.00 0.00 H new ATOM 583 N LYS A 285 13.081 -5.921 3.389 1.00 0.00 N ATOM 584 CA LYS A 285 14.449 -6.317 3.098 1.00 0.00 C ATOM 585 C LYS A 285 15.427 -5.263 3.602 1.00 0.00 C ATOM 586 O LYS A 285 16.436 -5.588 4.227 1.00 0.00 O ATOM 587 CB LYS A 285 14.625 -6.536 1.597 1.00 0.00 C ATOM 588 CG LYS A 285 14.176 -7.914 1.139 1.00 0.00 C ATOM 589 CD LYS A 285 15.302 -8.676 0.455 1.00 0.00 C ATOM 590 CE LYS A 285 14.836 -9.313 -0.845 1.00 0.00 C ATOM 591 NZ LYS A 285 14.396 -10.722 -0.648 1.00 0.00 N1+ ATOM 0 H LYS A 285 12.488 -5.813 2.566 1.00 0.00 H new ATOM 0 HA LYS A 285 14.659 -7.254 3.614 1.00 0.00 H new ATOM 0 HB2 LYS A 285 14.059 -5.778 1.056 1.00 0.00 H new ATOM 0 HB3 LYS A 285 15.674 -6.397 1.336 1.00 0.00 H new ATOM 0 HG2 LYS A 285 13.820 -8.484 1.997 1.00 0.00 H new ATOM 0 HG3 LYS A 285 13.336 -7.813 0.452 1.00 0.00 H new ATOM 0 HD2 LYS A 285 16.131 -7.998 0.252 1.00 0.00 H new ATOM 0 HD3 LYS A 285 15.679 -9.449 1.125 1.00 0.00 H new ATOM 0 HE2 LYS A 285 14.013 -8.731 -1.260 1.00 0.00 H new ATOM 0 HE3 LYS A 285 15.646 -9.284 -1.574 1.00 0.00 H new ATOM 0 HZ1 LYS A 285 14.086 -11.119 -1.558 1.00 0.00 H new ATOM 0 HZ2 LYS A 285 15.188 -11.284 -0.276 1.00 0.00 H new ATOM 0 HZ3 LYS A 285 13.606 -10.748 0.028 1.00 0.00 H new ATOM 605 N VAL A 286 15.115 -3.997 3.339 1.00 0.00 N ATOM 606 CA VAL A 286 15.962 -2.899 3.787 1.00 0.00 C ATOM 607 C VAL A 286 16.097 -2.916 5.305 1.00 0.00 C ATOM 608 O VAL A 286 17.190 -2.750 5.847 1.00 0.00 O ATOM 609 CB VAL A 286 15.399 -1.534 3.345 1.00 0.00 C ATOM 610 CG1 VAL A 286 16.341 -0.409 3.747 1.00 0.00 C ATOM 611 CG2 VAL A 286 15.146 -1.518 1.844 1.00 0.00 C ATOM 0 H VAL A 286 14.286 -3.708 2.820 1.00 0.00 H new ATOM 0 HA VAL A 286 16.941 -3.037 3.328 1.00 0.00 H new ATOM 0 HB VAL A 286 14.447 -1.376 3.851 1.00 0.00 H new ATOM 0 HG11 VAL A 286 15.925 0.546 3.426 1.00 0.00 H new ATOM 0 HG12 VAL A 286 16.463 -0.406 4.830 1.00 0.00 H new ATOM 0 HG13 VAL A 286 17.311 -0.560 3.273 1.00 0.00 H new ATOM 0 HG21 VAL A 286 14.749 -0.546 1.552 1.00 0.00 H new ATOM 0 HG22 VAL A 286 16.081 -1.701 1.315 1.00 0.00 H new ATOM 0 HG23 VAL A 286 14.426 -2.296 1.588 1.00 0.00 H new ATOM 621 N MET A 287 14.974 -3.128 5.983 1.00 0.00 N ATOM 622 CA MET A 287 14.948 -3.180 7.438 1.00 0.00 C ATOM 623 C MET A 287 15.818 -4.323 7.949 1.00 0.00 C ATOM 624 O MET A 287 16.497 -4.195 8.967 1.00 0.00 O ATOM 625 CB MET A 287 13.510 -3.353 7.939 1.00 0.00 C ATOM 626 CG MET A 287 12.539 -2.321 7.384 1.00 0.00 C ATOM 627 SD MET A 287 12.621 -0.749 8.261 1.00 0.00 S ATOM 628 CE MET A 287 13.956 0.053 7.376 1.00 0.00 C ATOM 0 H MET A 287 14.064 -3.267 5.543 1.00 0.00 H new ATOM 0 HA MET A 287 15.346 -2.240 7.821 1.00 0.00 H new ATOM 0 HB2 MET A 287 13.159 -4.350 7.671 1.00 0.00 H new ATOM 0 HB3 MET A 287 13.505 -3.295 9.027 1.00 0.00 H new ATOM 0 HG2 MET A 287 12.755 -2.155 6.328 1.00 0.00 H new ATOM 0 HG3 MET A 287 11.524 -2.714 7.444 1.00 0.00 H new ATOM 0 HE1 MET A 287 14.808 0.184 8.043 1.00 0.00 H new ATOM 0 HE2 MET A 287 14.251 -0.563 6.527 1.00 0.00 H new ATOM 0 HE3 MET A 287 13.622 1.027 7.019 1.00 0.00 H new ATOM 638 N LYS A 288 15.790 -5.443 7.232 1.00 0.00 N ATOM 639 CA LYS A 288 16.574 -6.609 7.606 1.00 0.00 C ATOM 640 C LYS A 288 18.056 -6.381 7.322 1.00 0.00 C ATOM 641 O LYS A 288 18.921 -6.900 8.029 1.00 0.00 O ATOM 642 CB LYS A 288 16.078 -7.847 6.854 1.00 0.00 C ATOM 643 CG LYS A 288 15.357 -8.848 7.741 1.00 0.00 C ATOM 644 CD LYS A 288 13.849 -8.667 7.674 1.00 0.00 C ATOM 645 CE LYS A 288 13.123 -9.762 8.438 1.00 0.00 C ATOM 646 NZ LYS A 288 11.759 -9.338 8.856 1.00 0.00 N1+ ATOM 0 H LYS A 288 15.231 -5.565 6.388 1.00 0.00 H new ATOM 0 HA LYS A 288 16.450 -6.773 8.677 1.00 0.00 H new ATOM 0 HB2 LYS A 288 15.407 -7.532 6.055 1.00 0.00 H new ATOM 0 HB3 LYS A 288 16.928 -8.339 6.381 1.00 0.00 H new ATOM 0 HG2 LYS A 288 15.617 -9.861 7.434 1.00 0.00 H new ATOM 0 HG3 LYS A 288 15.693 -8.731 8.771 1.00 0.00 H new ATOM 0 HD2 LYS A 288 13.579 -7.694 8.086 1.00 0.00 H new ATOM 0 HD3 LYS A 288 13.527 -8.673 6.633 1.00 0.00 H new ATOM 0 HE2 LYS A 288 13.051 -10.653 7.814 1.00 0.00 H new ATOM 0 HE3 LYS A 288 13.704 -10.036 9.319 1.00 0.00 H new ATOM 0 HZ1 LYS A 288 11.298 -10.113 9.374 1.00 0.00 H new ATOM 0 HZ2 LYS A 288 11.829 -8.503 9.472 1.00 0.00 H new ATOM 0 HZ3 LYS A 288 11.196 -9.101 8.014 1.00 0.00 H new ATOM 660 N ALA A 289 18.339 -5.599 6.284 1.00 0.00 N ATOM 661 CA ALA A 289 19.711 -5.294 5.901 1.00 0.00 C ATOM 662 C ALA A 289 20.479 -6.558 5.526 1.00 0.00 C ATOM 663 O ALA A 289 20.654 -6.861 4.346 1.00 0.00 O ATOM 664 CB ALA A 289 20.411 -4.550 7.028 1.00 0.00 C ATOM 0 H ALA A 289 17.632 -5.164 5.692 1.00 0.00 H new ATOM 0 HA ALA A 289 19.686 -4.655 5.018 1.00 0.00 H new ATOM 0 HB1 ALA A 289 21.436 -4.326 6.734 1.00 0.00 H new ATOM 0 HB2 ALA A 289 19.881 -3.620 7.235 1.00 0.00 H new ATOM 0 HB3 ALA A 289 20.418 -5.170 7.924 1.00 0.00 H new ATOM 670 N LYS A 290 20.936 -7.293 6.535 1.00 0.00 N ATOM 671 CA LYS A 290 21.683 -8.524 6.308 1.00 0.00 C ATOM 672 C LYS A 290 20.740 -9.686 6.011 1.00 0.00 C ATOM 673 O LYS A 290 19.530 -9.500 5.886 1.00 0.00 O ATOM 674 CB LYS A 290 22.550 -8.848 7.526 1.00 0.00 C ATOM 675 CG LYS A 290 23.967 -8.307 7.424 1.00 0.00 C ATOM 676 CD LYS A 290 24.894 -8.981 8.422 1.00 0.00 C ATOM 677 CE LYS A 290 26.286 -9.180 7.844 1.00 0.00 C ATOM 678 NZ LYS A 290 26.410 -10.478 7.126 1.00 0.00 N1+ ATOM 0 H LYS A 290 20.802 -7.057 7.518 1.00 0.00 H new ATOM 0 HA LYS A 290 22.328 -8.376 5.442 1.00 0.00 H new ATOM 0 HB2 LYS A 290 22.077 -8.438 8.418 1.00 0.00 H new ATOM 0 HB3 LYS A 290 22.591 -9.930 7.655 1.00 0.00 H new ATOM 0 HG2 LYS A 290 24.345 -8.462 6.413 1.00 0.00 H new ATOM 0 HG3 LYS A 290 23.961 -7.231 7.601 1.00 0.00 H new ATOM 0 HD2 LYS A 290 24.958 -8.376 9.327 1.00 0.00 H new ATOM 0 HD3 LYS A 290 24.478 -9.946 8.712 1.00 0.00 H new ATOM 0 HE2 LYS A 290 26.515 -8.363 7.159 1.00 0.00 H new ATOM 0 HE3 LYS A 290 27.022 -9.138 8.647 1.00 0.00 H new ATOM 0 HZ1 LYS A 290 27.374 -10.575 6.747 1.00 0.00 H new ATOM 0 HZ2 LYS A 290 26.217 -11.259 7.785 1.00 0.00 H new ATOM 0 HZ3 LYS A 290 25.726 -10.509 6.343 1.00 0.00 H new ATOM 692 N ARG A 291 21.303 -10.886 5.900 1.00 0.00 N ATOM 693 CA ARG A 291 20.514 -12.081 5.617 1.00 0.00 C ATOM 694 C ARG A 291 19.378 -12.238 6.625 1.00 0.00 C ATOM 695 O ARG A 291 19.356 -11.571 7.659 1.00 0.00 O ATOM 696 CB ARG A 291 21.406 -13.324 5.639 1.00 0.00 C ATOM 697 CG ARG A 291 21.088 -14.321 4.537 1.00 0.00 C ATOM 698 CD ARG A 291 20.472 -15.594 5.094 1.00 0.00 C ATOM 699 NE ARG A 291 20.300 -16.615 4.063 1.00 0.00 N ATOM 700 CZ ARG A 291 19.521 -17.685 4.202 1.00 0.00 C ATOM 701 NH1 ARG A 291 18.841 -17.878 5.324 1.00 0.00 N1+ ATOM 702 NH2 ARG A 291 19.421 -18.565 3.214 1.00 0.00 N ATOM 0 H ARG A 291 22.303 -11.057 6.002 1.00 0.00 H new ATOM 0 HA ARG A 291 20.080 -11.971 4.623 1.00 0.00 H new ATOM 0 HB2 ARG A 291 22.447 -13.015 5.549 1.00 0.00 H new ATOM 0 HB3 ARG A 291 21.303 -13.818 6.605 1.00 0.00 H new ATOM 0 HG2 ARG A 291 20.402 -13.867 3.822 1.00 0.00 H new ATOM 0 HG3 ARG A 291 22.000 -14.566 3.993 1.00 0.00 H new ATOM 0 HD2 ARG A 291 21.106 -15.985 5.890 1.00 0.00 H new ATOM 0 HD3 ARG A 291 19.505 -15.363 5.541 1.00 0.00 H new ATOM 0 HE ARG A 291 20.807 -16.501 3.185 1.00 0.00 H new ATOM 0 HH11 ARG A 291 18.913 -17.204 6.086 1.00 0.00 H new ATOM 0 HH12 ARG A 291 18.246 -18.700 5.424 1.00 0.00 H new ATOM 0 HH21 ARG A 291 19.941 -18.421 2.348 1.00 0.00 H new ATOM 0 HH22 ARG A 291 18.824 -19.385 3.320 1.00 0.00 H new ATOM 716 N LYS A 292 18.437 -13.124 6.315 1.00 0.00 N ATOM 717 CA LYS A 292 17.299 -13.368 7.192 1.00 0.00 C ATOM 718 C LYS A 292 17.595 -14.511 8.159 1.00 0.00 C ATOM 719 O LYS A 292 16.813 -15.455 8.280 1.00 0.00 O ATOM 720 CB LYS A 292 16.051 -13.688 6.366 1.00 0.00 C ATOM 721 CG LYS A 292 15.582 -12.531 5.500 1.00 0.00 C ATOM 722 CD LYS A 292 16.079 -12.667 4.070 1.00 0.00 C ATOM 723 CE LYS A 292 15.119 -13.485 3.221 1.00 0.00 C ATOM 724 NZ LYS A 292 14.214 -12.621 2.414 1.00 0.00 N1+ ATOM 0 H LYS A 292 18.441 -13.685 5.463 1.00 0.00 H new ATOM 0 HA LYS A 292 17.117 -12.464 7.773 1.00 0.00 H new ATOM 0 HB2 LYS A 292 16.258 -14.548 5.728 1.00 0.00 H new ATOM 0 HB3 LYS A 292 15.244 -13.977 7.039 1.00 0.00 H new ATOM 0 HG2 LYS A 292 14.493 -12.490 5.505 1.00 0.00 H new ATOM 0 HG3 LYS A 292 15.939 -11.591 5.922 1.00 0.00 H new ATOM 0 HD2 LYS A 292 16.201 -11.677 3.631 1.00 0.00 H new ATOM 0 HD3 LYS A 292 17.061 -13.140 4.069 1.00 0.00 H new ATOM 0 HE2 LYS A 292 15.687 -14.136 2.556 1.00 0.00 H new ATOM 0 HE3 LYS A 292 14.524 -14.130 3.867 1.00 0.00 H new ATOM 0 HZ1 LYS A 292 13.576 -13.218 1.850 1.00 0.00 H new ATOM 0 HZ2 LYS A 292 13.653 -12.018 3.049 1.00 0.00 H new ATOM 0 HZ3 LYS A 292 14.780 -12.023 1.779 1.00 0.00 H new ATOM 738 N PHE A 293 18.729 -14.419 8.846 1.00 0.00 N ATOM 739 CA PHE A 293 19.129 -15.444 9.803 1.00 0.00 C ATOM 740 C PHE A 293 19.589 -14.815 11.114 1.00 0.00 C ATOM 741 O PHE A 293 19.860 -13.615 11.177 1.00 0.00 O ATOM 742 CB PHE A 293 20.247 -16.308 9.217 1.00 0.00 C ATOM 743 CG PHE A 293 20.404 -17.634 9.904 1.00 0.00 C ATOM 744 CD1 PHE A 293 19.297 -18.419 10.186 1.00 0.00 C ATOM 745 CD2 PHE A 293 21.659 -18.097 10.268 1.00 0.00 C ATOM 746 CE1 PHE A 293 19.439 -19.641 10.817 1.00 0.00 C ATOM 747 CE2 PHE A 293 21.807 -19.317 10.899 1.00 0.00 C ATOM 748 CZ PHE A 293 20.695 -20.090 11.175 1.00 0.00 C ATOM 0 H PHE A 293 19.387 -13.645 8.758 1.00 0.00 H new ATOM 0 HA PHE A 293 18.263 -16.073 10.008 1.00 0.00 H new ATOM 0 HB2 PHE A 293 20.047 -16.478 8.159 1.00 0.00 H new ATOM 0 HB3 PHE A 293 21.188 -15.762 9.280 1.00 0.00 H new ATOM 0 HD1 PHE A 293 18.312 -18.072 9.910 1.00 0.00 H new ATOM 0 HD2 PHE A 293 22.531 -17.497 10.056 1.00 0.00 H new ATOM 0 HE1 PHE A 293 18.569 -20.244 11.030 1.00 0.00 H new ATOM 0 HE2 PHE A 293 22.791 -19.666 11.176 1.00 0.00 H new ATOM 0 HZ PHE A 293 20.808 -21.043 11.670 1.00 0.00 H new ATOM 758 N ASN A 294 19.674 -15.632 12.158 1.00 0.00 N ATOM 759 CA ASN A 294 20.102 -15.156 13.469 1.00 0.00 C ATOM 760 C ASN A 294 21.525 -15.618 13.779 1.00 0.00 C ATOM 761 O ASN A 294 21.747 -16.780 14.116 1.00 0.00 O ATOM 762 CB ASN A 294 19.143 -15.657 14.552 1.00 0.00 C ATOM 763 CG ASN A 294 18.158 -14.590 14.988 1.00 0.00 C ATOM 764 OD1 ASN A 294 17.478 -13.980 14.163 1.00 0.00 O ATOM 765 ND2 ASN A 294 18.076 -14.359 16.294 1.00 0.00 N ATOM 0 H ASN A 294 19.452 -16.627 12.122 1.00 0.00 H new ATOM 0 HA ASN A 294 20.089 -14.066 13.456 1.00 0.00 H new ATOM 0 HB2 ASN A 294 18.596 -16.522 14.177 1.00 0.00 H new ATOM 0 HB3 ASN A 294 19.717 -15.993 15.416 1.00 0.00 H new ATOM 0 HD21 ASN A 294 17.431 -13.653 16.647 1.00 0.00 H new ATOM 0 HD22 ASN A 294 18.658 -14.888 16.943 1.00 0.00 H new ATOM 772 N PRO A 295 22.514 -14.712 13.671 1.00 0.00 N ATOM 773 CA PRO A 295 23.918 -15.041 13.945 1.00 0.00 C ATOM 774 C PRO A 295 24.121 -15.545 15.368 1.00 0.00 C ATOM 775 O PRO A 295 25.032 -16.329 15.637 1.00 0.00 O ATOM 776 CB PRO A 295 24.653 -13.710 13.741 1.00 0.00 C ATOM 777 CG PRO A 295 23.740 -12.890 12.896 1.00 0.00 C ATOM 778 CD PRO A 295 22.348 -13.302 13.278 1.00 0.00 C ATOM 0 HA PRO A 295 24.280 -15.841 13.299 1.00 0.00 H new ATOM 0 HB2 PRO A 295 24.855 -13.221 14.694 1.00 0.00 H new ATOM 0 HB3 PRO A 295 25.615 -13.861 13.251 1.00 0.00 H new ATOM 0 HG2 PRO A 295 23.895 -11.826 13.072 1.00 0.00 H new ATOM 0 HG3 PRO A 295 23.923 -13.068 11.836 1.00 0.00 H new ATOM 0 HD2 PRO A 295 21.959 -12.698 14.098 1.00 0.00 H new ATOM 0 HD3 PRO A 295 21.653 -13.195 12.445 1.00 0.00 H new ATOM 786 N TYR A 296 23.266 -15.091 16.277 1.00 0.00 N ATOM 787 CA TYR A 296 23.348 -15.496 17.676 1.00 0.00 C ATOM 788 C TYR A 296 21.979 -15.420 18.344 1.00 0.00 C ATOM 789 O TYR A 296 21.256 -14.436 18.191 1.00 0.00 O ATOM 790 CB TYR A 296 24.345 -14.612 18.427 1.00 0.00 C ATOM 791 CG TYR A 296 24.905 -15.257 19.674 1.00 0.00 C ATOM 792 CD1 TYR A 296 24.271 -15.107 20.902 1.00 0.00 C ATOM 793 CD2 TYR A 296 26.067 -16.017 19.625 1.00 0.00 C ATOM 794 CE1 TYR A 296 24.780 -15.695 22.043 1.00 0.00 C ATOM 795 CE2 TYR A 296 26.582 -16.609 20.763 1.00 0.00 C ATOM 796 CZ TYR A 296 25.935 -16.445 21.969 1.00 0.00 C ATOM 797 OH TYR A 296 26.445 -17.032 23.104 1.00 0.00 O ATOM 0 H TYR A 296 22.507 -14.442 16.070 1.00 0.00 H new ATOM 0 HA TYR A 296 23.693 -16.529 17.710 1.00 0.00 H new ATOM 0 HB2 TYR A 296 25.168 -14.358 17.759 1.00 0.00 H new ATOM 0 HB3 TYR A 296 23.855 -13.677 18.700 1.00 0.00 H new ATOM 0 HD1 TYR A 296 23.366 -14.521 20.965 1.00 0.00 H new ATOM 0 HD2 TYR A 296 26.577 -16.147 18.682 1.00 0.00 H new ATOM 0 HE1 TYR A 296 24.276 -15.568 22.990 1.00 0.00 H new ATOM 0 HE2 TYR A 296 27.486 -17.197 20.708 1.00 0.00 H new ATOM 0 HH TYR A 296 27.261 -17.525 22.879 1.00 0.00 H new ATOM 807 N THR A 297 21.630 -16.466 19.086 1.00 0.00 N ATOM 808 CA THR A 297 20.347 -16.517 19.777 1.00 0.00 C ATOM 809 C THR A 297 20.503 -17.120 21.170 1.00 0.00 C ATOM 810 O THR A 297 20.661 -18.356 21.264 1.00 0.00 O ATOM 811 CB THR A 297 19.338 -17.331 18.967 1.00 0.00 C ATOM 812 OG1 THR A 297 19.528 -17.125 17.578 1.00 0.00 O ATOM 813 CG2 THR A 297 17.899 -16.992 19.288 1.00 0.00 C ATOM 814 OXT THR A 297 20.467 -16.352 22.155 1.00 0.00 O ATOM 0 H THR A 297 22.217 -17.289 19.224 1.00 0.00 H new ATOM 0 HA THR A 297 19.979 -15.496 19.881 1.00 0.00 H new ATOM 0 HB THR A 297 19.519 -18.370 19.241 1.00 0.00 H new ATOM 0 HG1 THR A 297 18.874 -17.655 17.076 1.00 0.00 H new ATOM 0 HG21 THR A 297 17.236 -17.606 18.678 1.00 0.00 H new ATOM 0 HG22 THR A 297 17.706 -17.187 20.343 1.00 0.00 H new ATOM 0 HG23 THR A 297 17.717 -15.939 19.075 1.00 0.00 H new TER 822 THR A 297 END