USER MOD reduce.3.24.130724 H: found=0, std=0, add=569, rem=0, adj=7 USER MOD reduce.3.24.130724 removed 571 hydrogens (0 hets) HEADER TRANSFERASE 21-DEC-99 1DOQ TITLE THE C-TERMINAL DOMAIN OF THE RNA POLYMERASE ALPHA SUBUNIT TITLE 2 FROM THERMUS THERMOPHILUS COMPND MOL_ID: 1; COMPND 2 MOLECULE: RNA POLYMERASE ALPHA SUBUNIT; COMPND 3 CHAIN: A; COMPND 4 FRAGMENT: C-TERMINAL DOMAIN; COMPND 5 EC: 2.7.7.-; COMPND 6 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: THERMUS THERMOPHILUS; SOURCE 3 ORGANISM_TAXID: 274; SOURCE 4 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 5 EXPRESSION_SYSTEM_TAXID: 562; SOURCE 6 EXPRESSION_SYSTEM_PLASMID: PET15 KEYWDS TRANSCRIPTION, RNA POLYMERASE, THERMUS THERMOPHILUS, KEYWDS 2 TRANSFERASE EXPDTA SOLUTION NMR MDLTYP MINIMIZED AVERAGE AUTHOR T.WADA,T.YAMAZAKI,Y.KYOGOKU REVDAT 3 24-FEB-09 1DOQ 1 VERSN REVDAT 2 14-JUN-00 1DOQ 1 JRNL REVDAT 1 05-JAN-00 1DOQ 0 JRNL AUTH T.WADA,T.YAMAZAKI,Y.KYOGOKU JRNL TITL THE STRUCTURE AND THE CHARACTERISTIC DNA BINDING JRNL TITL 2 PROPERTY OF THE C-TERMINAL DOMAIN OF THE RNA JRNL TITL 3 POLYMERASE ALPHA SUBUNIT FROM THERMUS THERMOPHILUS. JRNL REF J.BIOL.CHEM. V. 275 16057 2000 JRNL REFN ISSN 0021-9258 JRNL PMID 10821859 JRNL DOI 10.1074/JBC.275.21.16057 REMARK 1 REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : NULL REMARK 3 AUTHORS : NULL REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: THE STRUCTURES ARE BASED ON 734 NOE- REMARK 3 DERIVED DISTANCE CONSTRAINTS, 43 DIHEDRAL ANGLE RESTRAINTS AND REMARK 3 38 DISTANCE RESTRAINTS FROM HYDROGEN BONDS. REMARK 4 REMARK 4 1DOQ COMPLIES WITH FORMAT V. 3.15, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 22-DEC-99. REMARK 100 THE RCSB ID CODE IS RCSB010251. REMARK 210 REMARK 210 EXPERIMENTAL DETAILS REMARK 210 EXPERIMENT TYPE : NMR REMARK 210 TEMPERATURE (KELVIN) : 310 REMARK 210 PH : 6.0 REMARK 210 IONIC STRENGTH : 30MM KCL REMARK 210 PRESSURE : 1ATM REMARK 210 SAMPLE CONTENTS : 2MM C-TERMINAL DOMAIN OF RNA REMARK 210 POLYMERASE ALPHA SUBUNIT-15N, REMARK 210 13C; 20MM PHOSPHATE BUFFER, REMARK 210 30MM KCL; 90% H2O, 10% D2O REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : NULL REMARK 210 SPECTROMETER FIELD STRENGTH : 500 MHZ, 600 MHZ REMARK 210 SPECTROMETER MODEL : DMX REMARK 210 SPECTROMETER MANUFACTURER : BRUKER REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : NMRPIPE, X-PLOR 3.1 REMARK 210 METHOD USED : DISTANCE GEOMETRY, SIMULATED REMARK 210 ANNEALING, MOLECULAR DYNAMICS REMARK 210 REMARK 210 CONFORMERS, NUMBER CALCULATED : NULL REMARK 210 CONFORMERS, NUMBER SUBMITTED : 1 REMARK 210 CONFORMERS, SELECTION CRITERIA : NULL REMARK 210 REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : NULL REMARK 210 REMARK 210 REMARK: THE STRUCTURE WAS DETERMINED USING TRIPLE-RESONANCE NMR REMARK 210 SPECTROSCOPY. 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 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: TORSION ANGLES REMARK 500 REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS: REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2) REMARK 500 REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI- REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400 REMARK 500 REMARK 500 M RES CSSEQI PSI PHI REMARK 500 GLU A 249 31.29 -177.55 REMARK 500 LEU A 252 111.98 59.57 REMARK 500 ASP A 253 62.21 -160.11 REMARK 500 SER A 268 -70.61 -52.07 REMARK 500 LYS A 270 -77.38 -48.21 REMARK 500 LEU A 283 89.86 -59.05 REMARK 500 ASN A 284 -172.00 -63.87 REMARK 500 ASP A 287 -57.60 -132.75 REMARK 500 THR A 312 -142.38 -106.23 REMARK 500 LEU A 313 -3.53 78.58 REMARK 500 LYS A 314 43.94 -150.48 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 264 0.26 SIDE_CHAIN REMARK 500 ARG A 278 0.17 SIDE_CHAIN REMARK 500 ARG A 297 0.28 SIDE_CHAIN REMARK 500 REMARK 500 REMARK: NULL DBREF 1DOQ A 247 315 UNP Q9Z9H6 RPOA_THETH 247 315 SEQRES 1 A 69 GLU GLN GLU GLU GLU LEU ASP LEU PRO LEU GLU GLU LEU SEQRES 2 A 69 GLY LEU SER THR ARG VAL LEU HIS SER LEU LYS GLU GLU SEQRES 3 A 69 GLY ILE GLU SER VAL ARG ALA LEU LEU ALA LEU ASN LEU SEQRES 4 A 69 LYS ASP LEU LYS ASN ILE PRO GLY ILE GLY GLU ARG SER SEQRES 5 A 69 LEU GLU GLU ILE LYS GLU ALA LEU GLU LYS LYS GLY PHE SEQRES 6 A 69 THR LEU LYS GLU HELIX 1 1 PRO A 255 GLY A 260 1 6 HELIX 2 2 SER A 262 GLU A 272 1 11 HELIX 3 3 SER A 276 LEU A 283 1 8 HELIX 4 4 ASN A 284 LYS A 289 1 6 HELIX 5 5 GLY A 295 GLY A 310 1 16 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 Single : A 248 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 262 SER OG : rot 75:sc= -0.952! USER MOD Single : A 263 THR OG1 : rot 180:sc= 0.117 USER MOD Single : A 267 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 268 SER OG : rot 106:sc= 0.866 USER MOD Single : A 270 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 276 SER OG : rot 15:sc= 0.425 USER MOD Single : A 284 ASN : amide:sc= -3.72! C(o=-3.7!,f=-7.3!) USER MOD Single : A 286 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 289 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 290 ASN : amide:sc=-0.00513 K(o=-0.0051,f=-1.6!) USER MOD Single : A 298 SER OG : rot 160:sc= -0.182 USER MOD Single : A 303 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 308 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 309 LYS NZ :NH3+ 147:sc= 1.02 (180deg=-0.462) USER MOD Single : A 312 THR OG1 : rot 132:sc= -0.451 USER MOD Single : A 314 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLU A 247 54.565 -21.186 1.288 1.00 6.34 N ATOM 2 CA GLU A 247 54.000 -19.814 1.146 1.00 5.61 C ATOM 3 C GLU A 247 55.136 -18.790 1.164 1.00 5.42 C ATOM 4 O GLU A 247 56.076 -18.905 1.926 1.00 5.31 O ATOM 5 CB GLU A 247 53.043 -19.534 2.307 1.00 4.81 C ATOM 6 CG GLU A 247 52.542 -18.091 2.221 1.00 3.88 C ATOM 7 CD GLU A 247 51.069 -18.084 1.810 1.00 4.40 C ATOM 8 OE1 GLU A 247 50.292 -18.770 2.454 1.00 4.84 O ATOM 9 OE2 GLU A 247 50.742 -17.394 0.859 1.00 4.78 O ATOM 0 HA GLU A 247 53.459 -19.740 0.203 1.00 5.61 H new ATOM 0 HB2 GLU A 247 52.201 -20.225 2.272 1.00 4.81 H new ATOM 0 HB3 GLU A 247 53.550 -19.698 3.258 1.00 4.81 H new ATOM 0 HG2 GLU A 247 52.664 -17.595 3.184 1.00 3.88 H new ATOM 0 HG3 GLU A 247 53.135 -17.532 1.497 1.00 3.88 H new ATOM 18 N GLN A 248 55.058 -17.789 0.331 1.00 5.67 N ATOM 19 CA GLN A 248 56.134 -16.759 0.301 1.00 5.63 C ATOM 20 C GLN A 248 55.537 -15.390 0.632 1.00 4.48 C ATOM 21 O GLN A 248 55.832 -14.401 -0.011 1.00 4.66 O ATOM 22 CB GLN A 248 56.763 -16.718 -1.093 1.00 6.85 C ATOM 23 CG GLN A 248 58.224 -16.277 -0.982 1.00 7.77 C ATOM 24 CD GLN A 248 59.135 -17.504 -1.049 1.00 8.75 C ATOM 25 OE1 GLN A 248 59.471 -18.082 -0.035 1.00 9.19 O ATOM 26 NE2 GLN A 248 59.551 -17.929 -2.211 1.00 9.33 N ATOM 0 H GLN A 248 54.296 -17.640 -0.330 1.00 5.67 H new ATOM 0 HA GLN A 248 56.898 -17.010 1.036 1.00 5.63 H new ATOM 0 HB2 GLN A 248 56.704 -17.701 -1.559 1.00 6.85 H new ATOM 0 HB3 GLN A 248 56.212 -16.028 -1.732 1.00 6.85 H new ATOM 0 HG2 GLN A 248 58.468 -15.585 -1.788 1.00 7.77 H new ATOM 0 HG3 GLN A 248 58.384 -15.743 -0.045 1.00 7.77 H new ATOM 0 HE21 GLN A 248 59.269 -17.444 -3.063 1.00 9.33 H new ATOM 0 HE22 GLN A 248 60.158 -18.747 -2.267 1.00 9.33 H new ATOM 35 N GLU A 249 54.699 -15.323 1.630 1.00 3.49 N ATOM 36 CA GLU A 249 54.083 -14.018 2.000 1.00 2.50 C ATOM 37 C GLU A 249 53.194 -14.205 3.232 1.00 1.63 C ATOM 38 O GLU A 249 52.199 -13.529 3.399 1.00 1.84 O ATOM 39 CB GLU A 249 53.235 -13.505 0.834 1.00 3.37 C ATOM 40 CG GLU A 249 53.250 -11.975 0.825 1.00 3.87 C ATOM 41 CD GLU A 249 54.160 -11.480 -0.300 1.00 4.95 C ATOM 42 OE1 GLU A 249 55.355 -11.388 -0.073 1.00 5.54 O ATOM 43 OE2 GLU A 249 53.646 -11.200 -1.371 1.00 5.48 O ATOM 0 H GLU A 249 54.414 -16.116 2.205 1.00 3.49 H new ATOM 0 HA GLU A 249 54.869 -13.296 2.224 1.00 2.50 H new ATOM 0 HB2 GLU A 249 53.625 -13.888 -0.109 1.00 3.37 H new ATOM 0 HB3 GLU A 249 52.212 -13.869 0.927 1.00 3.37 H new ATOM 0 HG2 GLU A 249 52.239 -11.592 0.685 1.00 3.87 H new ATOM 0 HG3 GLU A 249 53.603 -11.599 1.785 1.00 3.87 H new ATOM 50 N GLU A 250 53.544 -15.120 4.094 1.00 1.69 N ATOM 51 CA GLU A 250 52.718 -15.351 5.311 1.00 1.80 C ATOM 52 C GLU A 250 52.668 -14.072 6.149 1.00 2.18 C ATOM 53 O GLU A 250 51.659 -13.749 6.744 1.00 3.10 O ATOM 54 CB GLU A 250 53.335 -16.480 6.139 1.00 2.66 C ATOM 55 CG GLU A 250 52.390 -16.849 7.284 1.00 3.26 C ATOM 56 CD GLU A 250 52.991 -17.998 8.094 1.00 4.12 C ATOM 57 OE1 GLU A 250 54.047 -18.477 7.713 1.00 4.70 O ATOM 58 OE2 GLU A 250 52.386 -18.380 9.083 1.00 4.56 O ATOM 0 H GLU A 250 54.366 -15.717 4.007 1.00 1.69 H new ATOM 0 HA GLU A 250 51.706 -15.628 5.014 1.00 1.80 H new ATOM 0 HB2 GLU A 250 53.516 -17.350 5.508 1.00 2.66 H new ATOM 0 HB3 GLU A 250 54.301 -16.168 6.537 1.00 2.66 H new ATOM 0 HG2 GLU A 250 52.226 -15.984 7.927 1.00 3.26 H new ATOM 0 HG3 GLU A 250 51.417 -17.140 6.887 1.00 3.26 H new ATOM 65 N GLU A 251 53.749 -13.343 6.204 1.00 2.00 N ATOM 66 CA GLU A 251 53.759 -12.088 7.008 1.00 2.92 C ATOM 67 C GLU A 251 54.345 -10.947 6.172 1.00 2.50 C ATOM 68 O GLU A 251 54.708 -9.910 6.690 1.00 3.28 O ATOM 69 CB GLU A 251 54.614 -12.293 8.260 1.00 4.08 C ATOM 70 CG GLU A 251 53.757 -12.903 9.370 1.00 4.98 C ATOM 71 CD GLU A 251 54.262 -12.420 10.731 1.00 5.99 C ATOM 72 OE1 GLU A 251 55.468 -12.367 10.907 1.00 6.54 O ATOM 73 OE2 GLU A 251 53.435 -12.111 11.572 1.00 6.46 O ATOM 0 H GLU A 251 54.624 -13.562 5.728 1.00 2.00 H new ATOM 0 HA GLU A 251 52.739 -11.836 7.299 1.00 2.92 H new ATOM 0 HB2 GLU A 251 55.456 -12.948 8.035 1.00 4.08 H new ATOM 0 HB3 GLU A 251 55.030 -11.341 8.589 1.00 4.08 H new ATOM 0 HG2 GLU A 251 52.713 -12.618 9.236 1.00 4.98 H new ATOM 0 HG3 GLU A 251 53.799 -13.991 9.320 1.00 4.98 H new ATOM 80 N LEU A 252 54.440 -11.129 4.884 1.00 1.39 N ATOM 81 CA LEU A 252 55.003 -10.053 4.020 1.00 1.03 C ATOM 82 C LEU A 252 56.433 -9.738 4.464 1.00 1.00 C ATOM 83 O LEU A 252 56.658 -9.210 5.535 1.00 1.13 O ATOM 84 CB LEU A 252 54.143 -8.794 4.147 1.00 0.92 C ATOM 85 CG LEU A 252 54.847 -7.626 3.453 1.00 0.77 C ATOM 86 CD1 LEU A 252 53.814 -6.758 2.733 1.00 0.67 C ATOM 87 CD2 LEU A 252 55.579 -6.782 4.499 1.00 1.24 C ATOM 0 H LEU A 252 54.153 -11.975 4.392 1.00 1.39 H new ATOM 0 HA LEU A 252 55.009 -10.387 2.982 1.00 1.03 H new ATOM 0 HB2 LEU A 252 53.164 -8.962 3.698 1.00 0.92 H new ATOM 0 HB3 LEU A 252 53.975 -8.559 5.198 1.00 0.92 H new ATOM 0 HG LEU A 252 55.563 -8.013 2.728 1.00 0.77 H new ATOM 0 HD11 LEU A 252 54.318 -5.927 2.240 1.00 0.67 H new ATOM 0 HD12 LEU A 252 53.290 -7.358 1.989 1.00 0.67 H new ATOM 0 HD13 LEU A 252 53.097 -6.370 3.457 1.00 0.67 H new ATOM 0 HD21 LEU A 252 56.082 -5.949 4.007 1.00 1.24 H new ATOM 0 HD22 LEU A 252 54.861 -6.397 5.223 1.00 1.24 H new ATOM 0 HD23 LEU A 252 56.317 -7.399 5.013 1.00 1.24 H new ATOM 99 N ASP A 253 57.402 -10.055 3.649 1.00 1.02 N ATOM 100 CA ASP A 253 58.814 -9.771 4.028 1.00 1.08 C ATOM 101 C ASP A 253 59.689 -9.760 2.772 1.00 1.01 C ATOM 102 O ASP A 253 60.593 -10.559 2.628 1.00 1.24 O ATOM 103 CB ASP A 253 59.313 -10.853 4.987 1.00 1.39 C ATOM 104 CG ASP A 253 60.327 -10.247 5.959 1.00 1.79 C ATOM 105 OD1 ASP A 253 60.983 -9.291 5.580 1.00 2.39 O ATOM 106 OD2 ASP A 253 60.431 -10.750 7.066 1.00 2.32 O ATOM 0 H ASP A 253 57.277 -10.498 2.739 1.00 1.02 H new ATOM 0 HA ASP A 253 58.869 -8.798 4.517 1.00 1.08 H new ATOM 0 HB2 ASP A 253 58.475 -11.279 5.538 1.00 1.39 H new ATOM 0 HB3 ASP A 253 59.773 -11.667 4.426 1.00 1.39 H new ATOM 111 N LEU A 254 59.430 -8.861 1.862 1.00 0.80 N ATOM 112 CA LEU A 254 60.252 -8.803 0.619 1.00 0.80 C ATOM 113 C LEU A 254 60.911 -7.427 0.511 1.00 0.71 C ATOM 114 O LEU A 254 60.559 -6.518 1.228 1.00 0.68 O ATOM 115 CB LEU A 254 59.354 -9.034 -0.598 1.00 0.86 C ATOM 116 CG LEU A 254 59.845 -10.259 -1.370 1.00 1.12 C ATOM 117 CD1 LEU A 254 58.974 -11.466 -1.021 1.00 1.31 C ATOM 118 CD2 LEU A 254 59.754 -9.983 -2.873 1.00 1.40 C ATOM 0 H LEU A 254 58.687 -8.165 1.925 1.00 0.80 H new ATOM 0 HA LEU A 254 61.021 -9.575 0.654 1.00 0.80 H new ATOM 0 HB2 LEU A 254 58.322 -9.182 -0.279 1.00 0.86 H new ATOM 0 HB3 LEU A 254 59.365 -8.156 -1.243 1.00 0.86 H new ATOM 0 HG LEU A 254 60.880 -10.468 -1.099 1.00 1.12 H new ATOM 0 HD11 LEU A 254 59.324 -12.339 -1.572 1.00 1.31 H new ATOM 0 HD12 LEU A 254 59.037 -11.663 0.049 1.00 1.31 H new ATOM 0 HD13 LEU A 254 57.939 -11.258 -1.291 1.00 1.31 H new ATOM 0 HD21 LEU A 254 60.104 -10.855 -3.425 1.00 1.40 H new ATOM 0 HD22 LEU A 254 58.719 -9.774 -3.143 1.00 1.40 H new ATOM 0 HD23 LEU A 254 60.375 -9.123 -3.123 1.00 1.40 H new ATOM 130 N PRO A 255 61.853 -7.317 -0.385 1.00 0.70 N ATOM 131 CA PRO A 255 62.580 -6.058 -0.614 1.00 0.65 C ATOM 132 C PRO A 255 61.749 -5.116 -1.494 1.00 0.64 C ATOM 133 O PRO A 255 61.262 -5.505 -2.537 1.00 0.73 O ATOM 134 CB PRO A 255 63.846 -6.509 -1.348 1.00 0.71 C ATOM 135 CG PRO A 255 63.512 -7.876 -1.994 1.00 0.79 C ATOM 136 CD PRO A 255 62.288 -8.434 -1.245 1.00 0.79 C ATOM 0 HA PRO A 255 62.794 -5.510 0.304 1.00 0.65 H new ATOM 0 HB2 PRO A 255 64.136 -5.781 -2.106 1.00 0.71 H new ATOM 0 HB3 PRO A 255 64.684 -6.600 -0.657 1.00 0.71 H new ATOM 0 HG2 PRO A 255 63.295 -7.759 -3.056 1.00 0.79 H new ATOM 0 HG3 PRO A 255 64.358 -8.558 -1.914 1.00 0.79 H new ATOM 0 HD2 PRO A 255 61.501 -8.735 -1.936 1.00 0.79 H new ATOM 0 HD3 PRO A 255 62.548 -9.313 -0.656 1.00 0.79 H new ATOM 144 N LEU A 256 61.584 -3.880 -1.096 1.00 0.57 N ATOM 145 CA LEU A 256 60.785 -2.946 -1.943 1.00 0.60 C ATOM 146 C LEU A 256 61.473 -2.813 -3.301 1.00 0.70 C ATOM 147 O LEU A 256 60.842 -2.862 -4.338 1.00 0.87 O ATOM 148 CB LEU A 256 60.695 -1.558 -1.291 1.00 0.60 C ATOM 149 CG LEU A 256 59.834 -1.604 -0.025 1.00 0.56 C ATOM 150 CD1 LEU A 256 59.326 -0.197 0.293 1.00 0.45 C ATOM 151 CD2 LEU A 256 58.633 -2.524 -0.237 1.00 1.01 C ATOM 0 H LEU A 256 61.961 -3.483 -0.236 1.00 0.57 H new ATOM 0 HA LEU A 256 59.776 -3.343 -2.055 1.00 0.60 H new ATOM 0 HB2 LEU A 256 61.695 -1.203 -1.043 1.00 0.60 H new ATOM 0 HB3 LEU A 256 60.270 -0.846 -1.999 1.00 0.60 H new ATOM 0 HG LEU A 256 60.439 -1.982 0.799 1.00 0.56 H new ATOM 0 HD11 LEU A 256 58.713 -0.226 1.194 1.00 0.45 H new ATOM 0 HD12 LEU A 256 60.174 0.469 0.453 1.00 0.45 H new ATOM 0 HD13 LEU A 256 58.728 0.171 -0.541 1.00 0.45 H new ATOM 0 HD21 LEU A 256 58.029 -2.548 0.670 1.00 1.01 H new ATOM 0 HD22 LEU A 256 58.030 -2.150 -1.065 1.00 1.01 H new ATOM 0 HD23 LEU A 256 58.982 -3.531 -0.468 1.00 1.01 H new ATOM 163 N GLU A 257 62.767 -2.649 -3.297 1.00 0.66 N ATOM 164 CA GLU A 257 63.510 -2.517 -4.580 1.00 0.76 C ATOM 165 C GLU A 257 62.979 -3.539 -5.589 1.00 0.83 C ATOM 166 O GLU A 257 63.051 -3.340 -6.785 1.00 1.23 O ATOM 167 CB GLU A 257 64.999 -2.774 -4.332 1.00 0.90 C ATOM 168 CG GLU A 257 65.759 -2.706 -5.658 1.00 1.22 C ATOM 169 CD GLU A 257 66.780 -3.842 -5.720 1.00 1.38 C ATOM 170 OE1 GLU A 257 67.307 -4.197 -4.678 1.00 1.73 O ATOM 171 OE2 GLU A 257 67.019 -4.339 -6.808 1.00 2.04 O ATOM 0 H GLU A 257 63.343 -2.601 -2.457 1.00 0.66 H new ATOM 0 HA GLU A 257 63.372 -1.511 -4.977 1.00 0.76 H new ATOM 0 HB2 GLU A 257 65.395 -2.035 -3.636 1.00 0.90 H new ATOM 0 HB3 GLU A 257 65.138 -3.752 -3.871 1.00 0.90 H new ATOM 0 HG2 GLU A 257 65.062 -2.783 -6.493 1.00 1.22 H new ATOM 0 HG3 GLU A 257 66.263 -1.744 -5.751 1.00 1.22 H new ATOM 178 N GLU A 258 62.447 -4.635 -5.117 1.00 0.78 N ATOM 179 CA GLU A 258 61.917 -5.666 -6.052 1.00 0.81 C ATOM 180 C GLU A 258 60.389 -5.581 -6.105 1.00 0.73 C ATOM 181 O GLU A 258 59.778 -5.913 -7.102 1.00 0.85 O ATOM 182 CB GLU A 258 62.333 -7.056 -5.567 1.00 0.92 C ATOM 183 CG GLU A 258 63.843 -7.226 -5.741 1.00 1.40 C ATOM 184 CD GLU A 258 64.226 -8.683 -5.481 1.00 1.84 C ATOM 185 OE1 GLU A 258 63.500 -9.347 -4.759 1.00 2.47 O ATOM 186 OE2 GLU A 258 65.239 -9.112 -6.008 1.00 2.36 O ATOM 0 H GLU A 258 62.357 -4.859 -4.126 1.00 0.78 H new ATOM 0 HA GLU A 258 62.322 -5.490 -7.048 1.00 0.81 H new ATOM 0 HB2 GLU A 258 62.060 -7.184 -4.519 1.00 0.92 H new ATOM 0 HB3 GLU A 258 61.803 -7.823 -6.131 1.00 0.92 H new ATOM 0 HG2 GLU A 258 64.138 -6.936 -6.749 1.00 1.40 H new ATOM 0 HG3 GLU A 258 64.375 -6.570 -5.052 1.00 1.40 H new ATOM 193 N LEU A 259 59.767 -5.140 -5.043 1.00 0.62 N ATOM 194 CA LEU A 259 58.278 -5.035 -5.037 1.00 0.68 C ATOM 195 C LEU A 259 57.799 -4.475 -6.378 1.00 0.76 C ATOM 196 O LEU A 259 56.698 -4.744 -6.817 1.00 1.47 O ATOM 197 CB LEU A 259 57.832 -4.100 -3.910 1.00 0.69 C ATOM 198 CG LEU A 259 57.247 -4.924 -2.762 1.00 1.03 C ATOM 199 CD1 LEU A 259 58.365 -5.719 -2.086 1.00 1.98 C ATOM 200 CD2 LEU A 259 56.595 -3.987 -1.739 1.00 0.74 C ATOM 0 H LEU A 259 60.226 -4.848 -4.180 1.00 0.62 H new ATOM 0 HA LEU A 259 57.849 -6.025 -4.880 1.00 0.68 H new ATOM 0 HB2 LEU A 259 58.678 -3.512 -3.555 1.00 0.69 H new ATOM 0 HB3 LEU A 259 57.088 -3.395 -4.281 1.00 0.69 H new ATOM 0 HG LEU A 259 56.497 -5.611 -3.153 1.00 1.03 H new ATOM 0 HD11 LEU A 259 57.950 -6.307 -1.267 1.00 1.98 H new ATOM 0 HD12 LEU A 259 58.828 -6.386 -2.813 1.00 1.98 H new ATOM 0 HD13 LEU A 259 59.115 -5.032 -1.695 1.00 1.98 H new ATOM 0 HD21 LEU A 259 56.178 -4.575 -0.921 1.00 0.74 H new ATOM 0 HD22 LEU A 259 57.344 -3.299 -1.347 1.00 0.74 H new ATOM 0 HD23 LEU A 259 55.799 -3.420 -2.221 1.00 0.74 H new ATOM 212 N GLY A 260 58.618 -3.697 -7.032 1.00 0.95 N ATOM 213 CA GLY A 260 58.211 -3.120 -8.344 1.00 0.98 C ATOM 214 C GLY A 260 57.478 -1.798 -8.114 1.00 0.83 C ATOM 215 O GLY A 260 56.833 -1.272 -8.998 1.00 0.98 O ATOM 0 H GLY A 260 59.551 -3.436 -6.714 1.00 0.95 H new ATOM 0 HA2 GLY A 260 59.089 -2.957 -8.970 1.00 0.98 H new ATOM 0 HA3 GLY A 260 57.565 -3.819 -8.876 1.00 0.98 H new ATOM 219 N LEU A 261 57.573 -1.257 -6.930 1.00 0.74 N ATOM 220 CA LEU A 261 56.883 0.031 -6.643 1.00 0.72 C ATOM 221 C LEU A 261 57.446 1.124 -7.553 1.00 0.70 C ATOM 222 O LEU A 261 58.406 0.915 -8.268 1.00 0.96 O ATOM 223 CB LEU A 261 57.110 0.415 -5.178 1.00 0.74 C ATOM 224 CG LEU A 261 56.905 -0.814 -4.289 1.00 1.01 C ATOM 225 CD1 LEU A 261 56.818 -0.377 -2.825 1.00 1.85 C ATOM 226 CD2 LEU A 261 55.606 -1.521 -4.685 1.00 1.11 C ATOM 0 H LEU A 261 58.098 -1.652 -6.150 1.00 0.74 H new ATOM 0 HA LEU A 261 55.814 -0.078 -6.827 1.00 0.72 H new ATOM 0 HB2 LEU A 261 58.118 0.808 -5.046 1.00 0.74 H new ATOM 0 HB3 LEU A 261 56.419 1.206 -4.887 1.00 0.74 H new ATOM 0 HG LEU A 261 57.745 -1.497 -4.417 1.00 1.01 H new ATOM 0 HD11 LEU A 261 56.672 -1.252 -2.192 1.00 1.85 H new ATOM 0 HD12 LEU A 261 57.742 0.127 -2.540 1.00 1.85 H new ATOM 0 HD13 LEU A 261 55.978 0.306 -2.699 1.00 1.85 H new ATOM 0 HD21 LEU A 261 55.460 -2.396 -4.052 1.00 1.11 H new ATOM 0 HD22 LEU A 261 54.766 -0.838 -4.558 1.00 1.11 H new ATOM 0 HD23 LEU A 261 55.665 -1.833 -5.728 1.00 1.11 H new ATOM 238 N SER A 262 56.858 2.289 -7.535 1.00 0.70 N ATOM 239 CA SER A 262 57.363 3.391 -8.402 1.00 0.70 C ATOM 240 C SER A 262 58.868 3.555 -8.191 1.00 0.64 C ATOM 241 O SER A 262 59.385 3.299 -7.122 1.00 0.63 O ATOM 242 CB SER A 262 56.653 4.694 -8.035 1.00 0.74 C ATOM 243 OG SER A 262 56.109 5.279 -9.211 1.00 1.36 O ATOM 0 H SER A 262 56.051 2.525 -6.958 1.00 0.70 H new ATOM 0 HA SER A 262 57.166 3.151 -9.447 1.00 0.70 H new ATOM 0 HB2 SER A 262 55.861 4.499 -7.312 1.00 0.74 H new ATOM 0 HB3 SER A 262 57.353 5.383 -7.563 1.00 0.74 H new ATOM 0 HG SER A 262 55.310 4.782 -9.484 1.00 1.36 H new ATOM 249 N THR A 263 59.578 3.979 -9.201 1.00 0.69 N ATOM 250 CA THR A 263 61.049 4.157 -9.047 1.00 0.69 C ATOM 251 C THR A 263 61.322 5.106 -7.881 1.00 0.60 C ATOM 252 O THR A 263 62.146 4.837 -7.029 1.00 0.62 O ATOM 253 CB THR A 263 61.644 4.744 -10.332 1.00 0.86 C ATOM 254 OG1 THR A 263 60.596 5.106 -11.221 1.00 1.34 O ATOM 255 CG2 THR A 263 62.546 3.704 -10.998 1.00 1.05 C ATOM 0 H THR A 263 59.205 4.209 -10.122 1.00 0.69 H new ATOM 0 HA THR A 263 61.510 3.189 -8.852 1.00 0.69 H new ATOM 0 HB THR A 263 62.231 5.629 -10.088 1.00 0.86 H new ATOM 0 HG1 THR A 263 60.978 5.483 -12.041 1.00 1.34 H new ATOM 0 HG21 THR A 263 62.969 4.121 -11.912 1.00 1.05 H new ATOM 0 HG22 THR A 263 63.352 3.431 -10.316 1.00 1.05 H new ATOM 0 HG23 THR A 263 61.961 2.817 -11.241 1.00 1.05 H new ATOM 263 N ARG A 264 60.632 6.212 -7.829 1.00 0.60 N ATOM 264 CA ARG A 264 60.852 7.170 -6.711 1.00 0.57 C ATOM 265 C ARG A 264 60.863 6.400 -5.390 1.00 0.49 C ATOM 266 O ARG A 264 61.577 6.737 -4.469 1.00 0.53 O ATOM 267 CB ARG A 264 59.723 8.203 -6.693 1.00 0.66 C ATOM 268 CG ARG A 264 59.551 8.796 -8.093 1.00 1.13 C ATOM 269 CD ARG A 264 59.980 10.264 -8.082 1.00 1.56 C ATOM 270 NE ARG A 264 59.340 10.977 -9.224 1.00 2.03 N ATOM 271 CZ ARG A 264 59.646 12.221 -9.471 1.00 2.48 C ATOM 272 NH1 ARG A 264 59.532 13.120 -8.531 1.00 3.16 N ATOM 273 NH2 ARG A 264 60.067 12.566 -10.657 1.00 2.92 N ATOM 0 H ARG A 264 59.927 6.493 -8.511 1.00 0.60 H new ATOM 0 HA ARG A 264 61.805 7.682 -6.846 1.00 0.57 H new ATOM 0 HB2 ARG A 264 58.793 7.736 -6.368 1.00 0.66 H new ATOM 0 HB3 ARG A 264 59.950 8.993 -5.977 1.00 0.66 H new ATOM 0 HG2 ARG A 264 60.149 8.237 -8.812 1.00 1.13 H new ATOM 0 HG3 ARG A 264 58.511 8.712 -8.410 1.00 1.13 H new ATOM 0 HD2 ARG A 264 59.692 10.731 -7.140 1.00 1.56 H new ATOM 0 HD3 ARG A 264 61.065 10.338 -8.155 1.00 1.56 H new ATOM 0 HE ARG A 264 58.663 10.492 -9.813 1.00 2.03 H new ATOM 0 HH11 ARG A 264 59.204 12.850 -7.604 1.00 3.16 H new ATOM 0 HH12 ARG A 264 59.771 14.093 -8.724 1.00 3.16 H new ATOM 0 HH21 ARG A 264 60.157 11.863 -11.391 1.00 2.92 H new ATOM 0 HH22 ARG A 264 60.306 13.539 -10.850 1.00 2.92 H new ATOM 287 N VAL A 265 60.077 5.362 -5.294 1.00 0.44 N ATOM 288 CA VAL A 265 60.043 4.567 -4.035 1.00 0.38 C ATOM 289 C VAL A 265 61.357 3.802 -3.882 1.00 0.41 C ATOM 290 O VAL A 265 62.045 3.925 -2.892 1.00 0.40 O ATOM 291 CB VAL A 265 58.886 3.568 -4.091 1.00 0.39 C ATOM 292 CG1 VAL A 265 58.646 2.980 -2.698 1.00 0.41 C ATOM 293 CG2 VAL A 265 57.621 4.281 -4.572 1.00 0.40 C ATOM 0 H VAL A 265 59.457 5.031 -6.033 1.00 0.44 H new ATOM 0 HA VAL A 265 59.906 5.239 -3.188 1.00 0.38 H new ATOM 0 HB VAL A 265 59.135 2.763 -4.783 1.00 0.39 H new ATOM 0 HG11 VAL A 265 57.821 2.269 -2.741 1.00 0.41 H new ATOM 0 HG12 VAL A 265 59.548 2.470 -2.358 1.00 0.41 H new ATOM 0 HG13 VAL A 265 58.398 3.782 -2.002 1.00 0.41 H new ATOM 0 HG21 VAL A 265 56.796 3.570 -4.612 1.00 0.40 H new ATOM 0 HG22 VAL A 265 57.372 5.087 -3.881 1.00 0.40 H new ATOM 0 HG23 VAL A 265 57.792 4.695 -5.566 1.00 0.40 H new ATOM 303 N LEU A 266 61.704 3.008 -4.857 1.00 0.47 N ATOM 304 CA LEU A 266 62.967 2.219 -4.777 1.00 0.52 C ATOM 305 C LEU A 266 64.077 3.058 -4.141 1.00 0.51 C ATOM 306 O LEU A 266 64.572 2.747 -3.075 1.00 0.50 O ATOM 307 CB LEU A 266 63.392 1.809 -6.189 1.00 0.60 C ATOM 308 CG LEU A 266 62.905 0.389 -6.479 1.00 0.73 C ATOM 309 CD1 LEU A 266 61.850 0.422 -7.586 1.00 0.82 C ATOM 310 CD2 LEU A 266 64.088 -0.470 -6.931 1.00 1.05 C ATOM 0 H LEU A 266 61.164 2.871 -5.711 1.00 0.47 H new ATOM 0 HA LEU A 266 62.796 1.334 -4.164 1.00 0.52 H new ATOM 0 HB2 LEU A 266 62.978 2.503 -6.920 1.00 0.60 H new ATOM 0 HB3 LEU A 266 64.477 1.858 -6.282 1.00 0.60 H new ATOM 0 HG LEU A 266 62.467 -0.035 -5.575 1.00 0.73 H new ATOM 0 HD11 LEU A 266 61.505 -0.592 -7.790 1.00 0.82 H new ATOM 0 HD12 LEU A 266 61.007 1.035 -7.267 1.00 0.82 H new ATOM 0 HD13 LEU A 266 62.285 0.846 -8.491 1.00 0.82 H new ATOM 0 HD21 LEU A 266 63.744 -1.483 -7.138 1.00 1.05 H new ATOM 0 HD22 LEU A 266 64.524 -0.043 -7.834 1.00 1.05 H new ATOM 0 HD23 LEU A 266 64.840 -0.497 -6.143 1.00 1.05 H new ATOM 322 N HIS A 267 64.475 4.109 -4.793 1.00 0.55 N ATOM 323 CA HIS A 267 65.563 4.967 -4.246 1.00 0.57 C ATOM 324 C HIS A 267 65.176 5.524 -2.870 1.00 0.49 C ATOM 325 O HIS A 267 65.766 5.176 -1.863 1.00 0.46 O ATOM 326 CB HIS A 267 65.822 6.128 -5.208 1.00 0.67 C ATOM 327 CG HIS A 267 67.302 6.369 -5.318 1.00 1.15 C ATOM 328 ND1 HIS A 267 67.989 7.172 -4.421 1.00 1.85 N ATOM 329 CD2 HIS A 267 68.241 5.920 -6.214 1.00 1.79 C ATOM 330 CE1 HIS A 267 69.282 7.181 -4.793 1.00 2.18 C ATOM 331 NE2 HIS A 267 69.490 6.434 -5.881 1.00 2.15 N ATOM 0 H HIS A 267 64.093 4.415 -5.688 1.00 0.55 H new ATOM 0 HA HIS A 267 66.463 4.363 -4.136 1.00 0.57 H new ATOM 0 HB2 HIS A 267 65.406 5.900 -6.190 1.00 0.67 H new ATOM 0 HB3 HIS A 267 65.322 7.028 -4.851 1.00 0.67 H new ATOM 0 HD2 HIS A 267 68.040 5.267 -7.050 1.00 1.79 H new ATOM 0 HE1 HIS A 267 70.057 7.726 -4.275 1.00 2.18 H new ATOM 0 HE2 HIS A 267 70.374 6.275 -6.364 1.00 2.15 H new ATOM 339 N SER A 268 64.210 6.405 -2.820 1.00 0.47 N ATOM 340 CA SER A 268 63.815 7.002 -1.510 1.00 0.44 C ATOM 341 C SER A 268 63.538 5.912 -0.479 1.00 0.36 C ATOM 342 O SER A 268 64.281 5.752 0.450 1.00 0.37 O ATOM 343 CB SER A 268 62.567 7.862 -1.666 1.00 0.47 C ATOM 344 OG SER A 268 62.465 8.312 -3.010 1.00 0.59 O ATOM 0 H SER A 268 63.680 6.735 -3.626 1.00 0.47 H new ATOM 0 HA SER A 268 64.644 7.621 -1.167 1.00 0.44 H new ATOM 0 HB2 SER A 268 61.681 7.288 -1.396 1.00 0.47 H new ATOM 0 HB3 SER A 268 62.613 8.715 -0.989 1.00 0.47 H new ATOM 0 HG SER A 268 61.760 7.810 -3.470 1.00 0.59 H new ATOM 350 N LEU A 269 62.469 5.175 -0.616 1.00 0.33 N ATOM 351 CA LEU A 269 62.167 4.118 0.398 1.00 0.31 C ATOM 352 C LEU A 269 63.440 3.351 0.750 1.00 0.33 C ATOM 353 O LEU A 269 63.809 3.246 1.903 1.00 0.36 O ATOM 354 CB LEU A 269 61.121 3.141 -0.148 1.00 0.32 C ATOM 355 CG LEU A 269 59.724 3.605 0.264 1.00 0.33 C ATOM 356 CD1 LEU A 269 59.647 3.703 1.789 1.00 0.38 C ATOM 357 CD2 LEU A 269 59.442 4.979 -0.348 1.00 0.38 C ATOM 0 H LEU A 269 61.796 5.256 -1.378 1.00 0.33 H new ATOM 0 HA LEU A 269 61.774 4.600 1.293 1.00 0.31 H new ATOM 0 HB2 LEU A 269 61.192 3.086 -1.234 1.00 0.32 H new ATOM 0 HB3 LEU A 269 61.310 2.138 0.235 1.00 0.32 H new ATOM 0 HG LEU A 269 58.984 2.888 -0.092 1.00 0.33 H new ATOM 0 HD11 LEU A 269 58.651 4.034 2.082 1.00 0.38 H new ATOM 0 HD12 LEU A 269 59.848 2.725 2.227 1.00 0.38 H new ATOM 0 HD13 LEU A 269 60.387 4.420 2.145 1.00 0.38 H new ATOM 0 HD21 LEU A 269 58.446 5.310 -0.055 1.00 0.38 H new ATOM 0 HD22 LEU A 269 60.182 5.695 0.009 1.00 0.38 H new ATOM 0 HD23 LEU A 269 59.497 4.911 -1.435 1.00 0.38 H new ATOM 369 N LYS A 270 64.114 2.809 -0.224 1.00 0.33 N ATOM 370 CA LYS A 270 65.357 2.049 0.078 1.00 0.38 C ATOM 371 C LYS A 270 66.245 2.871 1.016 1.00 0.40 C ATOM 372 O LYS A 270 66.310 2.619 2.210 1.00 0.42 O ATOM 373 CB LYS A 270 66.115 1.771 -1.222 1.00 0.42 C ATOM 374 CG LYS A 270 67.499 1.207 -0.895 1.00 0.52 C ATOM 375 CD LYS A 270 68.203 0.795 -2.189 1.00 0.88 C ATOM 376 CE LYS A 270 69.631 0.344 -1.872 1.00 1.40 C ATOM 377 NZ LYS A 270 70.555 0.835 -2.933 1.00 1.90 N ATOM 0 H LYS A 270 63.860 2.859 -1.211 1.00 0.33 H new ATOM 0 HA LYS A 270 65.096 1.106 0.557 1.00 0.38 H new ATOM 0 HB2 LYS A 270 65.558 1.063 -1.836 1.00 0.42 H new ATOM 0 HB3 LYS A 270 66.212 2.689 -1.802 1.00 0.42 H new ATOM 0 HG2 LYS A 270 68.092 1.954 -0.368 1.00 0.52 H new ATOM 0 HG3 LYS A 270 67.405 0.348 -0.231 1.00 0.52 H new ATOM 0 HD2 LYS A 270 67.654 -0.013 -2.673 1.00 0.88 H new ATOM 0 HD3 LYS A 270 68.221 1.631 -2.888 1.00 0.88 H new ATOM 0 HE2 LYS A 270 69.938 0.730 -0.900 1.00 1.40 H new ATOM 0 HE3 LYS A 270 69.675 -0.743 -1.811 1.00 1.40 H new ATOM 0 HZ1 LYS A 270 71.525 0.529 -2.718 1.00 1.90 H new ATOM 0 HZ2 LYS A 270 70.265 0.446 -3.853 1.00 1.90 H new ATOM 0 HZ3 LYS A 270 70.520 1.874 -2.970 1.00 1.90 H new ATOM 391 N GLU A 271 66.926 3.854 0.477 1.00 0.41 N ATOM 392 CA GLU A 271 67.833 4.708 1.302 1.00 0.45 C ATOM 393 C GLU A 271 67.058 5.479 2.379 1.00 0.45 C ATOM 394 O GLU A 271 67.638 6.212 3.155 1.00 0.50 O ATOM 395 CB GLU A 271 68.550 5.705 0.389 1.00 0.50 C ATOM 396 CG GLU A 271 70.009 5.279 0.212 1.00 0.97 C ATOM 397 CD GLU A 271 70.694 6.206 -0.793 1.00 1.55 C ATOM 398 OE1 GLU A 271 70.049 6.581 -1.759 1.00 2.23 O ATOM 399 OE2 GLU A 271 71.852 6.526 -0.581 1.00 2.21 O ATOM 0 H GLU A 271 66.890 4.102 -0.512 1.00 0.41 H new ATOM 0 HA GLU A 271 68.551 4.058 1.801 1.00 0.45 H new ATOM 0 HB2 GLU A 271 68.053 5.749 -0.580 1.00 0.50 H new ATOM 0 HB3 GLU A 271 68.502 6.706 0.818 1.00 0.50 H new ATOM 0 HG2 GLU A 271 70.528 5.316 1.170 1.00 0.97 H new ATOM 0 HG3 GLU A 271 70.058 4.248 -0.137 1.00 0.97 H new ATOM 406 N GLU A 272 65.766 5.319 2.453 1.00 0.41 N ATOM 407 CA GLU A 272 64.991 6.038 3.494 1.00 0.46 C ATOM 408 C GLU A 272 64.894 5.125 4.711 1.00 0.49 C ATOM 409 O GLU A 272 64.009 5.251 5.533 1.00 0.54 O ATOM 410 CB GLU A 272 63.586 6.345 2.970 1.00 0.46 C ATOM 411 CG GLU A 272 62.809 7.139 4.024 1.00 0.93 C ATOM 412 CD GLU A 272 62.584 8.569 3.528 1.00 1.10 C ATOM 413 OE1 GLU A 272 62.781 8.805 2.347 1.00 1.88 O ATOM 414 OE2 GLU A 272 62.218 9.405 4.338 1.00 1.55 O ATOM 0 H GLU A 272 65.216 4.721 1.836 1.00 0.41 H new ATOM 0 HA GLU A 272 65.479 6.977 3.755 1.00 0.46 H new ATOM 0 HB2 GLU A 272 63.649 6.915 2.043 1.00 0.46 H new ATOM 0 HB3 GLU A 272 63.062 5.418 2.739 1.00 0.46 H new ATOM 0 HG2 GLU A 272 61.852 6.658 4.223 1.00 0.93 H new ATOM 0 HG3 GLU A 272 63.361 7.152 4.964 1.00 0.93 H new ATOM 421 N GLY A 273 65.786 4.173 4.806 1.00 0.49 N ATOM 422 CA GLY A 273 65.734 3.215 5.936 1.00 0.56 C ATOM 423 C GLY A 273 64.589 2.255 5.654 1.00 0.53 C ATOM 424 O GLY A 273 64.004 1.677 6.549 1.00 0.58 O ATOM 0 H GLY A 273 66.548 4.022 4.145 1.00 0.49 H new ATOM 0 HA2 GLY A 273 66.676 2.675 6.027 1.00 0.56 H new ATOM 0 HA3 GLY A 273 65.575 3.739 6.878 1.00 0.56 H new ATOM 428 N ILE A 274 64.252 2.098 4.399 1.00 0.46 N ATOM 429 CA ILE A 274 63.132 1.197 4.042 1.00 0.44 C ATOM 430 C ILE A 274 63.462 0.436 2.756 1.00 0.40 C ATOM 431 O ILE A 274 63.338 0.959 1.668 1.00 0.41 O ATOM 432 CB ILE A 274 61.862 2.035 3.849 1.00 0.44 C ATOM 433 CG1 ILE A 274 61.271 2.381 5.218 1.00 0.58 C ATOM 434 CG2 ILE A 274 60.829 1.252 3.036 1.00 0.41 C ATOM 435 CD1 ILE A 274 61.315 3.896 5.426 1.00 0.98 C ATOM 0 H ILE A 274 64.708 2.558 3.611 1.00 0.46 H new ATOM 0 HA ILE A 274 62.974 0.473 4.841 1.00 0.44 H new ATOM 0 HB ILE A 274 62.118 2.949 3.312 1.00 0.44 H new ATOM 0 HG12 ILE A 274 60.243 2.024 5.283 1.00 0.58 H new ATOM 0 HG13 ILE A 274 61.833 1.879 6.006 1.00 0.58 H new ATOM 0 HG21 ILE A 274 59.933 1.858 2.906 1.00 0.41 H new ATOM 0 HG22 ILE A 274 61.245 1.006 2.059 1.00 0.41 H new ATOM 0 HG23 ILE A 274 60.572 0.333 3.563 1.00 0.41 H new ATOM 0 HD11 ILE A 274 60.894 4.142 6.401 1.00 0.98 H new ATOM 0 HD12 ILE A 274 62.348 4.240 5.380 1.00 0.98 H new ATOM 0 HD13 ILE A 274 60.734 4.387 4.646 1.00 0.98 H new ATOM 447 N GLU A 275 63.868 -0.797 2.868 1.00 0.42 N ATOM 448 CA GLU A 275 64.189 -1.581 1.646 1.00 0.43 C ATOM 449 C GLU A 275 63.294 -2.823 1.593 1.00 0.46 C ATOM 450 O GLU A 275 63.648 -3.824 1.006 1.00 0.51 O ATOM 451 CB GLU A 275 65.666 -2.001 1.677 1.00 0.49 C ATOM 452 CG GLU A 275 65.837 -3.249 2.548 1.00 0.57 C ATOM 453 CD GLU A 275 67.063 -3.082 3.448 1.00 0.69 C ATOM 454 OE1 GLU A 275 66.968 -2.343 4.414 1.00 1.34 O ATOM 455 OE2 GLU A 275 68.076 -3.695 3.155 1.00 1.26 O ATOM 0 H GLU A 275 63.991 -1.294 3.750 1.00 0.42 H new ATOM 0 HA GLU A 275 64.012 -0.970 0.761 1.00 0.43 H new ATOM 0 HB2 GLU A 275 66.017 -2.203 0.665 1.00 0.49 H new ATOM 0 HB3 GLU A 275 66.276 -1.187 2.069 1.00 0.49 H new ATOM 0 HG2 GLU A 275 64.946 -3.406 3.156 1.00 0.57 H new ATOM 0 HG3 GLU A 275 65.953 -4.131 1.918 1.00 0.57 H new ATOM 462 N SER A 276 62.144 -2.767 2.208 1.00 0.47 N ATOM 463 CA SER A 276 61.235 -3.949 2.197 1.00 0.52 C ATOM 464 C SER A 276 59.794 -3.497 2.401 1.00 0.48 C ATOM 465 O SER A 276 59.523 -2.366 2.759 1.00 0.49 O ATOM 466 CB SER A 276 61.632 -4.910 3.318 1.00 0.60 C ATOM 467 OG SER A 276 62.862 -5.539 2.983 1.00 1.46 O ATOM 0 H SER A 276 61.795 -1.955 2.717 1.00 0.47 H new ATOM 0 HA SER A 276 61.319 -4.456 1.236 1.00 0.52 H new ATOM 0 HB2 SER A 276 61.731 -4.369 4.259 1.00 0.60 H new ATOM 0 HB3 SER A 276 60.854 -5.660 3.462 1.00 0.60 H new ATOM 0 HG SER A 276 63.291 -5.050 2.250 1.00 1.46 H new ATOM 473 N VAL A 277 58.869 -4.378 2.169 1.00 0.54 N ATOM 474 CA VAL A 277 57.450 -4.025 2.334 1.00 0.54 C ATOM 475 C VAL A 277 57.147 -3.912 3.825 1.00 0.55 C ATOM 476 O VAL A 277 56.230 -3.229 4.233 1.00 0.61 O ATOM 477 CB VAL A 277 56.572 -5.097 1.688 1.00 0.60 C ATOM 478 CG1 VAL A 277 55.432 -4.405 0.957 1.00 0.97 C ATOM 479 CG2 VAL A 277 57.368 -5.924 0.670 1.00 0.86 C ATOM 0 H VAL A 277 59.044 -5.337 1.869 1.00 0.54 H new ATOM 0 HA VAL A 277 57.240 -3.072 1.848 1.00 0.54 H new ATOM 0 HB VAL A 277 56.201 -5.763 2.467 1.00 0.60 H new ATOM 0 HG11 VAL A 277 54.793 -5.153 0.488 1.00 0.97 H new ATOM 0 HG12 VAL A 277 54.846 -3.821 1.667 1.00 0.97 H new ATOM 0 HG13 VAL A 277 55.839 -3.744 0.191 1.00 0.97 H new ATOM 0 HG21 VAL A 277 56.718 -6.679 0.227 1.00 0.86 H new ATOM 0 HG22 VAL A 277 57.750 -5.268 -0.113 1.00 0.86 H new ATOM 0 HG23 VAL A 277 58.203 -6.414 1.172 1.00 0.86 H new ATOM 489 N ARG A 278 57.934 -4.555 4.645 1.00 0.59 N ATOM 490 CA ARG A 278 57.710 -4.452 6.110 1.00 0.64 C ATOM 491 C ARG A 278 57.937 -2.997 6.510 1.00 0.58 C ATOM 492 O ARG A 278 57.122 -2.384 7.173 1.00 0.62 O ATOM 493 CB ARG A 278 58.699 -5.355 6.849 1.00 0.72 C ATOM 494 CG ARG A 278 58.454 -5.257 8.356 1.00 1.00 C ATOM 495 CD ARG A 278 58.659 -6.630 8.997 1.00 1.58 C ATOM 496 NE ARG A 278 58.009 -6.655 10.337 1.00 2.24 N ATOM 497 CZ ARG A 278 58.358 -7.556 11.215 1.00 2.64 C ATOM 498 NH1 ARG A 278 58.704 -8.751 10.822 1.00 3.21 N ATOM 499 NH2 ARG A 278 58.361 -7.261 12.487 1.00 3.07 N ATOM 0 H ARG A 278 58.718 -5.144 4.363 1.00 0.59 H new ATOM 0 HA ARG A 278 56.699 -4.766 6.368 1.00 0.64 H new ATOM 0 HB2 ARG A 278 58.583 -6.387 6.518 1.00 0.72 H new ATOM 0 HB3 ARG A 278 59.722 -5.059 6.616 1.00 0.72 H new ATOM 0 HG2 ARG A 278 59.136 -4.531 8.800 1.00 1.00 H new ATOM 0 HG3 ARG A 278 57.442 -4.902 8.548 1.00 1.00 H new ATOM 0 HD2 ARG A 278 58.235 -7.407 8.361 1.00 1.58 H new ATOM 0 HD3 ARG A 278 59.724 -6.843 9.093 1.00 1.58 H new ATOM 0 HE ARG A 278 57.291 -5.968 10.569 1.00 2.24 H new ATOM 0 HH11 ARG A 278 58.702 -8.982 9.828 1.00 3.21 H new ATOM 0 HH12 ARG A 278 58.977 -9.455 11.508 1.00 3.21 H new ATOM 0 HH21 ARG A 278 58.091 -6.327 12.795 1.00 3.07 H new ATOM 0 HH22 ARG A 278 58.634 -7.965 13.173 1.00 3.07 H new ATOM 513 N ALA A 279 59.031 -2.427 6.079 1.00 0.53 N ATOM 514 CA ALA A 279 59.299 -1.003 6.398 1.00 0.50 C ATOM 515 C ALA A 279 58.214 -0.165 5.728 1.00 0.46 C ATOM 516 O ALA A 279 57.632 0.717 6.328 1.00 0.48 O ATOM 517 CB ALA A 279 60.673 -0.601 5.858 1.00 0.48 C ATOM 0 H ALA A 279 59.748 -2.890 5.520 1.00 0.53 H new ATOM 0 HA ALA A 279 59.292 -0.845 7.476 1.00 0.50 H new ATOM 0 HB1 ALA A 279 60.865 0.445 6.095 1.00 0.48 H new ATOM 0 HB2 ALA A 279 61.441 -1.224 6.317 1.00 0.48 H new ATOM 0 HB3 ALA A 279 60.693 -0.738 4.777 1.00 0.48 H new ATOM 523 N LEU A 280 57.921 -0.456 4.488 1.00 0.43 N ATOM 524 CA LEU A 280 56.853 0.300 3.781 1.00 0.41 C ATOM 525 C LEU A 280 55.575 0.210 4.617 1.00 0.48 C ATOM 526 O LEU A 280 54.731 1.083 4.589 1.00 0.53 O ATOM 527 CB LEU A 280 56.616 -0.326 2.402 1.00 0.45 C ATOM 528 CG LEU A 280 56.117 0.738 1.424 1.00 0.45 C ATOM 529 CD1 LEU A 280 55.005 1.556 2.081 1.00 0.52 C ATOM 530 CD2 LEU A 280 57.272 1.668 1.044 1.00 0.45 C ATOM 0 H LEU A 280 58.376 -1.184 3.937 1.00 0.43 H new ATOM 0 HA LEU A 280 57.144 1.342 3.650 1.00 0.41 H new ATOM 0 HB2 LEU A 280 57.540 -0.768 2.031 1.00 0.45 H new ATOM 0 HB3 LEU A 280 55.886 -1.132 2.480 1.00 0.45 H new ATOM 0 HG LEU A 280 55.731 0.251 0.528 1.00 0.45 H new ATOM 0 HD11 LEU A 280 54.650 2.314 1.383 1.00 0.52 H new ATOM 0 HD12 LEU A 280 54.180 0.897 2.352 1.00 0.52 H new ATOM 0 HD13 LEU A 280 55.391 2.041 2.978 1.00 0.52 H new ATOM 0 HD21 LEU A 280 56.915 2.426 0.347 1.00 0.45 H new ATOM 0 HD22 LEU A 280 57.659 2.153 1.940 1.00 0.45 H new ATOM 0 HD23 LEU A 280 58.066 1.088 0.574 1.00 0.45 H new ATOM 542 N LEU A 281 55.442 -0.845 5.375 1.00 0.55 N ATOM 543 CA LEU A 281 54.236 -1.010 6.234 1.00 0.64 C ATOM 544 C LEU A 281 54.386 -0.123 7.469 1.00 0.65 C ATOM 545 O LEU A 281 53.438 0.471 7.941 1.00 0.71 O ATOM 546 CB LEU A 281 54.120 -2.476 6.665 1.00 0.74 C ATOM 547 CG LEU A 281 53.037 -2.625 7.738 1.00 0.79 C ATOM 548 CD1 LEU A 281 52.553 -4.076 7.773 1.00 1.55 C ATOM 549 CD2 LEU A 281 53.615 -2.256 9.107 1.00 1.65 C ATOM 0 H LEU A 281 56.121 -1.603 5.436 1.00 0.55 H new ATOM 0 HA LEU A 281 53.341 -0.724 5.682 1.00 0.64 H new ATOM 0 HB2 LEU A 281 53.877 -3.098 5.804 1.00 0.74 H new ATOM 0 HB3 LEU A 281 55.077 -2.826 7.052 1.00 0.74 H new ATOM 0 HG LEU A 281 52.204 -1.963 7.503 1.00 0.79 H new ATOM 0 HD11 LEU A 281 51.782 -4.184 8.536 1.00 1.55 H new ATOM 0 HD12 LEU A 281 52.141 -4.346 6.800 1.00 1.55 H new ATOM 0 HD13 LEU A 281 53.390 -4.733 8.007 1.00 1.55 H new ATOM 0 HD21 LEU A 281 52.843 -2.363 9.869 1.00 1.65 H new ATOM 0 HD22 LEU A 281 54.449 -2.918 9.340 1.00 1.65 H new ATOM 0 HD23 LEU A 281 53.966 -1.224 9.088 1.00 1.65 H new ATOM 561 N ALA A 282 55.577 -0.029 7.994 1.00 0.64 N ATOM 562 CA ALA A 282 55.795 0.820 9.199 1.00 0.70 C ATOM 563 C ALA A 282 55.500 2.279 8.850 1.00 0.67 C ATOM 564 O ALA A 282 54.984 3.028 9.656 1.00 0.74 O ATOM 565 CB ALA A 282 57.249 0.689 9.659 1.00 0.71 C ATOM 0 H ALA A 282 56.408 -0.503 7.641 1.00 0.64 H new ATOM 0 HA ALA A 282 55.131 0.495 10.000 1.00 0.70 H new ATOM 0 HB1 ALA A 282 57.409 1.310 10.540 1.00 0.71 H new ATOM 0 HB2 ALA A 282 57.460 -0.352 9.905 1.00 0.71 H new ATOM 0 HB3 ALA A 282 57.914 1.015 8.860 1.00 0.71 H new ATOM 571 N LEU A 283 55.820 2.688 7.653 1.00 0.59 N ATOM 572 CA LEU A 283 55.555 4.098 7.252 1.00 0.57 C ATOM 573 C LEU A 283 54.058 4.387 7.375 1.00 0.63 C ATOM 574 O LEU A 283 53.302 4.200 6.442 1.00 0.69 O ATOM 575 CB LEU A 283 55.998 4.308 5.802 1.00 0.55 C ATOM 576 CG LEU A 283 57.478 3.946 5.657 1.00 0.55 C ATOM 577 CD1 LEU A 283 57.998 4.456 4.312 1.00 0.63 C ATOM 578 CD2 LEU A 283 58.276 4.596 6.790 1.00 0.66 C ATOM 0 H LEU A 283 56.253 2.107 6.936 1.00 0.59 H new ATOM 0 HA LEU A 283 56.111 4.773 7.902 1.00 0.57 H new ATOM 0 HB2 LEU A 283 55.396 3.691 5.135 1.00 0.55 H new ATOM 0 HB3 LEU A 283 55.837 5.346 5.509 1.00 0.55 H new ATOM 0 HG LEU A 283 57.593 2.863 5.705 1.00 0.55 H new ATOM 0 HD11 LEU A 283 59.052 4.199 4.208 1.00 0.63 H new ATOM 0 HD12 LEU A 283 57.430 3.995 3.504 1.00 0.63 H new ATOM 0 HD13 LEU A 283 57.883 5.539 4.264 1.00 0.63 H new ATOM 0 HD21 LEU A 283 59.330 4.338 6.687 1.00 0.66 H new ATOM 0 HD22 LEU A 283 58.161 5.679 6.742 1.00 0.66 H new ATOM 0 HD23 LEU A 283 57.906 4.234 7.749 1.00 0.66 H new ATOM 590 N ASN A 284 53.622 4.839 8.519 1.00 0.74 N ATOM 591 CA ASN A 284 52.172 5.136 8.698 1.00 0.86 C ATOM 592 C ASN A 284 51.762 6.270 7.758 1.00 0.93 C ATOM 593 O ASN A 284 52.523 6.692 6.912 1.00 0.86 O ATOM 594 CB ASN A 284 51.910 5.554 10.147 1.00 0.97 C ATOM 595 CG ASN A 284 52.721 4.665 11.092 1.00 1.45 C ATOM 596 OD1 ASN A 284 52.647 3.455 11.019 1.00 2.34 O ATOM 597 ND2 ASN A 284 53.497 5.219 11.983 1.00 1.80 N ATOM 0 H ASN A 284 54.206 5.015 9.336 1.00 0.74 H new ATOM 0 HA ASN A 284 51.589 4.245 8.467 1.00 0.86 H new ATOM 0 HB2 ASN A 284 52.184 6.599 10.290 1.00 0.97 H new ATOM 0 HB3 ASN A 284 50.847 5.469 10.374 1.00 0.97 H new ATOM 0 HD21 ASN A 284 54.042 4.636 12.618 1.00 1.80 H new ATOM 0 HD22 ASN A 284 53.559 6.235 12.044 1.00 1.80 H new ATOM 604 N LEU A 285 50.563 6.766 7.897 1.00 1.11 N ATOM 605 CA LEU A 285 50.107 7.872 7.011 1.00 1.24 C ATOM 606 C LEU A 285 51.017 9.086 7.206 1.00 1.25 C ATOM 607 O LEU A 285 51.289 9.826 6.281 1.00 1.27 O ATOM 608 CB LEU A 285 48.667 8.250 7.366 1.00 1.49 C ATOM 609 CG LEU A 285 47.758 7.036 7.170 1.00 2.09 C ATOM 610 CD1 LEU A 285 46.738 6.973 8.309 1.00 2.67 C ATOM 611 CD2 LEU A 285 47.021 7.163 5.835 1.00 2.83 C ATOM 0 H LEU A 285 49.880 6.452 8.586 1.00 1.11 H new ATOM 0 HA LEU A 285 50.150 7.548 5.971 1.00 1.24 H new ATOM 0 HB2 LEU A 285 48.614 8.594 8.399 1.00 1.49 H new ATOM 0 HB3 LEU A 285 48.331 9.075 6.738 1.00 1.49 H new ATOM 0 HG LEU A 285 48.360 6.127 7.170 1.00 2.09 H new ATOM 0 HD11 LEU A 285 46.090 6.108 8.170 1.00 2.67 H new ATOM 0 HD12 LEU A 285 47.261 6.885 9.261 1.00 2.67 H new ATOM 0 HD13 LEU A 285 46.136 7.881 8.309 1.00 2.67 H new ATOM 0 HD21 LEU A 285 46.373 6.298 5.694 1.00 2.83 H new ATOM 0 HD22 LEU A 285 46.419 8.072 5.837 1.00 2.83 H new ATOM 0 HD23 LEU A 285 47.746 7.210 5.022 1.00 2.83 H new ATOM 623 N LYS A 286 51.493 9.293 8.403 1.00 1.30 N ATOM 624 CA LYS A 286 52.389 10.454 8.662 1.00 1.39 C ATOM 625 C LYS A 286 53.841 10.026 8.448 1.00 1.21 C ATOM 626 O LYS A 286 54.754 10.572 9.034 1.00 1.37 O ATOM 627 CB LYS A 286 52.205 10.929 10.105 1.00 1.60 C ATOM 628 CG LYS A 286 51.083 11.967 10.161 1.00 2.10 C ATOM 629 CD LYS A 286 50.075 11.572 11.241 1.00 2.42 C ATOM 630 CE LYS A 286 49.496 12.832 11.886 1.00 3.12 C ATOM 631 NZ LYS A 286 49.374 12.626 13.357 1.00 3.73 N ATOM 0 H LYS A 286 51.299 8.706 9.215 1.00 1.30 H new ATOM 0 HA LYS A 286 52.142 11.267 7.979 1.00 1.39 H new ATOM 0 HB2 LYS A 286 51.965 10.083 10.750 1.00 1.60 H new ATOM 0 HB3 LYS A 286 53.134 11.361 10.478 1.00 1.60 H new ATOM 0 HG2 LYS A 286 51.496 12.953 10.377 1.00 2.10 H new ATOM 0 HG3 LYS A 286 50.587 12.034 9.193 1.00 2.10 H new ATOM 0 HD2 LYS A 286 49.275 10.974 10.805 1.00 2.42 H new ATOM 0 HD3 LYS A 286 50.560 10.954 11.997 1.00 2.42 H new ATOM 0 HE2 LYS A 286 50.139 13.687 11.680 1.00 3.12 H new ATOM 0 HE3 LYS A 286 48.519 13.057 11.457 1.00 3.12 H new ATOM 0 HZ1 LYS A 286 48.980 13.483 13.796 1.00 3.73 H new ATOM 0 HZ2 LYS A 286 48.743 11.820 13.544 1.00 3.73 H new ATOM 0 HZ3 LYS A 286 50.313 12.431 13.759 1.00 3.73 H new ATOM 645 N ASP A 287 54.059 9.050 7.612 1.00 0.97 N ATOM 646 CA ASP A 287 55.449 8.580 7.356 1.00 0.84 C ATOM 647 C ASP A 287 55.661 8.453 5.849 1.00 0.75 C ATOM 648 O ASP A 287 56.538 9.070 5.278 1.00 0.71 O ATOM 649 CB ASP A 287 55.653 7.216 8.019 1.00 0.77 C ATOM 650 CG ASP A 287 57.097 7.096 8.509 1.00 0.87 C ATOM 651 OD1 ASP A 287 57.960 7.710 7.903 1.00 1.42 O ATOM 652 OD2 ASP A 287 57.315 6.393 9.482 1.00 1.39 O ATOM 0 H ASP A 287 53.333 8.556 7.094 1.00 0.97 H new ATOM 0 HA ASP A 287 56.164 9.292 7.769 1.00 0.84 H new ATOM 0 HB2 ASP A 287 54.963 7.100 8.855 1.00 0.77 H new ATOM 0 HB3 ASP A 287 55.431 6.419 7.310 1.00 0.77 H new ATOM 657 N LEU A 288 54.852 7.664 5.200 1.00 0.84 N ATOM 658 CA LEU A 288 54.987 7.499 3.729 1.00 0.92 C ATOM 659 C LEU A 288 54.840 8.870 3.067 1.00 0.98 C ATOM 660 O LEU A 288 55.668 9.286 2.280 1.00 0.97 O ATOM 661 CB LEU A 288 53.885 6.549 3.237 1.00 1.15 C ATOM 662 CG LEU A 288 53.805 6.550 1.708 1.00 1.84 C ATOM 663 CD1 LEU A 288 53.045 7.791 1.237 1.00 2.70 C ATOM 664 CD2 LEU A 288 55.216 6.543 1.110 1.00 2.43 C ATOM 0 H LEU A 288 54.100 7.124 5.628 1.00 0.84 H new ATOM 0 HA LEU A 288 55.961 7.080 3.474 1.00 0.92 H new ATOM 0 HB2 LEU A 288 54.084 5.539 3.594 1.00 1.15 H new ATOM 0 HB3 LEU A 288 52.925 6.851 3.656 1.00 1.15 H new ATOM 0 HG LEU A 288 53.277 5.656 1.375 1.00 1.84 H new ATOM 0 HD11 LEU A 288 52.988 7.792 0.148 1.00 2.70 H new ATOM 0 HD12 LEU A 288 52.038 7.780 1.653 1.00 2.70 H new ATOM 0 HD13 LEU A 288 53.567 8.687 1.573 1.00 2.70 H new ATOM 0 HD21 LEU A 288 55.150 6.544 0.022 1.00 2.43 H new ATOM 0 HD22 LEU A 288 55.756 7.430 1.441 1.00 2.43 H new ATOM 0 HD23 LEU A 288 55.747 5.650 1.441 1.00 2.43 H new ATOM 676 N LYS A 289 53.792 9.579 3.384 1.00 1.12 N ATOM 677 CA LYS A 289 53.588 10.922 2.780 1.00 1.27 C ATOM 678 C LYS A 289 54.587 11.914 3.382 1.00 1.23 C ATOM 679 O LYS A 289 54.757 13.012 2.890 1.00 1.53 O ATOM 680 CB LYS A 289 52.162 11.397 3.066 1.00 1.48 C ATOM 681 CG LYS A 289 51.796 12.525 2.100 1.00 1.90 C ATOM 682 CD LYS A 289 50.275 12.690 2.060 1.00 2.35 C ATOM 683 CE LYS A 289 49.892 13.627 0.913 1.00 2.66 C ATOM 684 NZ LYS A 289 48.662 14.383 1.279 1.00 3.25 N ATOM 0 H LYS A 289 53.067 9.284 4.038 1.00 1.12 H new ATOM 0 HA LYS A 289 53.743 10.862 1.703 1.00 1.27 H new ATOM 0 HB2 LYS A 289 51.462 10.568 2.956 1.00 1.48 H new ATOM 0 HB3 LYS A 289 52.083 11.746 4.096 1.00 1.48 H new ATOM 0 HG2 LYS A 289 52.265 13.456 2.417 1.00 1.90 H new ATOM 0 HG3 LYS A 289 52.174 12.301 1.103 1.00 1.90 H new ATOM 0 HD2 LYS A 289 49.797 11.720 1.926 1.00 2.35 H new ATOM 0 HD3 LYS A 289 49.917 13.093 3.008 1.00 2.35 H new ATOM 0 HE2 LYS A 289 50.709 14.319 0.706 1.00 2.66 H new ATOM 0 HE3 LYS A 289 49.722 13.053 0.002 1.00 2.66 H new ATOM 0 HZ1 LYS A 289 48.401 15.020 0.499 1.00 3.25 H new ATOM 0 HZ2 LYS A 289 47.884 13.716 1.456 1.00 3.25 H new ATOM 0 HZ3 LYS A 289 48.841 14.942 2.138 1.00 3.25 H new ATOM 698 N ASN A 290 55.248 11.538 4.443 1.00 0.96 N ATOM 699 CA ASN A 290 56.233 12.463 5.073 1.00 1.00 C ATOM 700 C ASN A 290 57.543 12.425 4.285 1.00 0.88 C ATOM 701 O ASN A 290 58.179 13.438 4.070 1.00 0.99 O ATOM 702 CB ASN A 290 56.492 12.025 6.517 1.00 1.03 C ATOM 703 CG ASN A 290 57.412 13.038 7.201 1.00 1.51 C ATOM 704 OD1 ASN A 290 57.488 14.180 6.792 1.00 2.23 O ATOM 705 ND2 ASN A 290 58.119 12.667 8.233 1.00 1.87 N ATOM 0 H ASN A 290 55.149 10.632 4.900 1.00 0.96 H new ATOM 0 HA ASN A 290 55.835 13.478 5.067 1.00 1.00 H new ATOM 0 HB2 ASN A 290 55.550 11.949 7.060 1.00 1.03 H new ATOM 0 HB3 ASN A 290 56.949 11.035 6.532 1.00 1.03 H new ATOM 0 HD21 ASN A 290 58.735 13.335 8.696 1.00 1.87 H new ATOM 0 HD22 ASN A 290 58.056 11.709 8.577 1.00 1.87 H new ATOM 712 N ILE A 291 57.949 11.263 3.850 1.00 0.75 N ATOM 713 CA ILE A 291 59.215 11.154 3.071 1.00 0.74 C ATOM 714 C ILE A 291 59.284 12.301 2.053 1.00 0.71 C ATOM 715 O ILE A 291 58.353 12.509 1.301 1.00 0.65 O ATOM 716 CB ILE A 291 59.230 9.811 2.335 1.00 0.72 C ATOM 717 CG1 ILE A 291 59.262 8.673 3.358 1.00 0.88 C ATOM 718 CG2 ILE A 291 60.465 9.721 1.438 1.00 1.11 C ATOM 719 CD1 ILE A 291 59.223 7.328 2.628 1.00 1.62 C ATOM 0 H ILE A 291 57.457 10.382 4.001 1.00 0.75 H new ATOM 0 HA ILE A 291 60.072 11.215 3.741 1.00 0.74 H new ATOM 0 HB ILE A 291 58.334 9.729 1.720 1.00 0.72 H new ATOM 0 HG12 ILE A 291 60.164 8.742 3.967 1.00 0.88 H new ATOM 0 HG13 ILE A 291 58.413 8.755 4.036 1.00 0.88 H new ATOM 0 HG21 ILE A 291 60.468 8.763 0.918 1.00 1.11 H new ATOM 0 HG22 ILE A 291 60.444 10.530 0.708 1.00 1.11 H new ATOM 0 HG23 ILE A 291 61.365 9.806 2.048 1.00 1.11 H new ATOM 0 HD11 ILE A 291 59.246 6.518 3.357 1.00 1.62 H new ATOM 0 HD12 ILE A 291 58.309 7.260 2.039 1.00 1.62 H new ATOM 0 HD13 ILE A 291 60.087 7.247 1.968 1.00 1.62 H new ATOM 731 N PRO A 292 60.386 13.014 2.057 1.00 0.83 N ATOM 732 CA PRO A 292 60.595 14.144 1.138 1.00 0.91 C ATOM 733 C PRO A 292 60.893 13.636 -0.275 1.00 0.91 C ATOM 734 O PRO A 292 61.121 14.404 -1.188 1.00 1.05 O ATOM 735 CB PRO A 292 61.799 14.880 1.730 1.00 1.09 C ATOM 736 CG PRO A 292 62.547 13.851 2.605 1.00 1.12 C ATOM 737 CD PRO A 292 61.520 12.762 2.967 1.00 0.96 C ATOM 0 HA PRO A 292 59.721 14.789 1.046 1.00 0.91 H new ATOM 0 HB2 PRO A 292 62.446 15.264 0.942 1.00 1.09 H new ATOM 0 HB3 PRO A 292 61.478 15.736 2.324 1.00 1.09 H new ATOM 0 HG2 PRO A 292 63.392 13.424 2.066 1.00 1.12 H new ATOM 0 HG3 PRO A 292 62.947 14.322 3.503 1.00 1.12 H new ATOM 0 HD2 PRO A 292 61.932 11.763 2.823 1.00 0.96 H new ATOM 0 HD3 PRO A 292 61.216 12.833 4.011 1.00 0.96 H new ATOM 745 N GLY A 293 60.881 12.345 -0.462 1.00 0.81 N ATOM 746 CA GLY A 293 61.150 11.780 -1.814 1.00 0.89 C ATOM 747 C GLY A 293 59.991 10.864 -2.199 1.00 0.75 C ATOM 748 O GLY A 293 60.113 10.008 -3.053 1.00 0.89 O ATOM 0 H GLY A 293 60.696 11.655 0.266 1.00 0.81 H new ATOM 0 HA2 GLY A 293 61.257 12.582 -2.545 1.00 0.89 H new ATOM 0 HA3 GLY A 293 62.087 11.224 -1.812 1.00 0.89 H new ATOM 752 N ILE A 294 58.866 11.038 -1.562 1.00 0.55 N ATOM 753 CA ILE A 294 57.686 10.184 -1.866 1.00 0.49 C ATOM 754 C ILE A 294 56.560 11.061 -2.422 1.00 0.60 C ATOM 755 O ILE A 294 56.196 12.064 -1.840 1.00 1.26 O ATOM 756 CB ILE A 294 57.234 9.496 -0.572 1.00 0.54 C ATOM 757 CG1 ILE A 294 58.137 8.289 -0.302 1.00 0.88 C ATOM 758 CG2 ILE A 294 55.784 9.022 -0.693 1.00 0.64 C ATOM 759 CD1 ILE A 294 57.871 7.208 -1.350 1.00 1.37 C ATOM 0 H ILE A 294 58.714 11.741 -0.839 1.00 0.55 H new ATOM 0 HA ILE A 294 57.943 9.428 -2.608 1.00 0.49 H new ATOM 0 HB ILE A 294 57.303 10.210 0.249 1.00 0.54 H new ATOM 0 HG12 ILE A 294 59.184 8.591 -0.333 1.00 0.88 H new ATOM 0 HG13 ILE A 294 57.948 7.896 0.697 1.00 0.88 H new ATOM 0 HG21 ILE A 294 55.481 8.536 0.235 1.00 0.64 H new ATOM 0 HG22 ILE A 294 55.136 9.878 -0.883 1.00 0.64 H new ATOM 0 HG23 ILE A 294 55.700 8.314 -1.517 1.00 0.64 H new ATOM 0 HD11 ILE A 294 58.514 6.349 -1.158 1.00 1.37 H new ATOM 0 HD12 ILE A 294 56.827 6.899 -1.297 1.00 1.37 H new ATOM 0 HD13 ILE A 294 58.082 7.604 -2.343 1.00 1.37 H new ATOM 771 N GLY A 295 56.005 10.690 -3.544 1.00 0.70 N ATOM 772 CA GLY A 295 54.904 11.503 -4.135 1.00 0.80 C ATOM 773 C GLY A 295 53.696 10.605 -4.409 1.00 0.74 C ATOM 774 O GLY A 295 53.628 9.482 -3.951 1.00 0.76 O ATOM 0 H GLY A 295 56.266 9.860 -4.076 1.00 0.70 H new ATOM 0 HA2 GLY A 295 54.626 12.307 -3.454 1.00 0.80 H new ATOM 0 HA3 GLY A 295 55.240 11.971 -5.060 1.00 0.80 H new ATOM 778 N GLU A 296 52.740 11.090 -5.154 1.00 0.92 N ATOM 779 CA GLU A 296 51.538 10.264 -5.457 1.00 1.18 C ATOM 780 C GLU A 296 51.957 9.022 -6.245 1.00 1.23 C ATOM 781 O GLU A 296 51.481 7.931 -6.003 1.00 2.09 O ATOM 782 CB GLU A 296 50.550 11.086 -6.288 1.00 1.45 C ATOM 783 CG GLU A 296 49.971 12.212 -5.429 1.00 1.66 C ATOM 784 CD GLU A 296 49.008 13.052 -6.269 1.00 2.06 C ATOM 785 OE1 GLU A 296 47.944 12.551 -6.595 1.00 2.78 O ATOM 786 OE2 GLU A 296 49.350 14.183 -6.573 1.00 2.43 O ATOM 0 H GLU A 296 52.740 12.023 -5.566 1.00 0.92 H new ATOM 0 HA GLU A 296 51.063 9.959 -4.524 1.00 1.18 H new ATOM 0 HB2 GLU A 296 51.052 11.502 -7.161 1.00 1.45 H new ATOM 0 HB3 GLU A 296 49.748 10.446 -6.656 1.00 1.45 H new ATOM 0 HG2 GLU A 296 49.450 11.795 -4.567 1.00 1.66 H new ATOM 0 HG3 GLU A 296 50.775 12.839 -5.043 1.00 1.66 H new ATOM 793 N ARG A 297 52.844 9.178 -7.189 1.00 0.86 N ATOM 794 CA ARG A 297 53.293 8.006 -7.993 1.00 0.82 C ATOM 795 C ARG A 297 53.852 6.930 -7.061 1.00 0.72 C ATOM 796 O ARG A 297 53.909 5.766 -7.405 1.00 0.82 O ATOM 797 CB ARG A 297 54.382 8.448 -8.973 1.00 0.88 C ATOM 798 CG ARG A 297 54.437 7.471 -10.150 1.00 1.06 C ATOM 799 CD ARG A 297 54.188 8.228 -11.455 1.00 1.34 C ATOM 800 NE ARG A 297 53.202 7.479 -12.283 1.00 1.93 N ATOM 801 CZ ARG A 297 53.167 7.656 -13.575 1.00 2.33 C ATOM 802 NH1 ARG A 297 54.196 7.327 -14.307 1.00 3.05 N ATOM 803 NH2 ARG A 297 52.103 8.163 -14.136 1.00 2.70 N ATOM 0 H ARG A 297 53.278 10.067 -7.439 1.00 0.86 H new ATOM 0 HA ARG A 297 52.447 7.601 -8.548 1.00 0.82 H new ATOM 0 HB2 ARG A 297 54.175 9.456 -9.333 1.00 0.88 H new ATOM 0 HB3 ARG A 297 55.348 8.481 -8.469 1.00 0.88 H new ATOM 0 HG2 ARG A 297 55.409 6.979 -10.183 1.00 1.06 H new ATOM 0 HG3 ARG A 297 53.688 6.689 -10.022 1.00 1.06 H new ATOM 0 HD2 ARG A 297 53.814 9.229 -11.241 1.00 1.34 H new ATOM 0 HD3 ARG A 297 55.123 8.347 -12.003 1.00 1.34 H new ATOM 0 HE ARG A 297 52.554 6.828 -11.840 1.00 1.93 H new ATOM 0 HH11 ARG A 297 55.028 6.931 -13.869 1.00 3.05 H new ATOM 0 HH12 ARG A 297 54.168 7.465 -15.317 1.00 3.05 H new ATOM 0 HH21 ARG A 297 51.299 8.421 -13.564 1.00 2.70 H new ATOM 0 HH22 ARG A 297 52.076 8.301 -15.146 1.00 2.70 H new ATOM 817 N SER A 298 54.267 7.308 -5.883 1.00 0.70 N ATOM 818 CA SER A 298 54.824 6.304 -4.932 1.00 0.64 C ATOM 819 C SER A 298 53.695 5.735 -4.070 1.00 0.61 C ATOM 820 O SER A 298 53.533 4.537 -3.954 1.00 0.63 O ATOM 821 CB SER A 298 55.863 6.975 -4.033 1.00 0.73 C ATOM 822 OG SER A 298 56.930 7.466 -4.835 1.00 1.48 O ATOM 0 H SER A 298 54.245 8.268 -5.538 1.00 0.70 H new ATOM 0 HA SER A 298 55.295 5.496 -5.492 1.00 0.64 H new ATOM 0 HB2 SER A 298 55.405 7.792 -3.476 1.00 0.73 H new ATOM 0 HB3 SER A 298 56.241 6.262 -3.300 1.00 0.73 H new ATOM 0 HG SER A 298 57.421 8.155 -4.340 1.00 1.48 H new ATOM 828 N LEU A 299 52.913 6.586 -3.463 1.00 0.66 N ATOM 829 CA LEU A 299 51.797 6.091 -2.608 1.00 0.71 C ATOM 830 C LEU A 299 50.976 5.061 -3.386 1.00 0.66 C ATOM 831 O LEU A 299 50.490 4.095 -2.833 1.00 0.67 O ATOM 832 CB LEU A 299 50.900 7.266 -2.212 1.00 0.86 C ATOM 833 CG LEU A 299 49.941 6.826 -1.104 1.00 1.41 C ATOM 834 CD1 LEU A 299 49.543 8.039 -0.261 1.00 1.87 C ATOM 835 CD2 LEU A 299 48.689 6.209 -1.730 1.00 2.17 C ATOM 0 H LEU A 299 52.999 7.601 -3.522 1.00 0.66 H new ATOM 0 HA LEU A 299 52.205 5.626 -1.710 1.00 0.71 H new ATOM 0 HB2 LEU A 299 51.509 8.103 -1.869 1.00 0.86 H new ATOM 0 HB3 LEU A 299 50.337 7.615 -3.077 1.00 0.86 H new ATOM 0 HG LEU A 299 50.433 6.089 -0.470 1.00 1.41 H new ATOM 0 HD11 LEU A 299 48.860 7.725 0.528 1.00 1.87 H new ATOM 0 HD12 LEU A 299 50.434 8.480 0.185 1.00 1.87 H new ATOM 0 HD13 LEU A 299 49.051 8.777 -0.895 1.00 1.87 H new ATOM 0 HD21 LEU A 299 48.005 5.895 -0.942 1.00 2.17 H new ATOM 0 HD22 LEU A 299 48.198 6.947 -2.364 1.00 2.17 H new ATOM 0 HD23 LEU A 299 48.971 5.345 -2.331 1.00 2.17 H new ATOM 847 N GLU A 300 50.816 5.260 -4.666 1.00 0.71 N ATOM 848 CA GLU A 300 50.025 4.294 -5.478 1.00 0.75 C ATOM 849 C GLU A 300 50.671 2.908 -5.402 1.00 0.66 C ATOM 850 O GLU A 300 50.112 1.979 -4.849 1.00 0.71 O ATOM 851 CB GLU A 300 49.991 4.761 -6.935 1.00 0.84 C ATOM 852 CG GLU A 300 48.653 5.443 -7.223 1.00 1.33 C ATOM 853 CD GLU A 300 48.572 5.803 -8.708 1.00 1.75 C ATOM 854 OE1 GLU A 300 48.500 4.891 -9.515 1.00 2.03 O ATOM 855 OE2 GLU A 300 48.585 6.985 -9.012 1.00 2.48 O ATOM 0 H GLU A 300 51.199 6.050 -5.184 1.00 0.71 H new ATOM 0 HA GLU A 300 49.009 4.241 -5.088 1.00 0.75 H new ATOM 0 HB2 GLU A 300 50.812 5.453 -7.125 1.00 0.84 H new ATOM 0 HB3 GLU A 300 50.129 3.911 -7.603 1.00 0.84 H new ATOM 0 HG2 GLU A 300 47.830 4.781 -6.953 1.00 1.33 H new ATOM 0 HG3 GLU A 300 48.552 6.342 -6.614 1.00 1.33 H new ATOM 862 N GLU A 301 51.844 2.759 -5.955 1.00 0.70 N ATOM 863 CA GLU A 301 52.522 1.434 -5.918 1.00 0.73 C ATOM 864 C GLU A 301 52.455 0.867 -4.498 1.00 0.66 C ATOM 865 O GLU A 301 52.015 -0.246 -4.291 1.00 0.64 O ATOM 866 CB GLU A 301 53.982 1.594 -6.346 1.00 0.92 C ATOM 867 CG GLU A 301 54.098 1.330 -7.849 1.00 1.49 C ATOM 868 CD GLU A 301 53.673 2.580 -8.621 1.00 1.78 C ATOM 869 OE1 GLU A 301 54.395 3.562 -8.563 1.00 2.45 O ATOM 870 OE2 GLU A 301 52.633 2.534 -9.258 1.00 2.19 O ATOM 0 H GLU A 301 52.361 3.498 -6.431 1.00 0.70 H new ATOM 0 HA GLU A 301 52.022 0.749 -6.602 1.00 0.73 H new ATOM 0 HB2 GLU A 301 54.334 2.599 -6.113 1.00 0.92 H new ATOM 0 HB3 GLU A 301 54.614 0.899 -5.793 1.00 0.92 H new ATOM 0 HG2 GLU A 301 55.124 1.063 -8.104 1.00 1.49 H new ATOM 0 HG3 GLU A 301 53.470 0.485 -8.130 1.00 1.49 H new ATOM 877 N ILE A 302 52.877 1.623 -3.519 1.00 0.70 N ATOM 878 CA ILE A 302 52.819 1.124 -2.113 1.00 0.73 C ATOM 879 C ILE A 302 51.472 0.440 -1.893 1.00 0.66 C ATOM 880 O ILE A 302 51.394 -0.730 -1.572 1.00 0.67 O ATOM 881 CB ILE A 302 52.951 2.304 -1.149 1.00 0.87 C ATOM 882 CG1 ILE A 302 54.400 2.782 -1.135 1.00 0.91 C ATOM 883 CG2 ILE A 302 52.545 1.868 0.261 1.00 0.96 C ATOM 884 CD1 ILE A 302 54.495 4.111 -0.384 1.00 0.96 C ATOM 0 H ILE A 302 53.259 2.562 -3.631 1.00 0.70 H new ATOM 0 HA ILE A 302 53.631 0.419 -1.934 1.00 0.73 H new ATOM 0 HB ILE A 302 52.299 3.114 -1.476 1.00 0.87 H new ATOM 0 HG12 ILE A 302 55.035 2.036 -0.657 1.00 0.91 H new ATOM 0 HG13 ILE A 302 54.764 2.903 -2.155 1.00 0.91 H new ATOM 0 HG21 ILE A 302 52.641 2.712 0.944 1.00 0.96 H new ATOM 0 HG22 ILE A 302 51.511 1.524 0.252 1.00 0.96 H new ATOM 0 HG23 ILE A 302 53.194 1.057 0.592 1.00 0.96 H new ATOM 0 HD11 ILE A 302 55.531 4.451 -0.375 1.00 0.96 H new ATOM 0 HD12 ILE A 302 53.873 4.855 -0.882 1.00 0.96 H new ATOM 0 HD13 ILE A 302 54.149 3.975 0.641 1.00 0.96 H new ATOM 896 N LYS A 303 50.408 1.169 -2.074 1.00 0.67 N ATOM 897 CA LYS A 303 49.056 0.575 -1.892 1.00 0.74 C ATOM 898 C LYS A 303 49.002 -0.768 -2.620 1.00 0.71 C ATOM 899 O LYS A 303 48.673 -1.786 -2.042 1.00 0.84 O ATOM 900 CB LYS A 303 48.000 1.517 -2.476 1.00 0.88 C ATOM 901 CG LYS A 303 46.644 0.811 -2.505 1.00 1.33 C ATOM 902 CD LYS A 303 45.527 1.842 -2.328 1.00 1.62 C ATOM 903 CE LYS A 303 45.539 2.815 -3.508 1.00 1.52 C ATOM 904 NZ LYS A 303 44.445 3.813 -3.341 1.00 1.85 N ATOM 0 H LYS A 303 50.416 2.153 -2.341 1.00 0.67 H new ATOM 0 HA LYS A 303 48.857 0.428 -0.830 1.00 0.74 H new ATOM 0 HB2 LYS A 303 47.936 2.425 -1.876 1.00 0.88 H new ATOM 0 HB3 LYS A 303 48.285 1.820 -3.483 1.00 0.88 H new ATOM 0 HG2 LYS A 303 46.518 0.281 -3.449 1.00 1.33 H new ATOM 0 HG3 LYS A 303 46.594 0.065 -1.712 1.00 1.33 H new ATOM 0 HD2 LYS A 303 44.561 1.340 -2.266 1.00 1.62 H new ATOM 0 HD3 LYS A 303 45.664 2.386 -1.393 1.00 1.62 H new ATOM 0 HE2 LYS A 303 46.502 3.322 -3.565 1.00 1.52 H new ATOM 0 HE3 LYS A 303 45.409 2.271 -4.443 1.00 1.52 H new ATOM 0 HZ1 LYS A 303 44.453 4.475 -4.143 1.00 1.85 H new ATOM 0 HZ2 LYS A 303 43.529 3.322 -3.307 1.00 1.85 H new ATOM 0 HZ3 LYS A 303 44.588 4.340 -2.456 1.00 1.85 H new ATOM 918 N GLU A 304 49.332 -0.782 -3.884 1.00 0.65 N ATOM 919 CA GLU A 304 49.308 -2.065 -4.641 1.00 0.73 C ATOM 920 C GLU A 304 49.968 -3.150 -3.791 1.00 0.68 C ATOM 921 O GLU A 304 49.478 -4.257 -3.687 1.00 0.83 O ATOM 922 CB GLU A 304 50.077 -1.902 -5.954 1.00 0.81 C ATOM 923 CG GLU A 304 49.093 -1.608 -7.088 1.00 1.15 C ATOM 924 CD GLU A 304 49.786 -1.818 -8.435 1.00 1.50 C ATOM 925 OE1 GLU A 304 50.700 -2.625 -8.490 1.00 2.24 O ATOM 926 OE2 GLU A 304 49.392 -1.169 -9.390 1.00 1.90 O ATOM 0 H GLU A 304 49.616 0.037 -4.422 1.00 0.65 H new ATOM 0 HA GLU A 304 48.278 -2.344 -4.865 1.00 0.73 H new ATOM 0 HB2 GLU A 304 50.800 -1.091 -5.866 1.00 0.81 H new ATOM 0 HB3 GLU A 304 50.640 -2.809 -6.173 1.00 0.81 H new ATOM 0 HG2 GLU A 304 48.225 -2.262 -7.008 1.00 1.15 H new ATOM 0 HG3 GLU A 304 48.729 -0.584 -7.011 1.00 1.15 H new ATOM 933 N ALA A 305 51.075 -2.835 -3.175 1.00 0.72 N ATOM 934 CA ALA A 305 51.765 -3.838 -2.321 1.00 0.80 C ATOM 935 C ALA A 305 50.831 -4.248 -1.181 1.00 0.72 C ATOM 936 O ALA A 305 50.637 -5.418 -0.916 1.00 0.72 O ATOM 937 CB ALA A 305 53.043 -3.227 -1.743 1.00 1.04 C ATOM 0 H ALA A 305 51.531 -1.924 -3.228 1.00 0.72 H new ATOM 0 HA ALA A 305 52.025 -4.713 -2.917 1.00 0.80 H new ATOM 0 HB1 ALA A 305 53.548 -3.963 -1.117 1.00 1.04 H new ATOM 0 HB2 ALA A 305 53.704 -2.928 -2.557 1.00 1.04 H new ATOM 0 HB3 ALA A 305 52.789 -2.353 -1.142 1.00 1.04 H new ATOM 943 N LEU A 306 50.239 -3.294 -0.510 1.00 0.78 N ATOM 944 CA LEU A 306 49.309 -3.644 0.601 1.00 0.92 C ATOM 945 C LEU A 306 48.105 -4.379 0.015 1.00 0.92 C ATOM 946 O LEU A 306 47.326 -4.985 0.722 1.00 1.05 O ATOM 947 CB LEU A 306 48.831 -2.377 1.314 1.00 1.11 C ATOM 948 CG LEU A 306 49.958 -1.817 2.179 1.00 1.26 C ATOM 949 CD1 LEU A 306 51.199 -1.590 1.316 1.00 1.31 C ATOM 950 CD2 LEU A 306 49.516 -0.489 2.795 1.00 1.69 C ATOM 0 H LEU A 306 50.359 -2.296 -0.682 1.00 0.78 H new ATOM 0 HA LEU A 306 49.827 -4.276 1.322 1.00 0.92 H new ATOM 0 HB2 LEU A 306 48.517 -1.633 0.582 1.00 1.11 H new ATOM 0 HB3 LEU A 306 47.962 -2.602 1.933 1.00 1.11 H new ATOM 0 HG LEU A 306 50.193 -2.526 2.973 1.00 1.26 H new ATOM 0 HD11 LEU A 306 52.003 -1.190 1.933 1.00 1.31 H new ATOM 0 HD12 LEU A 306 51.515 -2.536 0.877 1.00 1.31 H new ATOM 0 HD13 LEU A 306 50.965 -0.881 0.522 1.00 1.31 H new ATOM 0 HD21 LEU A 306 50.320 -0.089 3.413 1.00 1.69 H new ATOM 0 HD22 LEU A 306 49.281 0.220 2.001 1.00 1.69 H new ATOM 0 HD23 LEU A 306 48.631 -0.650 3.411 1.00 1.69 H new ATOM 962 N GLU A 307 47.952 -4.336 -1.279 1.00 0.98 N ATOM 963 CA GLU A 307 46.812 -5.044 -1.917 1.00 1.21 C ATOM 964 C GLU A 307 47.228 -6.492 -2.169 1.00 1.18 C ATOM 965 O GLU A 307 46.411 -7.390 -2.214 1.00 1.37 O ATOM 966 CB GLU A 307 46.463 -4.368 -3.245 1.00 1.42 C ATOM 967 CG GLU A 307 45.326 -3.369 -3.025 1.00 1.83 C ATOM 968 CD GLU A 307 45.230 -2.432 -4.231 1.00 2.47 C ATOM 969 OE1 GLU A 307 46.073 -1.558 -4.346 1.00 2.97 O ATOM 970 OE2 GLU A 307 44.314 -2.605 -5.018 1.00 3.06 O ATOM 0 H GLU A 307 48.569 -3.840 -1.922 1.00 0.98 H new ATOM 0 HA GLU A 307 45.938 -5.012 -1.267 1.00 1.21 H new ATOM 0 HB2 GLU A 307 47.338 -3.857 -3.646 1.00 1.42 H new ATOM 0 HB3 GLU A 307 46.167 -5.117 -3.980 1.00 1.42 H new ATOM 0 HG2 GLU A 307 44.384 -3.899 -2.887 1.00 1.83 H new ATOM 0 HG3 GLU A 307 45.504 -2.793 -2.117 1.00 1.83 H new ATOM 977 N LYS A 308 48.505 -6.723 -2.328 1.00 1.03 N ATOM 978 CA LYS A 308 48.992 -8.103 -2.569 1.00 1.14 C ATOM 979 C LYS A 308 49.137 -8.826 -1.231 1.00 1.10 C ATOM 980 O LYS A 308 48.893 -10.012 -1.124 1.00 1.30 O ATOM 981 CB LYS A 308 50.350 -8.053 -3.275 1.00 1.24 C ATOM 982 CG LYS A 308 50.154 -7.624 -4.730 1.00 1.43 C ATOM 983 CD LYS A 308 50.959 -8.548 -5.647 1.00 1.60 C ATOM 984 CE LYS A 308 51.465 -7.757 -6.854 1.00 1.69 C ATOM 985 NZ LYS A 308 51.458 -8.632 -8.061 1.00 2.12 N ATOM 0 H LYS A 308 49.231 -6.007 -2.300 1.00 1.03 H new ATOM 0 HA LYS A 308 48.280 -8.637 -3.198 1.00 1.14 H new ATOM 0 HB2 LYS A 308 51.011 -7.353 -2.764 1.00 1.24 H new ATOM 0 HB3 LYS A 308 50.829 -9.031 -3.235 1.00 1.24 H new ATOM 0 HG2 LYS A 308 49.097 -7.664 -4.993 1.00 1.43 H new ATOM 0 HG3 LYS A 308 50.477 -6.591 -4.863 1.00 1.43 H new ATOM 0 HD2 LYS A 308 51.800 -8.976 -5.101 1.00 1.60 H new ATOM 0 HD3 LYS A 308 50.337 -9.380 -5.979 1.00 1.60 H new ATOM 0 HE2 LYS A 308 50.834 -6.884 -7.021 1.00 1.69 H new ATOM 0 HE3 LYS A 308 52.473 -7.389 -6.664 1.00 1.69 H new ATOM 0 HZ1 LYS A 308 51.802 -8.094 -8.882 1.00 2.12 H new ATOM 0 HZ2 LYS A 308 52.078 -9.451 -7.899 1.00 2.12 H new ATOM 0 HZ3 LYS A 308 50.489 -8.962 -8.245 1.00 2.12 H new ATOM 999 N LYS A 309 49.523 -8.118 -0.205 1.00 0.97 N ATOM 1000 CA LYS A 309 49.672 -8.764 1.129 1.00 1.10 C ATOM 1001 C LYS A 309 48.426 -8.459 1.962 1.00 1.40 C ATOM 1002 O LYS A 309 47.861 -9.326 2.598 1.00 1.82 O ATOM 1003 CB LYS A 309 50.914 -8.206 1.827 1.00 1.16 C ATOM 1004 CG LYS A 309 52.169 -8.753 1.143 1.00 1.91 C ATOM 1005 CD LYS A 309 52.529 -7.865 -0.049 1.00 2.65 C ATOM 1006 CE LYS A 309 53.875 -8.308 -0.625 1.00 3.58 C ATOM 1007 NZ LYS A 309 53.695 -8.723 -2.045 1.00 4.49 N ATOM 0 H LYS A 309 49.741 -7.122 -0.233 1.00 0.97 H new ATOM 0 HA LYS A 309 49.783 -9.842 1.015 1.00 1.10 H new ATOM 0 HB2 LYS A 309 50.909 -7.117 1.786 1.00 1.16 H new ATOM 0 HB3 LYS A 309 50.909 -8.485 2.881 1.00 1.16 H new ATOM 0 HG2 LYS A 309 52.998 -8.784 1.851 1.00 1.91 H new ATOM 0 HG3 LYS A 309 51.997 -9.776 0.809 1.00 1.91 H new ATOM 0 HD2 LYS A 309 51.754 -7.932 -0.813 1.00 2.65 H new ATOM 0 HD3 LYS A 309 52.580 -6.822 0.263 1.00 2.65 H new ATOM 0 HE2 LYS A 309 54.596 -7.493 -0.562 1.00 3.58 H new ATOM 0 HE3 LYS A 309 54.278 -9.136 -0.041 1.00 3.58 H new ATOM 0 HZ1 LYS A 309 54.552 -8.491 -2.586 1.00 4.49 H new ATOM 0 HZ2 LYS A 309 53.525 -9.748 -2.088 1.00 4.49 H new ATOM 0 HZ3 LYS A 309 52.881 -8.220 -2.453 1.00 4.49 H new ATOM 1021 N GLY A 310 47.985 -7.233 1.940 1.00 1.56 N ATOM 1022 CA GLY A 310 46.759 -6.860 2.705 1.00 2.18 C ATOM 1023 C GLY A 310 47.112 -6.499 4.150 1.00 2.05 C ATOM 1024 O GLY A 310 46.333 -6.721 5.056 1.00 2.74 O ATOM 0 H GLY A 310 48.421 -6.469 1.424 1.00 1.56 H new ATOM 0 HA2 GLY A 310 46.267 -6.015 2.224 1.00 2.18 H new ATOM 0 HA3 GLY A 310 46.051 -7.689 2.694 1.00 2.18 H new ATOM 1028 N PHE A 311 48.269 -5.941 4.384 1.00 1.50 N ATOM 1029 CA PHE A 311 48.631 -5.574 5.783 1.00 1.62 C ATOM 1030 C PHE A 311 48.185 -4.140 6.078 1.00 1.58 C ATOM 1031 O PHE A 311 47.896 -3.371 5.183 1.00 1.92 O ATOM 1032 CB PHE A 311 50.141 -5.704 5.993 1.00 1.75 C ATOM 1033 CG PHE A 311 50.895 -4.888 4.973 1.00 1.40 C ATOM 1034 CD1 PHE A 311 51.205 -5.443 3.728 1.00 1.74 C ATOM 1035 CD2 PHE A 311 51.308 -3.587 5.282 1.00 2.19 C ATOM 1036 CE1 PHE A 311 51.923 -4.696 2.788 1.00 2.40 C ATOM 1037 CE2 PHE A 311 52.031 -2.841 4.345 1.00 2.80 C ATOM 1038 CZ PHE A 311 52.338 -3.396 3.097 1.00 2.79 C ATOM 0 H PHE A 311 48.972 -5.725 3.677 1.00 1.50 H new ATOM 0 HA PHE A 311 48.123 -6.254 6.466 1.00 1.62 H new ATOM 0 HB2 PHE A 311 50.403 -5.371 6.997 1.00 1.75 H new ATOM 0 HB3 PHE A 311 50.435 -6.751 5.917 1.00 1.75 H new ATOM 0 HD1 PHE A 311 50.890 -6.449 3.492 1.00 1.74 H new ATOM 0 HD2 PHE A 311 51.068 -3.159 6.244 1.00 2.19 H new ATOM 0 HE1 PHE A 311 52.157 -5.123 1.824 1.00 2.40 H new ATOM 0 HE2 PHE A 311 52.352 -1.838 4.584 1.00 2.80 H new ATOM 0 HZ PHE A 311 52.895 -2.821 2.373 1.00 2.79 H new ATOM 1048 N THR A 312 48.120 -3.781 7.332 1.00 1.86 N ATOM 1049 CA THR A 312 47.685 -2.403 7.698 1.00 2.19 C ATOM 1050 C THR A 312 48.891 -1.587 8.159 1.00 1.89 C ATOM 1051 O THR A 312 49.969 -1.699 7.610 1.00 2.04 O ATOM 1052 CB THR A 312 46.651 -2.485 8.825 1.00 3.35 C ATOM 1053 OG1 THR A 312 47.320 -2.657 10.066 1.00 4.13 O ATOM 1054 CG2 THR A 312 45.715 -3.668 8.578 1.00 3.81 C ATOM 0 H THR A 312 48.350 -4.385 8.121 1.00 1.86 H new ATOM 0 HA THR A 312 47.240 -1.917 6.830 1.00 2.19 H new ATOM 0 HB THR A 312 46.067 -1.565 8.851 1.00 3.35 H new ATOM 0 HG1 THR A 312 46.962 -2.023 10.722 1.00 4.13 H new ATOM 0 HG21 THR A 312 44.980 -3.724 9.381 1.00 3.81 H new ATOM 0 HG22 THR A 312 45.202 -3.534 7.626 1.00 3.81 H new ATOM 0 HG23 THR A 312 46.294 -4.591 8.551 1.00 3.81 H new ATOM 1062 N LEU A 313 48.714 -0.750 9.147 1.00 2.08 N ATOM 1063 CA LEU A 313 49.845 0.090 9.625 1.00 1.88 C ATOM 1064 C LEU A 313 50.029 1.265 8.662 1.00 1.46 C ATOM 1065 O LEU A 313 50.852 2.132 8.877 1.00 1.68 O ATOM 1066 CB LEU A 313 51.127 -0.745 9.671 1.00 2.53 C ATOM 1067 CG LEU A 313 51.821 -0.541 11.018 1.00 3.15 C ATOM 1068 CD1 LEU A 313 52.290 0.910 11.137 1.00 3.49 C ATOM 1069 CD2 LEU A 313 50.839 -0.853 12.150 1.00 3.91 C ATOM 0 H LEU A 313 47.833 -0.613 9.643 1.00 2.08 H new ATOM 0 HA LEU A 313 49.630 0.462 10.627 1.00 1.88 H new ATOM 0 HB2 LEU A 313 50.892 -1.800 9.527 1.00 2.53 H new ATOM 0 HB3 LEU A 313 51.793 -0.453 8.859 1.00 2.53 H new ATOM 0 HG LEU A 313 52.681 -1.207 11.087 1.00 3.15 H new ATOM 0 HD11 LEU A 313 52.785 1.055 12.097 1.00 3.49 H new ATOM 0 HD12 LEU A 313 52.989 1.134 10.331 1.00 3.49 H new ATOM 0 HD13 LEU A 313 51.431 1.577 11.067 1.00 3.49 H new ATOM 0 HD21 LEU A 313 51.333 -0.708 13.111 1.00 3.91 H new ATOM 0 HD22 LEU A 313 49.979 -0.187 12.080 1.00 3.91 H new ATOM 0 HD23 LEU A 313 50.504 -1.887 12.067 1.00 3.91 H new ATOM 1081 N LYS A 314 49.264 1.303 7.600 1.00 1.62 N ATOM 1082 CA LYS A 314 49.395 2.426 6.629 1.00 2.48 C ATOM 1083 C LYS A 314 48.044 2.677 5.957 1.00 3.25 C ATOM 1084 O LYS A 314 47.960 2.865 4.760 1.00 3.56 O ATOM 1085 CB LYS A 314 50.434 2.065 5.566 1.00 2.95 C ATOM 1086 CG LYS A 314 50.788 3.313 4.754 1.00 4.02 C ATOM 1087 CD LYS A 314 51.178 2.905 3.332 1.00 4.83 C ATOM 1088 CE LYS A 314 50.761 4.003 2.352 1.00 5.85 C ATOM 1089 NZ LYS A 314 49.442 3.656 1.750 1.00 6.70 N ATOM 0 H LYS A 314 48.557 0.606 7.366 1.00 1.62 H new ATOM 0 HA LYS A 314 49.713 3.326 7.155 1.00 2.48 H new ATOM 0 HB2 LYS A 314 51.329 1.660 6.039 1.00 2.95 H new ATOM 0 HB3 LYS A 314 50.042 1.289 4.908 1.00 2.95 H new ATOM 0 HG2 LYS A 314 49.938 3.995 4.728 1.00 4.02 H new ATOM 0 HG3 LYS A 314 51.611 3.847 5.229 1.00 4.02 H new ATOM 0 HD2 LYS A 314 52.254 2.739 3.272 1.00 4.83 H new ATOM 0 HD3 LYS A 314 50.695 1.964 3.067 1.00 4.83 H new ATOM 0 HE2 LYS A 314 50.697 4.961 2.868 1.00 5.85 H new ATOM 0 HE3 LYS A 314 51.512 4.112 1.570 1.00 5.85 H new ATOM 0 HZ1 LYS A 314 49.158 4.402 1.083 1.00 6.70 H new ATOM 0 HZ2 LYS A 314 49.519 2.751 1.244 1.00 6.70 H new ATOM 0 HZ3 LYS A 314 48.728 3.573 2.502 1.00 6.70 H new ATOM 1103 N GLU A 315 46.984 2.681 6.719 1.00 3.96 N ATOM 1104 CA GLU A 315 45.639 2.919 6.124 1.00 4.99 C ATOM 1105 C GLU A 315 44.680 3.411 7.210 1.00 5.94 C ATOM 1106 O GLU A 315 44.356 4.587 7.198 1.00 6.48 O ATOM 1107 CB GLU A 315 45.107 1.614 5.527 1.00 5.33 C ATOM 1108 CG GLU A 315 45.773 1.362 4.173 1.00 5.80 C ATOM 1109 CD GLU A 315 45.066 0.207 3.462 1.00 6.15 C ATOM 1110 OE1 GLU A 315 44.314 -0.495 4.119 1.00 6.17 O ATOM 1111 OE2 GLU A 315 45.287 0.044 2.274 1.00 6.67 O ATOM 1112 OXT GLU A 315 44.287 2.604 8.035 1.00 6.36 O ATOM 0 H GLU A 315 46.992 2.530 7.728 1.00 3.96 H new ATOM 0 HA GLU A 315 45.717 3.672 5.340 1.00 4.99 H new ATOM 0 HB2 GLU A 315 45.309 0.784 6.203 1.00 5.33 H new ATOM 0 HB3 GLU A 315 44.025 1.671 5.407 1.00 5.33 H new ATOM 0 HG2 GLU A 315 45.727 2.262 3.560 1.00 5.80 H new ATOM 0 HG3 GLU A 315 46.828 1.125 4.313 1.00 5.80 H new TER 1119 GLU A 315 END