USER MOD reduce.3.24.130724 H: found=0, std=0, add=556, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 555 hydrogens (0 hets) 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 305 GLN : amide:sc= -2.91! C(o=-2.9!,f=-5.5!) USER MOD Set 1.2: A 306 THR OG1 : rot 180:sc=-0.00261 USER MOD Set 2.1: A 290 SER OG : rot 180:sc=-0.00693 USER MOD Set 2.2: A 294 MET CE :methyl 148:sc= -0.0145 (180deg=-1.56!) USER MOD Single : A 293 THR OG1 : rot -140:sc= -0.374 USER MOD Single : A 295 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 301 THR OG1 : rot 180:sc= -0.0232 USER MOD Single : A 310 HIS : no HE2:sc= -1.41 K(o=-1.4,f=-5.3!) USER MOD Single : A 311 LYS NZ :NH3+ -112:sc= -0.807 (180deg=-1.63!) USER MOD Single : A 312 CYS SG : rot 35:sc= -3.48! USER MOD Single : A 313 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 318 TYR OH : rot 180:sc= 0 USER MOD Single : A 321 LYS NZ :NH3+ -148:sc= -0.216 (180deg=-1.03) USER MOD Single : A 323 SER OG : rot 180:sc= 0 USER MOD Single : A 325 THR OG1 : rot 180:sc= 0 USER MOD Single : A 330 THR OG1 : rot 180:sc= 0 USER MOD Single : A 331 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 334 HIS : no HD1:sc= -0.238 X(o=-0.24,f=-0.6) USER MOD Single : A 336 LYS NZ :NH3+ 160:sc= -0.0296 (180deg=-0.667) USER MOD Single : A 337 THR OG1 : rot 180:sc= 0 USER MOD Single : A 338 LYS NZ :NH3+ -168:sc= -0.0238 (180deg=-0.316) USER MOD Single : A 340 THR OG1 : rot 180:sc= 0 USER MOD Single : A 341 GLN :FLIP amide:sc= -0.207 F(o=-1.9,f=-0.21) USER MOD Single : A 342 TYR OH : rot 30:sc= 0 USER MOD Single : A 344 SER OG : rot 180:sc= 0 USER MOD Single : A 345 THR OG1 : rot -27:sc= 0.445 USER MOD Single : A 346 ASN :FLIP amide:sc= -1.22 F(o=-6.3!,f=-1.2) USER MOD Single : A 350 GLN :FLIP amide:sc= 0 F(o=-1.4,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N PHE A 289 -19.461 2.592 3.212 1.00 0.00 N ATOM 2 CA PHE A 289 -18.092 2.179 2.798 1.00 0.00 C ATOM 3 C PHE A 289 -17.805 2.716 1.394 1.00 0.00 C ATOM 4 O PHE A 289 -16.888 2.284 0.725 1.00 0.00 O ATOM 5 CB PHE A 289 -18.009 0.651 2.765 1.00 0.00 C ATOM 6 CG PHE A 289 -18.749 0.078 3.947 1.00 0.00 C ATOM 7 CD1 PHE A 289 -18.128 0.012 5.197 1.00 0.00 C ATOM 8 CD2 PHE A 289 -20.059 -0.388 3.788 1.00 0.00 C ATOM 9 CE1 PHE A 289 -18.817 -0.522 6.293 1.00 0.00 C ATOM 10 CE2 PHE A 289 -20.750 -0.922 4.883 1.00 0.00 C ATOM 11 CZ PHE A 289 -20.128 -0.989 6.135 1.00 0.00 C ATOM 0 HA PHE A 289 -17.365 2.576 3.507 1.00 0.00 H new ATOM 0 HB2 PHE A 289 -18.438 0.274 1.837 1.00 0.00 H new ATOM 0 HB3 PHE A 289 -16.967 0.333 2.787 1.00 0.00 H new ATOM 0 HD1 PHE A 289 -17.117 0.373 5.318 1.00 0.00 H new ATOM 0 HD2 PHE A 289 -20.537 -0.336 2.821 1.00 0.00 H new ATOM 0 HE1 PHE A 289 -18.338 -0.574 7.259 1.00 0.00 H new ATOM 0 HE2 PHE A 289 -21.761 -1.281 4.761 1.00 0.00 H new ATOM 0 HZ PHE A 289 -20.659 -1.401 6.980 1.00 0.00 H new ATOM 21 N SER A 290 -18.608 3.627 0.929 1.00 0.00 N ATOM 22 CA SER A 290 -18.420 4.174 -0.446 1.00 0.00 C ATOM 23 C SER A 290 -17.571 5.450 -0.424 1.00 0.00 C ATOM 24 O SER A 290 -16.709 5.636 -1.261 1.00 0.00 O ATOM 25 CB SER A 290 -19.804 4.454 -1.065 1.00 0.00 C ATOM 26 OG SER A 290 -19.945 3.685 -2.252 1.00 0.00 O ATOM 0 H SER A 290 -19.395 4.022 1.445 1.00 0.00 H new ATOM 0 HA SER A 290 -17.888 3.441 -1.052 1.00 0.00 H new ATOM 0 HB2 SER A 290 -20.592 4.200 -0.356 1.00 0.00 H new ATOM 0 HB3 SER A 290 -19.908 5.516 -1.290 1.00 0.00 H new ATOM 0 HG SER A 290 -20.824 3.857 -2.650 1.00 0.00 H new ATOM 32 N PRO A 291 -17.829 6.332 0.495 1.00 0.00 N ATOM 33 CA PRO A 291 -17.099 7.614 0.590 1.00 0.00 C ATOM 34 C PRO A 291 -15.816 7.533 1.424 1.00 0.00 C ATOM 35 O PRO A 291 -14.793 8.043 1.032 1.00 0.00 O ATOM 36 CB PRO A 291 -18.130 8.545 1.238 1.00 0.00 C ATOM 37 CG PRO A 291 -18.991 7.650 2.090 1.00 0.00 C ATOM 38 CD PRO A 291 -18.841 6.211 1.548 1.00 0.00 C ATOM 0 HA PRO A 291 -16.744 7.951 -0.384 1.00 0.00 H new ATOM 0 HB2 PRO A 291 -17.644 9.313 1.840 1.00 0.00 H new ATOM 0 HB3 PRO A 291 -18.724 9.061 0.483 1.00 0.00 H new ATOM 0 HG2 PRO A 291 -18.682 7.701 3.134 1.00 0.00 H new ATOM 0 HG3 PRO A 291 -20.033 7.968 2.050 1.00 0.00 H new ATOM 0 HD2 PRO A 291 -18.523 5.521 2.330 1.00 0.00 H new ATOM 0 HD3 PRO A 291 -19.784 5.833 1.154 1.00 0.00 H new ATOM 46 N GLU A 292 -15.861 6.932 2.580 1.00 0.00 N ATOM 47 CA GLU A 292 -14.626 6.861 3.432 1.00 0.00 C ATOM 48 C GLU A 292 -13.809 5.590 3.132 1.00 0.00 C ATOM 49 O GLU A 292 -12.634 5.647 2.818 1.00 0.00 O ATOM 50 CB GLU A 292 -15.037 6.888 4.920 1.00 0.00 C ATOM 51 CG GLU A 292 -16.430 6.264 5.094 1.00 0.00 C ATOM 52 CD GLU A 292 -16.628 5.830 6.550 1.00 0.00 C ATOM 53 OE1 GLU A 292 -16.074 4.811 6.923 1.00 0.00 O ATOM 54 OE2 GLU A 292 -17.329 6.527 7.265 1.00 0.00 O ATOM 0 H GLU A 292 -16.690 6.488 2.975 1.00 0.00 H new ATOM 0 HA GLU A 292 -13.995 7.720 3.204 1.00 0.00 H new ATOM 0 HB2 GLU A 292 -14.308 6.340 5.517 1.00 0.00 H new ATOM 0 HB3 GLU A 292 -15.042 7.915 5.286 1.00 0.00 H new ATOM 0 HG2 GLU A 292 -17.198 6.984 4.812 1.00 0.00 H new ATOM 0 HG3 GLU A 292 -16.539 5.405 4.431 1.00 0.00 H new ATOM 61 N THR A 293 -14.416 4.449 3.276 1.00 0.00 N ATOM 62 CA THR A 293 -13.693 3.162 3.058 1.00 0.00 C ATOM 63 C THR A 293 -13.158 3.041 1.637 1.00 0.00 C ATOM 64 O THR A 293 -12.000 2.743 1.423 1.00 0.00 O ATOM 65 CB THR A 293 -14.660 2.010 3.293 1.00 0.00 C ATOM 66 OG1 THR A 293 -15.287 2.159 4.559 1.00 0.00 O ATOM 67 CG2 THR A 293 -13.908 0.683 3.242 1.00 0.00 C ATOM 0 H THR A 293 -15.396 4.349 3.539 1.00 0.00 H new ATOM 0 HA THR A 293 -12.852 3.133 3.750 1.00 0.00 H new ATOM 0 HB THR A 293 -15.421 2.019 2.513 1.00 0.00 H new ATOM 0 HG1 THR A 293 -15.363 1.283 4.992 1.00 0.00 H new ATOM 0 HG21 THR A 293 -14.606 -0.137 3.411 1.00 0.00 H new ATOM 0 HG22 THR A 293 -13.441 0.567 2.264 1.00 0.00 H new ATOM 0 HG23 THR A 293 -13.139 0.670 4.015 1.00 0.00 H new ATOM 75 N MET A 294 -13.998 3.213 0.662 1.00 0.00 N ATOM 76 CA MET A 294 -13.534 3.040 -0.737 1.00 0.00 C ATOM 77 C MET A 294 -12.290 3.897 -0.982 1.00 0.00 C ATOM 78 O MET A 294 -11.395 3.499 -1.694 1.00 0.00 O ATOM 79 CB MET A 294 -14.666 3.417 -1.704 1.00 0.00 C ATOM 80 CG MET A 294 -14.578 2.550 -2.966 1.00 0.00 C ATOM 81 SD MET A 294 -15.917 2.995 -4.101 1.00 0.00 S ATOM 82 CE MET A 294 -17.189 1.910 -3.399 1.00 0.00 C ATOM 0 H MET A 294 -14.980 3.464 0.771 1.00 0.00 H new ATOM 0 HA MET A 294 -13.266 1.998 -0.910 1.00 0.00 H new ATOM 0 HB2 MET A 294 -15.633 3.275 -1.221 1.00 0.00 H new ATOM 0 HB3 MET A 294 -14.594 4.472 -1.970 1.00 0.00 H new ATOM 0 HG2 MET A 294 -13.613 2.693 -3.452 1.00 0.00 H new ATOM 0 HG3 MET A 294 -14.648 1.495 -2.701 1.00 0.00 H new ATOM 0 HE1 MET A 294 -18.168 2.375 -3.515 1.00 0.00 H new ATOM 0 HE2 MET A 294 -17.178 0.952 -3.919 1.00 0.00 H new ATOM 0 HE3 MET A 294 -16.987 1.750 -2.340 1.00 0.00 H new ATOM 92 N LYS A 295 -12.212 5.058 -0.396 1.00 0.00 N ATOM 93 CA LYS A 295 -11.002 5.905 -0.602 1.00 0.00 C ATOM 94 C LYS A 295 -9.778 5.125 -0.146 1.00 0.00 C ATOM 95 O LYS A 295 -8.789 5.048 -0.843 1.00 0.00 O ATOM 96 CB LYS A 295 -11.131 7.198 0.205 1.00 0.00 C ATOM 97 CG LYS A 295 -12.367 7.976 -0.264 1.00 0.00 C ATOM 98 CD LYS A 295 -12.082 8.684 -1.591 1.00 0.00 C ATOM 99 CE LYS A 295 -13.158 9.739 -1.855 1.00 0.00 C ATOM 100 NZ LYS A 295 -12.868 10.423 -3.148 1.00 0.00 N ATOM 0 H LYS A 295 -12.927 5.456 0.213 1.00 0.00 H new ATOM 0 HA LYS A 295 -10.902 6.162 -1.657 1.00 0.00 H new ATOM 0 HB2 LYS A 295 -11.215 6.969 1.267 1.00 0.00 H new ATOM 0 HB3 LYS A 295 -10.236 7.808 0.080 1.00 0.00 H new ATOM 0 HG2 LYS A 295 -13.210 7.295 -0.382 1.00 0.00 H new ATOM 0 HG3 LYS A 295 -12.652 8.708 0.492 1.00 0.00 H new ATOM 0 HD2 LYS A 295 -11.099 9.154 -1.560 1.00 0.00 H new ATOM 0 HD3 LYS A 295 -12.063 7.959 -2.404 1.00 0.00 H new ATOM 0 HE2 LYS A 295 -14.142 9.271 -1.890 1.00 0.00 H new ATOM 0 HE3 LYS A 295 -13.179 10.465 -1.042 1.00 0.00 H new ATOM 0 HZ1 LYS A 295 -13.597 11.141 -3.332 1.00 0.00 H new ATOM 0 HZ2 LYS A 295 -11.936 10.881 -3.097 1.00 0.00 H new ATOM 0 HZ3 LYS A 295 -12.869 9.724 -3.918 1.00 0.00 H new ATOM 114 N ALA A 296 -9.838 4.524 1.006 1.00 0.00 N ATOM 115 CA ALA A 296 -8.669 3.732 1.465 1.00 0.00 C ATOM 116 C ALA A 296 -8.378 2.666 0.410 1.00 0.00 C ATOM 117 O ALA A 296 -7.245 2.441 0.031 1.00 0.00 O ATOM 118 CB ALA A 296 -8.978 3.068 2.807 1.00 0.00 C ATOM 0 H ALA A 296 -10.635 4.546 1.642 1.00 0.00 H new ATOM 0 HA ALA A 296 -7.803 4.381 1.597 1.00 0.00 H new ATOM 0 HB1 ALA A 296 -8.114 2.490 3.134 1.00 0.00 H new ATOM 0 HB2 ALA A 296 -9.204 3.834 3.549 1.00 0.00 H new ATOM 0 HB3 ALA A 296 -9.837 2.406 2.696 1.00 0.00 H new ATOM 124 N ARG A 297 -9.401 2.020 -0.083 1.00 0.00 N ATOM 125 CA ARG A 297 -9.197 0.983 -1.132 1.00 0.00 C ATOM 126 C ARG A 297 -8.841 1.692 -2.448 1.00 0.00 C ATOM 127 O ARG A 297 -8.228 1.121 -3.327 1.00 0.00 O ATOM 128 CB ARG A 297 -10.482 0.112 -1.250 1.00 0.00 C ATOM 129 CG ARG A 297 -11.220 0.327 -2.583 1.00 0.00 C ATOM 130 CD ARG A 297 -12.482 -0.540 -2.605 1.00 0.00 C ATOM 131 NE ARG A 297 -13.123 -0.465 -3.947 1.00 0.00 N ATOM 132 CZ ARG A 297 -13.999 -1.365 -4.302 1.00 0.00 C ATOM 133 NH1 ARG A 297 -14.289 -2.348 -3.492 1.00 0.00 N ATOM 134 NH2 ARG A 297 -14.576 -1.289 -5.470 1.00 0.00 N ATOM 0 H ARG A 297 -10.371 2.167 0.197 1.00 0.00 H new ATOM 0 HA ARG A 297 -8.377 0.312 -0.876 1.00 0.00 H new ATOM 0 HB2 ARG A 297 -10.214 -0.940 -1.153 1.00 0.00 H new ATOM 0 HB3 ARG A 297 -11.154 0.348 -0.425 1.00 0.00 H new ATOM 0 HG2 ARG A 297 -11.484 1.378 -2.701 1.00 0.00 H new ATOM 0 HG3 ARG A 297 -10.570 0.066 -3.418 1.00 0.00 H new ATOM 0 HD2 ARG A 297 -12.228 -1.574 -2.371 1.00 0.00 H new ATOM 0 HD3 ARG A 297 -13.180 -0.202 -1.839 1.00 0.00 H new ATOM 0 HE ARG A 297 -12.878 0.289 -4.588 1.00 0.00 H new ATOM 0 HH11 ARG A 297 -13.831 -2.412 -2.583 1.00 0.00 H new ATOM 0 HH12 ARG A 297 -14.974 -3.052 -3.769 1.00 0.00 H new ATOM 0 HH21 ARG A 297 -14.342 -0.526 -6.106 1.00 0.00 H new ATOM 0 HH22 ARG A 297 -15.261 -1.992 -5.747 1.00 0.00 H new ATOM 148 N ARG A 298 -9.210 2.939 -2.578 1.00 0.00 N ATOM 149 CA ARG A 298 -8.878 3.688 -3.821 1.00 0.00 C ATOM 150 C ARG A 298 -7.385 3.979 -3.805 1.00 0.00 C ATOM 151 O ARG A 298 -6.684 3.751 -4.771 1.00 0.00 O ATOM 152 CB ARG A 298 -9.674 4.999 -3.866 1.00 0.00 C ATOM 153 CG ARG A 298 -9.697 5.563 -5.299 1.00 0.00 C ATOM 154 CD ARG A 298 -8.318 6.144 -5.693 1.00 0.00 C ATOM 155 NE ARG A 298 -8.510 7.436 -6.425 1.00 0.00 N ATOM 156 CZ ARG A 298 -9.377 7.541 -7.400 1.00 0.00 C ATOM 157 NH1 ARG A 298 -9.984 6.484 -7.864 1.00 0.00 N ATOM 158 NH2 ARG A 298 -9.604 8.706 -7.942 1.00 0.00 N ATOM 0 H ARG A 298 -9.727 3.469 -1.876 1.00 0.00 H new ATOM 0 HA ARG A 298 -9.137 3.102 -4.703 1.00 0.00 H new ATOM 0 HB2 ARG A 298 -10.693 4.825 -3.520 1.00 0.00 H new ATOM 0 HB3 ARG A 298 -9.227 5.727 -3.189 1.00 0.00 H new ATOM 0 HG2 ARG A 298 -9.976 4.775 -5.998 1.00 0.00 H new ATOM 0 HG3 ARG A 298 -10.457 6.340 -5.375 1.00 0.00 H new ATOM 0 HD2 ARG A 298 -7.712 6.306 -4.802 1.00 0.00 H new ATOM 0 HD3 ARG A 298 -7.779 5.435 -6.321 1.00 0.00 H new ATOM 0 HE ARG A 298 -7.955 8.249 -6.159 1.00 0.00 H new ATOM 0 HH11 ARG A 298 -9.785 5.566 -7.467 1.00 0.00 H new ATOM 0 HH12 ARG A 298 -10.658 6.575 -8.624 1.00 0.00 H new ATOM 0 HH21 ARG A 298 -9.107 9.531 -7.606 1.00 0.00 H new ATOM 0 HH22 ARG A 298 -10.279 8.792 -8.702 1.00 0.00 H new ATOM 172 N ALA A 299 -6.882 4.449 -2.695 1.00 0.00 N ATOM 173 CA ALA A 299 -5.421 4.715 -2.604 1.00 0.00 C ATOM 174 C ALA A 299 -4.695 3.444 -3.036 1.00 0.00 C ATOM 175 O ALA A 299 -3.835 3.461 -3.894 1.00 0.00 O ATOM 176 CB ALA A 299 -5.052 5.049 -1.157 1.00 0.00 C ATOM 0 H ALA A 299 -7.418 4.659 -1.853 1.00 0.00 H new ATOM 0 HA ALA A 299 -5.140 5.554 -3.240 1.00 0.00 H new ATOM 0 HB1 ALA A 299 -3.982 5.244 -1.090 1.00 0.00 H new ATOM 0 HB2 ALA A 299 -5.603 5.933 -0.836 1.00 0.00 H new ATOM 0 HB3 ALA A 299 -5.309 4.208 -0.513 1.00 0.00 H new ATOM 182 N TRP A 300 -5.073 2.334 -2.461 1.00 0.00 N ATOM 183 CA TRP A 300 -4.457 1.032 -2.832 1.00 0.00 C ATOM 184 C TRP A 300 -4.425 0.901 -4.355 1.00 0.00 C ATOM 185 O TRP A 300 -3.488 0.377 -4.920 1.00 0.00 O ATOM 186 CB TRP A 300 -5.296 -0.103 -2.244 1.00 0.00 C ATOM 187 CG TRP A 300 -5.350 -0.067 -0.730 1.00 0.00 C ATOM 188 CD1 TRP A 300 -6.213 -0.826 -0.007 1.00 0.00 C ATOM 189 CD2 TRP A 300 -4.567 0.701 0.267 1.00 0.00 C ATOM 190 NE1 TRP A 300 -6.009 -0.604 1.334 1.00 0.00 N ATOM 191 CE2 TRP A 300 -5.016 0.318 1.561 1.00 0.00 C ATOM 192 CE3 TRP A 300 -3.528 1.667 0.206 1.00 0.00 C ATOM 193 CZ2 TRP A 300 -4.468 0.851 2.723 1.00 0.00 C ATOM 194 CZ3 TRP A 300 -2.980 2.201 1.383 1.00 0.00 C ATOM 195 CH2 TRP A 300 -3.448 1.790 2.635 1.00 0.00 C ATOM 0 H TRP A 300 -5.793 2.276 -1.740 1.00 0.00 H new ATOM 0 HA TRP A 300 -3.441 0.981 -2.441 1.00 0.00 H new ATOM 0 HB2 TRP A 300 -6.309 -0.043 -2.641 1.00 0.00 H new ATOM 0 HB3 TRP A 300 -4.883 -1.059 -2.566 1.00 0.00 H new ATOM 0 HD1 TRP A 300 -6.947 -1.501 -0.422 1.00 0.00 H new ATOM 0 HE1 TRP A 300 -6.534 -1.070 2.074 1.00 0.00 H new ATOM 0 HE3 TRP A 300 -3.156 1.994 -0.754 1.00 0.00 H new ATOM 0 HZ2 TRP A 300 -4.834 0.536 3.689 1.00 0.00 H new ATOM 0 HZ3 TRP A 300 -2.190 2.935 1.321 1.00 0.00 H new ATOM 0 HH2 TRP A 300 -3.016 2.203 3.535 1.00 0.00 H new ATOM 206 N THR A 301 -5.434 1.373 -5.028 1.00 0.00 N ATOM 207 CA THR A 301 -5.442 1.270 -6.514 1.00 0.00 C ATOM 208 C THR A 301 -4.220 2.004 -7.086 1.00 0.00 C ATOM 209 O THR A 301 -3.459 1.464 -7.866 1.00 0.00 O ATOM 210 CB THR A 301 -6.722 1.912 -7.054 1.00 0.00 C ATOM 211 OG1 THR A 301 -7.803 1.609 -6.185 1.00 0.00 O ATOM 212 CG2 THR A 301 -7.023 1.377 -8.456 1.00 0.00 C ATOM 0 H THR A 301 -6.251 1.824 -4.617 1.00 0.00 H new ATOM 0 HA THR A 301 -5.404 0.222 -6.809 1.00 0.00 H new ATOM 0 HB THR A 301 -6.588 2.992 -7.108 1.00 0.00 H new ATOM 0 HG1 THR A 301 -8.624 2.021 -6.528 1.00 0.00 H new ATOM 0 HG21 THR A 301 -7.935 1.839 -8.833 1.00 0.00 H new ATOM 0 HG22 THR A 301 -6.194 1.615 -9.122 1.00 0.00 H new ATOM 0 HG23 THR A 301 -7.155 0.296 -8.412 1.00 0.00 H new ATOM 220 N ASP A 302 -4.042 3.241 -6.708 1.00 0.00 N ATOM 221 CA ASP A 302 -2.889 4.033 -7.227 1.00 0.00 C ATOM 222 C ASP A 302 -1.573 3.299 -6.955 1.00 0.00 C ATOM 223 O ASP A 302 -0.775 3.092 -7.845 1.00 0.00 O ATOM 224 CB ASP A 302 -2.861 5.399 -6.537 1.00 0.00 C ATOM 225 CG ASP A 302 -3.980 6.281 -7.098 1.00 0.00 C ATOM 226 OD1 ASP A 302 -5.104 5.810 -7.158 1.00 0.00 O ATOM 227 OD2 ASP A 302 -3.693 7.410 -7.458 1.00 0.00 O ATOM 0 H ASP A 302 -4.649 3.740 -6.058 1.00 0.00 H new ATOM 0 HA ASP A 302 -3.005 4.163 -8.303 1.00 0.00 H new ATOM 0 HB2 ASP A 302 -2.985 5.277 -5.461 1.00 0.00 H new ATOM 0 HB3 ASP A 302 -1.894 5.877 -6.694 1.00 0.00 H new ATOM 232 N VAL A 303 -1.325 2.917 -5.736 1.00 0.00 N ATOM 233 CA VAL A 303 -0.047 2.221 -5.438 1.00 0.00 C ATOM 234 C VAL A 303 -0.078 0.801 -6.008 1.00 0.00 C ATOM 235 O VAL A 303 0.947 0.234 -6.322 1.00 0.00 O ATOM 236 CB VAL A 303 0.174 2.171 -3.925 1.00 0.00 C ATOM 237 CG1 VAL A 303 0.538 3.567 -3.416 1.00 0.00 C ATOM 238 CG2 VAL A 303 -1.099 1.691 -3.234 1.00 0.00 C ATOM 0 H VAL A 303 -1.947 3.055 -4.939 1.00 0.00 H new ATOM 0 HA VAL A 303 0.773 2.769 -5.901 1.00 0.00 H new ATOM 0 HB VAL A 303 0.986 1.479 -3.702 1.00 0.00 H new ATOM 0 HG11 VAL A 303 0.695 3.532 -2.338 1.00 0.00 H new ATOM 0 HG12 VAL A 303 1.451 3.906 -3.905 1.00 0.00 H new ATOM 0 HG13 VAL A 303 -0.273 4.259 -3.642 1.00 0.00 H new ATOM 0 HG21 VAL A 303 -0.937 1.657 -2.157 1.00 0.00 H new ATOM 0 HG22 VAL A 303 -1.915 2.378 -3.457 1.00 0.00 H new ATOM 0 HG23 VAL A 303 -1.355 0.695 -3.594 1.00 0.00 H new ATOM 248 N ILE A 304 -1.234 0.214 -6.164 1.00 0.00 N ATOM 249 CA ILE A 304 -1.270 -1.168 -6.726 1.00 0.00 C ATOM 250 C ILE A 304 -0.485 -1.174 -8.045 1.00 0.00 C ATOM 251 O ILE A 304 0.228 -2.111 -8.345 1.00 0.00 O ATOM 252 CB ILE A 304 -2.745 -1.603 -6.927 1.00 0.00 C ATOM 253 CG1 ILE A 304 -3.220 -2.407 -5.704 1.00 0.00 C ATOM 254 CG2 ILE A 304 -2.913 -2.472 -8.181 1.00 0.00 C ATOM 255 CD1 ILE A 304 -4.744 -2.540 -5.729 1.00 0.00 C ATOM 0 H ILE A 304 -2.140 0.622 -5.932 1.00 0.00 H new ATOM 0 HA ILE A 304 -0.808 -1.882 -6.045 1.00 0.00 H new ATOM 0 HB ILE A 304 -3.341 -0.699 -7.047 1.00 0.00 H new ATOM 0 HG12 ILE A 304 -2.760 -3.395 -5.706 1.00 0.00 H new ATOM 0 HG13 ILE A 304 -2.904 -1.910 -4.786 1.00 0.00 H new ATOM 0 HG21 ILE A 304 -3.960 -2.757 -8.288 1.00 0.00 H new ATOM 0 HG22 ILE A 304 -2.599 -1.908 -9.059 1.00 0.00 H new ATOM 0 HG23 ILE A 304 -2.300 -3.369 -8.087 1.00 0.00 H new ATOM 0 HD11 ILE A 304 -5.074 -3.110 -4.861 1.00 0.00 H new ATOM 0 HD12 ILE A 304 -5.196 -1.549 -5.705 1.00 0.00 H new ATOM 0 HD13 ILE A 304 -5.049 -3.056 -6.639 1.00 0.00 H new ATOM 267 N GLN A 305 -0.589 -0.132 -8.827 1.00 0.00 N ATOM 268 CA GLN A 305 0.177 -0.098 -10.104 1.00 0.00 C ATOM 269 C GLN A 305 1.646 0.214 -9.783 1.00 0.00 C ATOM 270 O GLN A 305 2.548 -0.234 -10.460 1.00 0.00 O ATOM 271 CB GLN A 305 -0.427 0.960 -11.059 1.00 0.00 C ATOM 272 CG GLN A 305 0.192 2.350 -10.824 1.00 0.00 C ATOM 273 CD GLN A 305 1.529 2.462 -11.564 1.00 0.00 C ATOM 274 OE1 GLN A 305 2.555 2.693 -10.955 1.00 0.00 O ATOM 275 NE2 GLN A 305 1.560 2.307 -12.859 1.00 0.00 N ATOM 0 H GLN A 305 -1.165 0.688 -8.638 1.00 0.00 H new ATOM 0 HA GLN A 305 0.119 -1.064 -10.606 1.00 0.00 H new ATOM 0 HB2 GLN A 305 -0.260 0.656 -12.092 1.00 0.00 H new ATOM 0 HB3 GLN A 305 -1.506 1.011 -10.912 1.00 0.00 H new ATOM 0 HG2 GLN A 305 -0.491 3.125 -11.172 1.00 0.00 H new ATOM 0 HG3 GLN A 305 0.343 2.514 -9.757 1.00 0.00 H new ATOM 0 HE21 GLN A 305 0.699 2.113 -13.370 1.00 0.00 H new ATOM 0 HE22 GLN A 305 2.445 2.380 -13.360 1.00 0.00 H new ATOM 284 N THR A 306 1.887 0.976 -8.746 1.00 0.00 N ATOM 285 CA THR A 306 3.294 1.307 -8.381 1.00 0.00 C ATOM 286 C THR A 306 3.990 0.055 -7.845 1.00 0.00 C ATOM 287 O THR A 306 5.012 -0.357 -8.353 1.00 0.00 O ATOM 288 CB THR A 306 3.310 2.393 -7.306 1.00 0.00 C ATOM 289 OG1 THR A 306 2.457 3.460 -7.696 1.00 0.00 O ATOM 290 CG2 THR A 306 4.740 2.914 -7.130 1.00 0.00 C ATOM 0 H THR A 306 1.173 1.380 -8.140 1.00 0.00 H new ATOM 0 HA THR A 306 3.817 1.668 -9.266 1.00 0.00 H new ATOM 0 HB THR A 306 2.957 1.977 -6.362 1.00 0.00 H new ATOM 0 HG1 THR A 306 2.466 4.155 -7.006 1.00 0.00 H new ATOM 0 HG21 THR A 306 4.753 3.689 -6.363 1.00 0.00 H new ATOM 0 HG22 THR A 306 5.391 2.094 -6.828 1.00 0.00 H new ATOM 0 HG23 THR A 306 5.094 3.330 -8.073 1.00 0.00 H new ATOM 298 N LEU A 307 3.443 -0.560 -6.826 1.00 0.00 N ATOM 299 CA LEU A 307 4.076 -1.794 -6.261 1.00 0.00 C ATOM 300 C LEU A 307 4.468 -2.720 -7.417 1.00 0.00 C ATOM 301 O LEU A 307 5.576 -3.212 -7.493 1.00 0.00 O ATOM 302 CB LEU A 307 3.056 -2.523 -5.364 1.00 0.00 C ATOM 303 CG LEU A 307 3.109 -2.019 -3.903 1.00 0.00 C ATOM 304 CD1 LEU A 307 4.350 -2.564 -3.182 1.00 0.00 C ATOM 305 CD2 LEU A 307 3.132 -0.484 -3.867 1.00 0.00 C ATOM 0 H LEU A 307 2.586 -0.262 -6.360 1.00 0.00 H new ATOM 0 HA LEU A 307 4.956 -1.525 -5.677 1.00 0.00 H new ATOM 0 HB2 LEU A 307 2.052 -2.376 -5.762 1.00 0.00 H new ATOM 0 HB3 LEU A 307 3.254 -3.595 -5.386 1.00 0.00 H new ATOM 0 HG LEU A 307 2.216 -2.380 -3.392 1.00 0.00 H new ATOM 0 HD11 LEU A 307 4.366 -2.196 -2.156 1.00 0.00 H new ATOM 0 HD12 LEU A 307 4.318 -3.654 -3.176 1.00 0.00 H new ATOM 0 HD13 LEU A 307 5.248 -2.230 -3.701 1.00 0.00 H new ATOM 0 HD21 LEU A 307 3.169 -0.145 -2.832 1.00 0.00 H new ATOM 0 HD22 LEU A 307 4.011 -0.121 -4.400 1.00 0.00 H new ATOM 0 HD23 LEU A 307 2.232 -0.095 -4.344 1.00 0.00 H new ATOM 317 N ARG A 308 3.552 -2.959 -8.309 1.00 0.00 N ATOM 318 CA ARG A 308 3.840 -3.853 -9.458 1.00 0.00 C ATOM 319 C ARG A 308 5.021 -3.297 -10.264 1.00 0.00 C ATOM 320 O ARG A 308 5.583 -3.974 -11.101 1.00 0.00 O ATOM 321 CB ARG A 308 2.582 -3.947 -10.342 1.00 0.00 C ATOM 322 CG ARG A 308 2.578 -5.271 -11.128 1.00 0.00 C ATOM 323 CD ARG A 308 1.947 -6.387 -10.286 1.00 0.00 C ATOM 324 NE ARG A 308 0.477 -6.165 -10.175 1.00 0.00 N ATOM 325 CZ ARG A 308 -0.298 -7.123 -9.742 1.00 0.00 C ATOM 326 NH1 ARG A 308 0.218 -8.267 -9.379 1.00 0.00 N ATOM 327 NH2 ARG A 308 -1.586 -6.938 -9.666 1.00 0.00 N ATOM 0 H ARG A 308 2.609 -2.570 -8.290 1.00 0.00 H new ATOM 0 HA ARG A 308 4.105 -4.848 -9.100 1.00 0.00 H new ATOM 0 HB2 ARG A 308 1.688 -3.882 -9.722 1.00 0.00 H new ATOM 0 HB3 ARG A 308 2.552 -3.105 -11.034 1.00 0.00 H new ATOM 0 HG2 ARG A 308 2.022 -5.149 -12.057 1.00 0.00 H new ATOM 0 HG3 ARG A 308 3.598 -5.544 -11.400 1.00 0.00 H new ATOM 0 HD2 ARG A 308 2.144 -7.356 -10.744 1.00 0.00 H new ATOM 0 HD3 ARG A 308 2.397 -6.405 -9.294 1.00 0.00 H new ATOM 0 HE ARG A 308 0.076 -5.264 -10.437 1.00 0.00 H new ATOM 0 HH11 ARG A 308 1.226 -8.412 -9.434 1.00 0.00 H new ATOM 0 HH12 ARG A 308 -0.387 -9.015 -9.041 1.00 0.00 H new ATOM 0 HH21 ARG A 308 -1.990 -6.044 -9.945 1.00 0.00 H new ATOM 0 HH22 ARG A 308 -2.190 -7.687 -9.328 1.00 0.00 H new ATOM 341 N GLU A 309 5.406 -2.070 -10.018 1.00 0.00 N ATOM 342 CA GLU A 309 6.553 -1.484 -10.776 1.00 0.00 C ATOM 343 C GLU A 309 7.863 -1.940 -10.122 1.00 0.00 C ATOM 344 O GLU A 309 8.939 -1.527 -10.509 1.00 0.00 O ATOM 345 CB GLU A 309 6.427 0.063 -10.776 1.00 0.00 C ATOM 346 CG GLU A 309 7.319 0.718 -9.702 1.00 0.00 C ATOM 347 CD GLU A 309 6.886 2.170 -9.495 1.00 0.00 C ATOM 348 OE1 GLU A 309 5.953 2.590 -10.160 1.00 0.00 O ATOM 349 OE2 GLU A 309 7.495 2.838 -8.676 1.00 0.00 O ATOM 0 H GLU A 309 4.978 -1.452 -9.329 1.00 0.00 H new ATOM 0 HA GLU A 309 6.547 -1.825 -11.811 1.00 0.00 H new ATOM 0 HB2 GLU A 309 6.701 0.448 -11.758 1.00 0.00 H new ATOM 0 HB3 GLU A 309 5.388 0.342 -10.602 1.00 0.00 H new ATOM 0 HG2 GLU A 309 7.242 0.167 -8.765 1.00 0.00 H new ATOM 0 HG3 GLU A 309 8.364 0.679 -10.009 1.00 0.00 H new ATOM 356 N HIS A 310 7.767 -2.786 -9.130 1.00 0.00 N ATOM 357 CA HIS A 310 8.987 -3.286 -8.422 1.00 0.00 C ATOM 358 C HIS A 310 8.928 -4.821 -8.386 1.00 0.00 C ATOM 359 O HIS A 310 8.281 -5.441 -9.207 1.00 0.00 O ATOM 360 CB HIS A 310 8.957 -2.699 -6.981 1.00 0.00 C ATOM 361 CG HIS A 310 10.017 -1.648 -6.812 1.00 0.00 C ATOM 362 ND1 HIS A 310 11.362 -1.940 -6.938 1.00 0.00 N ATOM 363 CD2 HIS A 310 9.944 -0.310 -6.515 1.00 0.00 C ATOM 364 CE1 HIS A 310 12.044 -0.807 -6.716 1.00 0.00 C ATOM 365 NE2 HIS A 310 11.229 0.221 -6.454 1.00 0.00 N ATOM 0 H HIS A 310 6.886 -3.157 -8.775 1.00 0.00 H new ATOM 0 HA HIS A 310 9.906 -2.983 -8.924 1.00 0.00 H new ATOM 0 HB2 HIS A 310 7.976 -2.269 -6.779 1.00 0.00 H new ATOM 0 HB3 HIS A 310 9.111 -3.497 -6.255 1.00 0.00 H new ATOM 0 HD1 HIS A 310 11.763 -2.851 -7.160 1.00 0.00 H new ATOM 0 HD2 HIS A 310 9.031 0.245 -6.354 1.00 0.00 H new ATOM 0 HE1 HIS A 310 13.121 -0.733 -6.745 1.00 0.00 H new ATOM 373 N LYS A 311 9.569 -5.432 -7.421 1.00 0.00 N ATOM 374 CA LYS A 311 9.527 -6.923 -7.298 1.00 0.00 C ATOM 375 C LYS A 311 8.597 -7.257 -6.135 1.00 0.00 C ATOM 376 O LYS A 311 8.612 -8.344 -5.594 1.00 0.00 O ATOM 377 CB LYS A 311 10.948 -7.487 -7.047 1.00 0.00 C ATOM 378 CG LYS A 311 11.864 -6.416 -6.431 1.00 0.00 C ATOM 379 CD LYS A 311 11.353 -6.003 -5.043 1.00 0.00 C ATOM 380 CE LYS A 311 11.369 -7.207 -4.089 1.00 0.00 C ATOM 381 NZ LYS A 311 11.538 -6.727 -2.688 1.00 0.00 N ATOM 0 H LYS A 311 10.124 -4.959 -6.708 1.00 0.00 H new ATOM 0 HA LYS A 311 9.160 -7.375 -8.219 1.00 0.00 H new ATOM 0 HB2 LYS A 311 10.889 -8.348 -6.381 1.00 0.00 H new ATOM 0 HB3 LYS A 311 11.375 -7.839 -7.986 1.00 0.00 H new ATOM 0 HG2 LYS A 311 12.880 -6.801 -6.351 1.00 0.00 H new ATOM 0 HG3 LYS A 311 11.904 -5.544 -7.084 1.00 0.00 H new ATOM 0 HD2 LYS A 311 11.976 -5.204 -4.641 1.00 0.00 H new ATOM 0 HD3 LYS A 311 10.340 -5.608 -5.124 1.00 0.00 H new ATOM 0 HE2 LYS A 311 10.441 -7.771 -4.182 1.00 0.00 H new ATOM 0 HE3 LYS A 311 12.181 -7.884 -4.354 1.00 0.00 H new ATOM 0 HZ1 LYS A 311 12.469 -7.020 -2.330 1.00 0.00 H new ATOM 0 HZ2 LYS A 311 11.470 -5.689 -2.666 1.00 0.00 H new ATOM 0 HZ3 LYS A 311 10.793 -7.136 -2.089 1.00 0.00 H new ATOM 395 N CYS A 312 7.780 -6.308 -5.759 1.00 0.00 N ATOM 396 CA CYS A 312 6.820 -6.513 -4.639 1.00 0.00 C ATOM 397 C CYS A 312 5.409 -6.633 -5.213 1.00 0.00 C ATOM 398 O CYS A 312 4.812 -5.661 -5.632 1.00 0.00 O ATOM 399 CB CYS A 312 6.886 -5.308 -3.705 1.00 0.00 C ATOM 400 SG CYS A 312 6.858 -3.787 -4.685 1.00 0.00 S ATOM 0 H CYS A 312 7.739 -5.384 -6.190 1.00 0.00 H new ATOM 0 HA CYS A 312 7.072 -7.419 -4.088 1.00 0.00 H new ATOM 0 HB2 CYS A 312 6.044 -5.324 -3.013 1.00 0.00 H new ATOM 0 HB3 CYS A 312 7.794 -5.349 -3.103 1.00 0.00 H new ATOM 0 HG CYS A 312 6.104 -3.958 -5.730 1.00 0.00 H new ATOM 406 N GLN A 313 4.880 -7.820 -5.248 1.00 0.00 N ATOM 407 CA GLN A 313 3.512 -8.012 -5.811 1.00 0.00 C ATOM 408 C GLN A 313 2.451 -7.496 -4.812 1.00 0.00 C ATOM 409 O GLN A 313 2.402 -7.953 -3.687 1.00 0.00 O ATOM 410 CB GLN A 313 3.279 -9.505 -6.063 1.00 0.00 C ATOM 411 CG GLN A 313 4.081 -9.950 -7.290 1.00 0.00 C ATOM 412 CD GLN A 313 3.945 -11.464 -7.470 1.00 0.00 C ATOM 413 OE1 GLN A 313 4.771 -12.219 -6.997 1.00 0.00 O ATOM 414 NE2 GLN A 313 2.933 -11.939 -8.142 1.00 0.00 N ATOM 0 H GLN A 313 5.334 -8.669 -4.911 1.00 0.00 H new ATOM 0 HA GLN A 313 3.427 -7.456 -6.744 1.00 0.00 H new ATOM 0 HB2 GLN A 313 3.581 -10.083 -5.190 1.00 0.00 H new ATOM 0 HB3 GLN A 313 2.218 -9.696 -6.221 1.00 0.00 H new ATOM 0 HG2 GLN A 313 3.720 -9.434 -8.180 1.00 0.00 H new ATOM 0 HG3 GLN A 313 5.130 -9.681 -7.169 1.00 0.00 H new ATOM 0 HE21 GLN A 313 2.241 -11.304 -8.538 1.00 0.00 H new ATOM 0 HE22 GLN A 313 2.834 -12.946 -8.271 1.00 0.00 H new ATOM 423 N PRO A 314 1.598 -6.560 -5.202 1.00 0.00 N ATOM 424 CA PRO A 314 0.539 -6.019 -4.300 1.00 0.00 C ATOM 425 C PRO A 314 -0.723 -6.879 -4.308 1.00 0.00 C ATOM 426 O PRO A 314 -1.065 -7.495 -5.300 1.00 0.00 O ATOM 427 CB PRO A 314 0.242 -4.652 -4.906 1.00 0.00 C ATOM 428 CG PRO A 314 0.416 -4.863 -6.374 1.00 0.00 C ATOM 429 CD PRO A 314 1.537 -5.906 -6.525 1.00 0.00 C ATOM 0 HA PRO A 314 0.861 -5.989 -3.259 1.00 0.00 H new ATOM 0 HB2 PRO A 314 -0.769 -4.320 -4.667 1.00 0.00 H new ATOM 0 HB3 PRO A 314 0.925 -3.891 -4.528 1.00 0.00 H new ATOM 0 HG2 PRO A 314 -0.509 -5.216 -6.829 1.00 0.00 H new ATOM 0 HG3 PRO A 314 0.681 -3.931 -6.873 1.00 0.00 H new ATOM 0 HD2 PRO A 314 1.311 -6.623 -7.314 1.00 0.00 H new ATOM 0 HD3 PRO A 314 2.487 -5.437 -6.782 1.00 0.00 H new ATOM 437 N ARG A 315 -1.418 -6.928 -3.206 1.00 0.00 N ATOM 438 CA ARG A 315 -2.659 -7.747 -3.139 1.00 0.00 C ATOM 439 C ARG A 315 -3.650 -7.070 -2.189 1.00 0.00 C ATOM 440 O ARG A 315 -3.360 -6.848 -1.032 1.00 0.00 O ATOM 441 CB ARG A 315 -2.307 -9.153 -2.633 1.00 0.00 C ATOM 442 CG ARG A 315 -1.277 -9.079 -1.475 1.00 0.00 C ATOM 443 CD ARG A 315 0.184 -9.056 -1.983 1.00 0.00 C ATOM 444 NE ARG A 315 0.384 -10.024 -3.114 1.00 0.00 N ATOM 445 CZ ARG A 315 0.067 -11.289 -3.001 1.00 0.00 C ATOM 446 NH1 ARG A 315 -0.279 -11.785 -1.846 1.00 0.00 N ATOM 447 NH2 ARG A 315 0.143 -12.069 -4.045 1.00 0.00 N ATOM 0 H ARG A 315 -1.179 -6.434 -2.346 1.00 0.00 H new ATOM 0 HA ARG A 315 -3.112 -7.831 -4.127 1.00 0.00 H new ATOM 0 HB2 ARG A 315 -3.210 -9.658 -2.291 1.00 0.00 H new ATOM 0 HB3 ARG A 315 -1.900 -9.748 -3.451 1.00 0.00 H new ATOM 0 HG2 ARG A 315 -1.466 -8.185 -0.881 1.00 0.00 H new ATOM 0 HG3 ARG A 315 -1.415 -9.935 -0.815 1.00 0.00 H new ATOM 0 HD2 ARG A 315 0.441 -8.049 -2.313 1.00 0.00 H new ATOM 0 HD3 ARG A 315 0.860 -9.305 -1.165 1.00 0.00 H new ATOM 0 HE ARG A 315 0.777 -9.687 -3.993 1.00 0.00 H new ATOM 0 HH11 ARG A 315 -0.304 -11.186 -1.021 1.00 0.00 H new ATOM 0 HH12 ARG A 315 -0.524 -12.772 -1.768 1.00 0.00 H new ATOM 0 HH21 ARG A 315 0.448 -11.692 -4.942 1.00 0.00 H new ATOM 0 HH22 ARG A 315 -0.103 -13.056 -3.963 1.00 0.00 H new ATOM 461 N LEU A 316 -4.816 -6.719 -2.668 1.00 0.00 N ATOM 462 CA LEU A 316 -5.802 -6.042 -1.789 1.00 0.00 C ATOM 463 C LEU A 316 -6.544 -7.079 -0.940 1.00 0.00 C ATOM 464 O LEU A 316 -7.157 -7.999 -1.443 1.00 0.00 O ATOM 465 CB LEU A 316 -6.794 -5.263 -2.671 1.00 0.00 C ATOM 466 CG LEU A 316 -7.206 -3.956 -1.987 1.00 0.00 C ATOM 467 CD1 LEU A 316 -8.121 -3.159 -2.917 1.00 0.00 C ATOM 468 CD2 LEU A 316 -7.947 -4.278 -0.697 1.00 0.00 C ATOM 0 H LEU A 316 -5.123 -6.874 -3.628 1.00 0.00 H new ATOM 0 HA LEU A 316 -5.291 -5.353 -1.117 1.00 0.00 H new ATOM 0 HB2 LEU A 316 -6.339 -5.047 -3.638 1.00 0.00 H new ATOM 0 HB3 LEU A 316 -7.676 -5.874 -2.864 1.00 0.00 H new ATOM 0 HG LEU A 316 -6.318 -3.365 -1.761 1.00 0.00 H new ATOM 0 HD11 LEU A 316 -8.414 -2.229 -2.430 1.00 0.00 H new ATOM 0 HD12 LEU A 316 -7.591 -2.933 -3.842 1.00 0.00 H new ATOM 0 HD13 LEU A 316 -9.011 -3.746 -3.143 1.00 0.00 H new ATOM 0 HD21 LEU A 316 -8.243 -3.351 -0.206 1.00 0.00 H new ATOM 0 HD22 LEU A 316 -8.835 -4.867 -0.925 1.00 0.00 H new ATOM 0 HD23 LEU A 316 -7.294 -4.847 -0.035 1.00 0.00 H new ATOM 480 N LEU A 317 -6.501 -6.908 0.350 1.00 0.00 N ATOM 481 CA LEU A 317 -7.210 -7.844 1.284 1.00 0.00 C ATOM 482 C LEU A 317 -8.478 -7.128 1.754 1.00 0.00 C ATOM 483 O LEU A 317 -8.959 -6.275 1.049 1.00 0.00 O ATOM 484 CB LEU A 317 -6.299 -8.162 2.484 1.00 0.00 C ATOM 485 CG LEU A 317 -5.217 -9.186 2.092 1.00 0.00 C ATOM 486 CD1 LEU A 317 -5.854 -10.542 1.733 1.00 0.00 C ATOM 487 CD2 LEU A 317 -4.404 -8.658 0.902 1.00 0.00 C ATOM 0 H LEU A 317 -5.998 -6.149 0.810 1.00 0.00 H new ATOM 0 HA LEU A 317 -7.460 -8.784 0.791 1.00 0.00 H new ATOM 0 HB2 LEU A 317 -5.827 -7.246 2.841 1.00 0.00 H new ATOM 0 HB3 LEU A 317 -6.897 -8.555 3.307 1.00 0.00 H new ATOM 0 HG LEU A 317 -4.554 -9.331 2.945 1.00 0.00 H new ATOM 0 HD11 LEU A 317 -5.072 -11.250 1.459 1.00 0.00 H new ATOM 0 HD12 LEU A 317 -6.405 -10.924 2.592 1.00 0.00 H new ATOM 0 HD13 LEU A 317 -6.536 -10.412 0.893 1.00 0.00 H new ATOM 0 HD21 LEU A 317 -3.641 -9.387 0.630 1.00 0.00 H new ATOM 0 HD22 LEU A 317 -5.067 -8.493 0.053 1.00 0.00 H new ATOM 0 HD23 LEU A 317 -3.926 -7.718 1.177 1.00 0.00 H new ATOM 499 N TYR A 318 -8.999 -7.468 2.928 1.00 0.00 N ATOM 500 CA TYR A 318 -10.245 -6.819 3.511 1.00 0.00 C ATOM 501 C TYR A 318 -10.671 -5.573 2.697 1.00 0.00 C ATOM 502 O TYR A 318 -9.826 -4.872 2.204 1.00 0.00 O ATOM 503 CB TYR A 318 -9.905 -6.394 4.961 1.00 0.00 C ATOM 504 CG TYR A 318 -11.076 -6.610 5.894 1.00 0.00 C ATOM 505 CD1 TYR A 318 -11.378 -7.897 6.354 1.00 0.00 C ATOM 506 CD2 TYR A 318 -11.852 -5.518 6.307 1.00 0.00 C ATOM 507 CE1 TYR A 318 -12.457 -8.094 7.223 1.00 0.00 C ATOM 508 CE2 TYR A 318 -12.930 -5.715 7.177 1.00 0.00 C ATOM 509 CZ TYR A 318 -13.234 -7.003 7.634 1.00 0.00 C ATOM 510 OH TYR A 318 -14.297 -7.198 8.490 1.00 0.00 O ATOM 0 H TYR A 318 -8.599 -8.192 3.525 1.00 0.00 H new ATOM 0 HA TYR A 318 -11.073 -7.527 3.482 1.00 0.00 H new ATOM 0 HB2 TYR A 318 -9.046 -6.964 5.316 1.00 0.00 H new ATOM 0 HB3 TYR A 318 -9.617 -5.343 4.975 1.00 0.00 H new ATOM 0 HD1 TYR A 318 -10.778 -8.738 6.038 1.00 0.00 H new ATOM 0 HD2 TYR A 318 -11.618 -4.525 5.954 1.00 0.00 H new ATOM 0 HE1 TYR A 318 -12.691 -9.087 7.577 1.00 0.00 H new ATOM 0 HE2 TYR A 318 -13.527 -4.874 7.496 1.00 0.00 H new ATOM 0 HH TYR A 318 -14.729 -6.338 8.676 1.00 0.00 H new ATOM 520 N PRO A 319 -11.956 -5.294 2.558 1.00 0.00 N ATOM 521 CA PRO A 319 -12.468 -4.126 1.790 1.00 0.00 C ATOM 522 C PRO A 319 -11.454 -2.988 1.602 1.00 0.00 C ATOM 523 O PRO A 319 -11.495 -2.274 0.621 1.00 0.00 O ATOM 524 CB PRO A 319 -13.656 -3.701 2.637 1.00 0.00 C ATOM 525 CG PRO A 319 -14.252 -5.005 3.096 1.00 0.00 C ATOM 526 CD PRO A 319 -13.098 -6.038 3.119 1.00 0.00 C ATOM 0 HA PRO A 319 -12.709 -4.382 0.758 1.00 0.00 H new ATOM 0 HB2 PRO A 319 -13.346 -3.084 3.480 1.00 0.00 H new ATOM 0 HB3 PRO A 319 -14.371 -3.115 2.059 1.00 0.00 H new ATOM 0 HG2 PRO A 319 -14.697 -4.900 4.085 1.00 0.00 H new ATOM 0 HG3 PRO A 319 -15.046 -5.326 2.422 1.00 0.00 H new ATOM 0 HD2 PRO A 319 -12.892 -6.386 4.131 1.00 0.00 H new ATOM 0 HD3 PRO A 319 -13.336 -6.918 2.521 1.00 0.00 H new ATOM 534 N ALA A 320 -10.521 -2.829 2.503 1.00 0.00 N ATOM 535 CA ALA A 320 -9.496 -1.756 2.325 1.00 0.00 C ATOM 536 C ALA A 320 -8.175 -2.143 3.007 1.00 0.00 C ATOM 537 O ALA A 320 -7.451 -1.284 3.470 1.00 0.00 O ATOM 538 CB ALA A 320 -10.003 -0.449 2.923 1.00 0.00 C ATOM 0 H ALA A 320 -10.423 -3.390 3.349 1.00 0.00 H new ATOM 0 HA ALA A 320 -9.319 -1.630 1.257 1.00 0.00 H new ATOM 0 HB1 ALA A 320 -9.251 0.328 2.789 1.00 0.00 H new ATOM 0 HB2 ALA A 320 -10.924 -0.152 2.421 1.00 0.00 H new ATOM 0 HB3 ALA A 320 -10.197 -0.587 3.987 1.00 0.00 H new ATOM 544 N LYS A 321 -7.834 -3.417 3.056 1.00 0.00 N ATOM 545 CA LYS A 321 -6.533 -3.826 3.694 1.00 0.00 C ATOM 546 C LYS A 321 -5.560 -4.220 2.583 1.00 0.00 C ATOM 547 O LYS A 321 -5.820 -5.134 1.830 1.00 0.00 O ATOM 548 CB LYS A 321 -6.756 -5.022 4.634 1.00 0.00 C ATOM 549 CG LYS A 321 -7.313 -4.540 5.990 1.00 0.00 C ATOM 550 CD LYS A 321 -6.167 -4.077 6.915 1.00 0.00 C ATOM 551 CE LYS A 321 -5.610 -5.270 7.702 1.00 0.00 C ATOM 552 NZ LYS A 321 -6.676 -5.829 8.581 1.00 0.00 N ATOM 0 H LYS A 321 -8.395 -4.184 2.685 1.00 0.00 H new ATOM 0 HA LYS A 321 -6.130 -2.999 4.278 1.00 0.00 H new ATOM 0 HB2 LYS A 321 -7.451 -5.727 4.178 1.00 0.00 H new ATOM 0 HB3 LYS A 321 -5.817 -5.553 4.787 1.00 0.00 H new ATOM 0 HG2 LYS A 321 -8.013 -3.720 5.831 1.00 0.00 H new ATOM 0 HG3 LYS A 321 -7.870 -5.346 6.468 1.00 0.00 H new ATOM 0 HD2 LYS A 321 -5.374 -3.620 6.323 1.00 0.00 H new ATOM 0 HD3 LYS A 321 -6.531 -3.315 7.604 1.00 0.00 H new ATOM 0 HE2 LYS A 321 -5.252 -6.037 7.015 1.00 0.00 H new ATOM 0 HE3 LYS A 321 -4.756 -4.956 8.303 1.00 0.00 H new ATOM 0 HZ1 LYS A 321 -6.246 -6.214 9.446 1.00 0.00 H new ATOM 0 HZ2 LYS A 321 -7.348 -5.076 8.834 1.00 0.00 H new ATOM 0 HZ3 LYS A 321 -7.179 -6.587 8.077 1.00 0.00 H new ATOM 566 N LEU A 322 -4.451 -3.528 2.456 1.00 0.00 N ATOM 567 CA LEU A 322 -3.473 -3.855 1.365 1.00 0.00 C ATOM 568 C LEU A 322 -2.214 -4.500 1.950 1.00 0.00 C ATOM 569 O LEU A 322 -1.528 -3.914 2.762 1.00 0.00 O ATOM 570 CB LEU A 322 -3.094 -2.547 0.647 1.00 0.00 C ATOM 571 CG LEU A 322 -2.746 -2.810 -0.827 1.00 0.00 C ATOM 572 CD1 LEU A 322 -2.220 -1.516 -1.473 1.00 0.00 C ATOM 573 CD2 LEU A 322 -1.679 -3.907 -0.924 1.00 0.00 C ATOM 0 H LEU A 322 -4.180 -2.752 3.060 1.00 0.00 H new ATOM 0 HA LEU A 322 -3.927 -4.558 0.666 1.00 0.00 H new ATOM 0 HB2 LEU A 322 -3.922 -1.841 0.709 1.00 0.00 H new ATOM 0 HB3 LEU A 322 -2.243 -2.086 1.149 1.00 0.00 H new ATOM 0 HG LEU A 322 -3.643 -3.138 -1.353 1.00 0.00 H new ATOM 0 HD11 LEU A 322 -1.974 -1.705 -2.518 1.00 0.00 H new ATOM 0 HD12 LEU A 322 -2.986 -0.743 -1.415 1.00 0.00 H new ATOM 0 HD13 LEU A 322 -1.327 -1.182 -0.945 1.00 0.00 H new ATOM 0 HD21 LEU A 322 -1.437 -4.088 -1.971 1.00 0.00 H new ATOM 0 HD22 LEU A 322 -0.781 -3.589 -0.394 1.00 0.00 H new ATOM 0 HD23 LEU A 322 -2.059 -4.825 -0.475 1.00 0.00 H new ATOM 585 N SER A 323 -1.892 -5.693 1.515 1.00 0.00 N ATOM 586 CA SER A 323 -0.661 -6.378 2.012 1.00 0.00 C ATOM 587 C SER A 323 0.420 -6.269 0.942 1.00 0.00 C ATOM 588 O SER A 323 0.252 -6.717 -0.179 1.00 0.00 O ATOM 589 CB SER A 323 -0.963 -7.848 2.296 1.00 0.00 C ATOM 590 OG SER A 323 0.228 -8.499 2.716 1.00 0.00 O ATOM 0 H SER A 323 -2.433 -6.224 0.833 1.00 0.00 H new ATOM 0 HA SER A 323 -0.321 -5.908 2.935 1.00 0.00 H new ATOM 0 HB2 SER A 323 -1.728 -7.932 3.068 1.00 0.00 H new ATOM 0 HB3 SER A 323 -1.358 -8.329 1.402 1.00 0.00 H new ATOM 0 HG SER A 323 0.037 -9.442 2.901 1.00 0.00 H new ATOM 596 N ILE A 324 1.525 -5.655 1.279 1.00 0.00 N ATOM 597 CA ILE A 324 2.635 -5.482 0.298 1.00 0.00 C ATOM 598 C ILE A 324 3.763 -6.460 0.628 1.00 0.00 C ATOM 599 O ILE A 324 4.051 -6.731 1.781 1.00 0.00 O ATOM 600 CB ILE A 324 3.149 -4.039 0.381 1.00 0.00 C ATOM 601 CG1 ILE A 324 3.592 -3.695 1.834 1.00 0.00 C ATOM 602 CG2 ILE A 324 2.024 -3.089 -0.061 1.00 0.00 C ATOM 603 CD1 ILE A 324 5.115 -3.808 1.970 1.00 0.00 C ATOM 0 H ILE A 324 1.706 -5.262 2.203 1.00 0.00 H new ATOM 0 HA ILE A 324 2.277 -5.683 -0.712 1.00 0.00 H new ATOM 0 HB ILE A 324 4.014 -3.926 -0.273 1.00 0.00 H new ATOM 0 HG12 ILE A 324 3.272 -2.685 2.089 1.00 0.00 H new ATOM 0 HG13 ILE A 324 3.107 -4.370 2.538 1.00 0.00 H new ATOM 0 HG21 ILE A 324 2.376 -2.059 -0.007 1.00 0.00 H new ATOM 0 HG22 ILE A 324 1.734 -3.320 -1.086 1.00 0.00 H new ATOM 0 HG23 ILE A 324 1.163 -3.214 0.596 1.00 0.00 H new ATOM 0 HD11 ILE A 324 5.408 -3.564 2.991 1.00 0.00 H new ATOM 0 HD12 ILE A 324 5.427 -4.826 1.736 1.00 0.00 H new ATOM 0 HD13 ILE A 324 5.594 -3.114 1.280 1.00 0.00 H new ATOM 615 N THR A 325 4.394 -7.005 -0.384 1.00 0.00 N ATOM 616 CA THR A 325 5.501 -7.989 -0.166 1.00 0.00 C ATOM 617 C THR A 325 6.862 -7.352 -0.479 1.00 0.00 C ATOM 618 O THR A 325 7.133 -6.973 -1.599 1.00 0.00 O ATOM 619 CB THR A 325 5.281 -9.183 -1.103 1.00 0.00 C ATOM 620 OG1 THR A 325 4.097 -9.869 -0.720 1.00 0.00 O ATOM 621 CG2 THR A 325 6.475 -10.136 -1.021 1.00 0.00 C ATOM 0 H THR A 325 4.187 -6.808 -1.363 1.00 0.00 H new ATOM 0 HA THR A 325 5.497 -8.308 0.876 1.00 0.00 H new ATOM 0 HB THR A 325 5.182 -8.824 -2.127 1.00 0.00 H new ATOM 0 HG1 THR A 325 3.953 -10.632 -1.318 1.00 0.00 H new ATOM 0 HG21 THR A 325 6.312 -10.982 -1.689 1.00 0.00 H new ATOM 0 HG22 THR A 325 7.382 -9.609 -1.317 1.00 0.00 H new ATOM 0 HG23 THR A 325 6.583 -10.497 0.002 1.00 0.00 H new ATOM 629 N ILE A 326 7.730 -7.259 0.500 1.00 0.00 N ATOM 630 CA ILE A 326 9.091 -6.678 0.264 1.00 0.00 C ATOM 631 C ILE A 326 10.120 -7.502 1.047 1.00 0.00 C ATOM 632 O ILE A 326 9.912 -7.840 2.191 1.00 0.00 O ATOM 633 CB ILE A 326 9.141 -5.229 0.756 1.00 0.00 C ATOM 634 CG1 ILE A 326 8.237 -4.357 -0.121 1.00 0.00 C ATOM 635 CG2 ILE A 326 10.585 -4.713 0.677 1.00 0.00 C ATOM 636 CD1 ILE A 326 8.147 -2.959 0.486 1.00 0.00 C ATOM 0 H ILE A 326 7.554 -7.562 1.458 1.00 0.00 H new ATOM 0 HA ILE A 326 9.312 -6.701 -0.803 1.00 0.00 H new ATOM 0 HB ILE A 326 8.794 -5.184 1.788 1.00 0.00 H new ATOM 0 HG12 ILE A 326 8.636 -4.302 -1.134 1.00 0.00 H new ATOM 0 HG13 ILE A 326 7.244 -4.800 -0.194 1.00 0.00 H new ATOM 0 HG21 ILE A 326 10.622 -3.681 1.027 1.00 0.00 H new ATOM 0 HG22 ILE A 326 11.227 -5.332 1.303 1.00 0.00 H new ATOM 0 HG23 ILE A 326 10.932 -4.759 -0.355 1.00 0.00 H new ATOM 0 HD11 ILE A 326 7.505 -2.334 -0.134 1.00 0.00 H new ATOM 0 HD12 ILE A 326 7.729 -3.025 1.491 1.00 0.00 H new ATOM 0 HD13 ILE A 326 9.143 -2.519 0.536 1.00 0.00 H new ATOM 648 N ASP A 327 11.231 -7.821 0.436 1.00 0.00 N ATOM 649 CA ASP A 327 12.280 -8.618 1.141 1.00 0.00 C ATOM 650 C ASP A 327 11.635 -9.772 1.909 1.00 0.00 C ATOM 651 O ASP A 327 12.157 -10.243 2.900 1.00 0.00 O ATOM 652 CB ASP A 327 13.034 -7.717 2.121 1.00 0.00 C ATOM 653 CG ASP A 327 14.274 -8.447 2.638 1.00 0.00 C ATOM 654 OD1 ASP A 327 15.013 -8.969 1.820 1.00 0.00 O ATOM 655 OD2 ASP A 327 14.466 -8.470 3.843 1.00 0.00 O ATOM 0 H ASP A 327 11.458 -7.563 -0.524 1.00 0.00 H new ATOM 0 HA ASP A 327 12.974 -9.022 0.404 1.00 0.00 H new ATOM 0 HB2 ASP A 327 13.325 -6.789 1.628 1.00 0.00 H new ATOM 0 HB3 ASP A 327 12.386 -7.446 2.954 1.00 0.00 H new ATOM 660 N GLY A 328 10.505 -10.232 1.456 1.00 0.00 N ATOM 661 CA GLY A 328 9.826 -11.358 2.155 1.00 0.00 C ATOM 662 C GLY A 328 9.114 -10.837 3.404 1.00 0.00 C ATOM 663 O GLY A 328 8.402 -11.562 4.070 1.00 0.00 O ATOM 0 H GLY A 328 10.021 -9.877 0.631 1.00 0.00 H new ATOM 0 HA2 GLY A 328 9.107 -11.833 1.487 1.00 0.00 H new ATOM 0 HA3 GLY A 328 10.555 -12.119 2.432 1.00 0.00 H new ATOM 667 N GLU A 329 9.293 -9.584 3.728 1.00 0.00 N ATOM 668 CA GLU A 329 8.622 -9.024 4.926 1.00 0.00 C ATOM 669 C GLU A 329 7.161 -8.742 4.573 1.00 0.00 C ATOM 670 O GLU A 329 6.855 -7.983 3.674 1.00 0.00 O ATOM 671 CB GLU A 329 9.358 -7.741 5.346 1.00 0.00 C ATOM 672 CG GLU A 329 8.430 -6.774 6.087 1.00 0.00 C ATOM 673 CD GLU A 329 7.737 -7.500 7.243 1.00 0.00 C ATOM 674 OE1 GLU A 329 8.402 -8.271 7.916 1.00 0.00 O ATOM 675 OE2 GLU A 329 6.555 -7.271 7.437 1.00 0.00 O ATOM 0 H GLU A 329 9.877 -8.927 3.211 1.00 0.00 H new ATOM 0 HA GLU A 329 8.648 -9.724 5.761 1.00 0.00 H new ATOM 0 HB2 GLU A 329 10.202 -7.998 5.986 1.00 0.00 H new ATOM 0 HB3 GLU A 329 9.766 -7.249 4.463 1.00 0.00 H new ATOM 0 HG2 GLU A 329 9.002 -5.928 6.468 1.00 0.00 H new ATOM 0 HG3 GLU A 329 7.685 -6.372 5.400 1.00 0.00 H new ATOM 682 N THR A 330 6.265 -9.350 5.285 1.00 0.00 N ATOM 683 CA THR A 330 4.810 -9.139 5.022 1.00 0.00 C ATOM 684 C THR A 330 4.286 -8.014 5.911 1.00 0.00 C ATOM 685 O THR A 330 4.314 -8.108 7.122 1.00 0.00 O ATOM 686 CB THR A 330 4.046 -10.430 5.330 1.00 0.00 C ATOM 687 OG1 THR A 330 4.662 -11.515 4.651 1.00 0.00 O ATOM 688 CG2 THR A 330 2.596 -10.291 4.862 1.00 0.00 C ATOM 0 H THR A 330 6.474 -9.993 6.049 1.00 0.00 H new ATOM 0 HA THR A 330 4.666 -8.869 3.976 1.00 0.00 H new ATOM 0 HB THR A 330 4.063 -10.615 6.404 1.00 0.00 H new ATOM 0 HG1 THR A 330 4.176 -12.343 4.848 1.00 0.00 H new ATOM 0 HG21 THR A 330 2.053 -11.210 5.082 1.00 0.00 H new ATOM 0 HG22 THR A 330 2.124 -9.458 5.382 1.00 0.00 H new ATOM 0 HG23 THR A 330 2.576 -10.106 3.788 1.00 0.00 H new ATOM 696 N LYS A 331 3.794 -6.955 5.321 1.00 0.00 N ATOM 697 CA LYS A 331 3.245 -5.821 6.124 1.00 0.00 C ATOM 698 C LYS A 331 1.915 -5.408 5.505 1.00 0.00 C ATOM 699 O LYS A 331 1.721 -5.529 4.311 1.00 0.00 O ATOM 700 CB LYS A 331 4.231 -4.646 6.099 1.00 0.00 C ATOM 701 CG LYS A 331 3.886 -3.637 7.207 1.00 0.00 C ATOM 702 CD LYS A 331 4.361 -4.142 8.580 1.00 0.00 C ATOM 703 CE LYS A 331 4.403 -2.976 9.572 1.00 0.00 C ATOM 704 NZ LYS A 331 4.907 -3.462 10.888 1.00 0.00 N ATOM 0 H LYS A 331 3.749 -6.826 4.310 1.00 0.00 H new ATOM 0 HA LYS A 331 3.096 -6.121 7.161 1.00 0.00 H new ATOM 0 HB2 LYS A 331 5.248 -5.013 6.236 1.00 0.00 H new ATOM 0 HB3 LYS A 331 4.197 -4.155 5.127 1.00 0.00 H new ATOM 0 HG2 LYS A 331 4.353 -2.677 6.987 1.00 0.00 H new ATOM 0 HG3 LYS A 331 2.809 -3.470 7.230 1.00 0.00 H new ATOM 0 HD2 LYS A 331 3.689 -4.919 8.945 1.00 0.00 H new ATOM 0 HD3 LYS A 331 5.350 -4.592 8.491 1.00 0.00 H new ATOM 0 HE2 LYS A 331 5.049 -2.185 9.193 1.00 0.00 H new ATOM 0 HE3 LYS A 331 3.408 -2.547 9.688 1.00 0.00 H new ATOM 0 HZ1 LYS A 331 4.936 -2.671 11.562 1.00 0.00 H new ATOM 0 HZ2 LYS A 331 4.273 -4.203 11.250 1.00 0.00 H new ATOM 0 HZ3 LYS A 331 5.864 -3.852 10.771 1.00 0.00 H new ATOM 718 N VAL A 332 0.985 -4.943 6.302 1.00 0.00 N ATOM 719 CA VAL A 332 -0.350 -4.546 5.750 1.00 0.00 C ATOM 720 C VAL A 332 -0.771 -3.196 6.319 1.00 0.00 C ATOM 721 O VAL A 332 -0.290 -2.763 7.346 1.00 0.00 O ATOM 722 CB VAL A 332 -1.383 -5.618 6.118 1.00 0.00 C ATOM 723 CG1 VAL A 332 -2.581 -5.523 5.173 1.00 0.00 C ATOM 724 CG2 VAL A 332 -0.749 -7.004 5.978 1.00 0.00 C ATOM 0 H VAL A 332 1.091 -4.821 7.309 1.00 0.00 H new ATOM 0 HA VAL A 332 -0.285 -4.459 4.665 1.00 0.00 H new ATOM 0 HB VAL A 332 -1.712 -5.462 7.145 1.00 0.00 H new ATOM 0 HG11 VAL A 332 -3.314 -6.286 5.437 1.00 0.00 H new ATOM 0 HG12 VAL A 332 -3.036 -4.537 5.261 1.00 0.00 H new ATOM 0 HG13 VAL A 332 -2.248 -5.679 4.147 1.00 0.00 H new ATOM 0 HG21 VAL A 332 -1.482 -7.767 6.239 1.00 0.00 H new ATOM 0 HG22 VAL A 332 -0.422 -7.152 4.949 1.00 0.00 H new ATOM 0 HG23 VAL A 332 0.109 -7.081 6.646 1.00 0.00 H new ATOM 734 N PHE A 333 -1.661 -2.517 5.636 1.00 0.00 N ATOM 735 CA PHE A 333 -2.115 -1.172 6.106 1.00 0.00 C ATOM 736 C PHE A 333 -3.629 -1.032 5.934 1.00 0.00 C ATOM 737 O PHE A 333 -4.204 -1.501 4.971 1.00 0.00 O ATOM 738 CB PHE A 333 -1.397 -0.108 5.280 1.00 0.00 C ATOM 739 CG PHE A 333 0.089 -0.258 5.486 1.00 0.00 C ATOM 740 CD1 PHE A 333 0.826 -1.107 4.653 1.00 0.00 C ATOM 741 CD2 PHE A 333 0.727 0.440 6.517 1.00 0.00 C ATOM 742 CE1 PHE A 333 2.202 -1.256 4.849 1.00 0.00 C ATOM 743 CE2 PHE A 333 2.105 0.292 6.711 1.00 0.00 C ATOM 744 CZ PHE A 333 2.842 -0.556 5.878 1.00 0.00 C ATOM 0 H PHE A 333 -2.094 -2.839 4.770 1.00 0.00 H new ATOM 0 HA PHE A 333 -1.880 -1.051 7.163 1.00 0.00 H new ATOM 0 HB2 PHE A 333 -1.645 -0.218 4.224 1.00 0.00 H new ATOM 0 HB3 PHE A 333 -1.722 0.888 5.582 1.00 0.00 H new ATOM 0 HD1 PHE A 333 0.332 -1.647 3.859 1.00 0.00 H new ATOM 0 HD2 PHE A 333 0.157 1.092 7.162 1.00 0.00 H new ATOM 0 HE1 PHE A 333 2.771 -1.911 4.206 1.00 0.00 H new ATOM 0 HE2 PHE A 333 2.600 0.833 7.504 1.00 0.00 H new ATOM 0 HZ PHE A 333 3.905 -0.671 6.029 1.00 0.00 H new ATOM 754 N HIS A 334 -4.276 -0.388 6.872 1.00 0.00 N ATOM 755 CA HIS A 334 -5.758 -0.201 6.793 1.00 0.00 C ATOM 756 C HIS A 334 -6.058 1.210 6.269 1.00 0.00 C ATOM 757 O HIS A 334 -6.839 1.391 5.356 1.00 0.00 O ATOM 758 CB HIS A 334 -6.358 -0.380 8.202 1.00 0.00 C ATOM 759 CG HIS A 334 -7.780 -0.875 8.107 1.00 0.00 C ATOM 760 ND1 HIS A 334 -8.480 -0.897 6.909 1.00 0.00 N ATOM 761 CD2 HIS A 334 -8.638 -1.378 9.052 1.00 0.00 C ATOM 762 CE1 HIS A 334 -9.703 -1.401 7.164 1.00 0.00 C ATOM 763 NE2 HIS A 334 -9.852 -1.710 8.456 1.00 0.00 N ATOM 0 H HIS A 334 -3.837 0.020 7.697 1.00 0.00 H new ATOM 0 HA HIS A 334 -6.197 -0.934 6.117 1.00 0.00 H new ATOM 0 HB2 HIS A 334 -5.757 -1.087 8.773 1.00 0.00 H new ATOM 0 HB3 HIS A 334 -6.331 0.568 8.739 1.00 0.00 H new ATOM 0 HD2 HIS A 334 -8.407 -1.498 10.100 1.00 0.00 H new ATOM 0 HE1 HIS A 334 -10.470 -1.539 6.416 1.00 0.00 H new ATOM 0 HE2 HIS A 334 -10.677 -2.104 8.908 1.00 0.00 H new ATOM 771 N ASP A 335 -5.435 2.211 6.839 1.00 0.00 N ATOM 772 CA ASP A 335 -5.673 3.614 6.376 1.00 0.00 C ATOM 773 C ASP A 335 -4.593 4.000 5.361 1.00 0.00 C ATOM 774 O ASP A 335 -3.483 3.511 5.412 1.00 0.00 O ATOM 775 CB ASP A 335 -5.608 4.563 7.576 1.00 0.00 C ATOM 776 CG ASP A 335 -6.041 5.964 7.142 1.00 0.00 C ATOM 777 OD1 ASP A 335 -6.721 6.066 6.134 1.00 0.00 O ATOM 778 OD2 ASP A 335 -5.686 6.911 7.825 1.00 0.00 O ATOM 0 H ASP A 335 -4.770 2.117 7.607 1.00 0.00 H new ATOM 0 HA ASP A 335 -6.656 3.685 5.910 1.00 0.00 H new ATOM 0 HB2 ASP A 335 -6.256 4.202 8.375 1.00 0.00 H new ATOM 0 HB3 ASP A 335 -4.595 4.592 7.976 1.00 0.00 H new ATOM 783 N LYS A 336 -4.910 4.865 4.435 1.00 0.00 N ATOM 784 CA LYS A 336 -3.899 5.265 3.412 1.00 0.00 C ATOM 785 C LYS A 336 -2.711 5.961 4.082 1.00 0.00 C ATOM 786 O LYS A 336 -1.583 5.815 3.655 1.00 0.00 O ATOM 787 CB LYS A 336 -4.544 6.204 2.388 1.00 0.00 C ATOM 788 CG LYS A 336 -5.445 7.212 3.105 1.00 0.00 C ATOM 789 CD LYS A 336 -5.797 8.350 2.143 1.00 0.00 C ATOM 790 CE LYS A 336 -6.935 9.188 2.728 1.00 0.00 C ATOM 791 NZ LYS A 336 -6.700 9.398 4.184 1.00 0.00 N ATOM 0 H LYS A 336 -5.823 5.311 4.342 1.00 0.00 H new ATOM 0 HA LYS A 336 -3.538 4.371 2.904 1.00 0.00 H new ATOM 0 HB2 LYS A 336 -3.772 6.728 1.825 1.00 0.00 H new ATOM 0 HB3 LYS A 336 -5.127 5.628 1.669 1.00 0.00 H new ATOM 0 HG2 LYS A 336 -6.354 6.721 3.454 1.00 0.00 H new ATOM 0 HG3 LYS A 336 -4.939 7.608 3.985 1.00 0.00 H new ATOM 0 HD2 LYS A 336 -4.922 8.977 1.971 1.00 0.00 H new ATOM 0 HD3 LYS A 336 -6.092 7.943 1.176 1.00 0.00 H new ATOM 0 HE2 LYS A 336 -6.994 10.149 2.216 1.00 0.00 H new ATOM 0 HE3 LYS A 336 -7.889 8.685 2.572 1.00 0.00 H new ATOM 0 HZ1 LYS A 336 -7.252 10.216 4.510 1.00 0.00 H new ATOM 0 HZ2 LYS A 336 -6.994 8.550 4.709 1.00 0.00 H new ATOM 0 HZ3 LYS A 336 -5.689 9.574 4.351 1.00 0.00 H new ATOM 805 N THR A 337 -2.939 6.711 5.124 1.00 0.00 N ATOM 806 CA THR A 337 -1.797 7.393 5.796 1.00 0.00 C ATOM 807 C THR A 337 -0.883 6.342 6.398 1.00 0.00 C ATOM 808 O THR A 337 0.324 6.398 6.261 1.00 0.00 O ATOM 809 CB THR A 337 -2.300 8.284 6.924 1.00 0.00 C ATOM 810 OG1 THR A 337 -3.239 9.221 6.415 1.00 0.00 O ATOM 811 CG2 THR A 337 -1.109 9.023 7.539 1.00 0.00 C ATOM 0 H THR A 337 -3.856 6.880 5.536 1.00 0.00 H new ATOM 0 HA THR A 337 -1.267 7.999 5.060 1.00 0.00 H new ATOM 0 HB THR A 337 -2.789 7.676 7.685 1.00 0.00 H new ATOM 0 HG1 THR A 337 -3.561 9.791 7.145 1.00 0.00 H new ATOM 0 HG21 THR A 337 -1.457 9.665 8.348 1.00 0.00 H new ATOM 0 HG22 THR A 337 -0.395 8.299 7.932 1.00 0.00 H new ATOM 0 HG23 THR A 337 -0.625 9.632 6.776 1.00 0.00 H new ATOM 819 N LYS A 338 -1.455 5.380 7.072 1.00 0.00 N ATOM 820 CA LYS A 338 -0.640 4.307 7.697 1.00 0.00 C ATOM 821 C LYS A 338 0.424 3.847 6.694 1.00 0.00 C ATOM 822 O LYS A 338 1.581 3.682 7.025 1.00 0.00 O ATOM 823 CB LYS A 338 -1.569 3.142 8.076 1.00 0.00 C ATOM 824 CG LYS A 338 -0.969 2.335 9.245 1.00 0.00 C ATOM 825 CD LYS A 338 -1.459 2.902 10.582 1.00 0.00 C ATOM 826 CE LYS A 338 -0.686 2.250 11.728 1.00 0.00 C ATOM 827 NZ LYS A 338 -0.905 0.776 11.704 1.00 0.00 N ATOM 0 H LYS A 338 -2.461 5.294 7.215 1.00 0.00 H new ATOM 0 HA LYS A 338 -0.142 4.671 8.596 1.00 0.00 H new ATOM 0 HB2 LYS A 338 -2.549 3.527 8.357 1.00 0.00 H new ATOM 0 HB3 LYS A 338 -1.717 2.491 7.214 1.00 0.00 H new ATOM 0 HG2 LYS A 338 -1.256 1.287 9.159 1.00 0.00 H new ATOM 0 HG3 LYS A 338 0.120 2.372 9.202 1.00 0.00 H new ATOM 0 HD2 LYS A 338 -1.319 3.983 10.604 1.00 0.00 H new ATOM 0 HD3 LYS A 338 -2.527 2.717 10.698 1.00 0.00 H new ATOM 0 HE2 LYS A 338 0.377 2.471 11.635 1.00 0.00 H new ATOM 0 HE3 LYS A 338 -1.015 2.661 12.682 1.00 0.00 H new ATOM 0 HZ1 LYS A 338 -0.553 0.358 12.589 1.00 0.00 H new ATOM 0 HZ2 LYS A 338 -1.921 0.578 11.608 1.00 0.00 H new ATOM 0 HZ3 LYS A 338 -0.394 0.362 10.899 1.00 0.00 H new ATOM 841 N PHE A 339 0.038 3.677 5.461 1.00 0.00 N ATOM 842 CA PHE A 339 1.022 3.272 4.421 1.00 0.00 C ATOM 843 C PHE A 339 2.035 4.406 4.248 1.00 0.00 C ATOM 844 O PHE A 339 3.215 4.241 4.467 1.00 0.00 O ATOM 845 CB PHE A 339 0.292 3.026 3.100 1.00 0.00 C ATOM 846 CG PHE A 339 1.286 2.618 2.035 1.00 0.00 C ATOM 847 CD1 PHE A 339 1.840 1.332 2.049 1.00 0.00 C ATOM 848 CD2 PHE A 339 1.650 3.525 1.032 1.00 0.00 C ATOM 849 CE1 PHE A 339 2.756 0.953 1.059 1.00 0.00 C ATOM 850 CE2 PHE A 339 2.566 3.147 0.044 1.00 0.00 C ATOM 851 CZ PHE A 339 3.120 1.859 0.055 1.00 0.00 C ATOM 0 H PHE A 339 -0.918 3.801 5.128 1.00 0.00 H new ATOM 0 HA PHE A 339 1.534 2.357 4.719 1.00 0.00 H new ATOM 0 HB2 PHE A 339 -0.459 2.246 3.228 1.00 0.00 H new ATOM 0 HB3 PHE A 339 -0.236 3.929 2.792 1.00 0.00 H new ATOM 0 HD1 PHE A 339 1.561 0.632 2.823 1.00 0.00 H new ATOM 0 HD2 PHE A 339 1.223 4.517 1.021 1.00 0.00 H new ATOM 0 HE1 PHE A 339 3.182 -0.039 1.070 1.00 0.00 H new ATOM 0 HE2 PHE A 339 2.847 3.848 -0.728 1.00 0.00 H new ATOM 0 HZ PHE A 339 3.825 1.566 -0.709 1.00 0.00 H new ATOM 861 N THR A 340 1.574 5.565 3.860 1.00 0.00 N ATOM 862 CA THR A 340 2.495 6.728 3.672 1.00 0.00 C ATOM 863 C THR A 340 3.517 6.784 4.814 1.00 0.00 C ATOM 864 O THR A 340 4.672 7.102 4.610 1.00 0.00 O ATOM 865 CB THR A 340 1.674 8.021 3.652 1.00 0.00 C ATOM 866 OG1 THR A 340 0.701 7.946 2.620 1.00 0.00 O ATOM 867 CG2 THR A 340 2.595 9.214 3.398 1.00 0.00 C ATOM 0 H THR A 340 0.592 5.759 3.663 1.00 0.00 H new ATOM 0 HA THR A 340 3.029 6.615 2.729 1.00 0.00 H new ATOM 0 HB THR A 340 1.178 8.148 4.614 1.00 0.00 H new ATOM 0 HG1 THR A 340 0.174 8.772 2.607 1.00 0.00 H new ATOM 0 HG21 THR A 340 2.007 10.131 3.385 1.00 0.00 H new ATOM 0 HG22 THR A 340 3.341 9.273 4.190 1.00 0.00 H new ATOM 0 HG23 THR A 340 3.095 9.090 2.437 1.00 0.00 H new ATOM 875 N GLN A 341 3.107 6.466 6.011 1.00 0.00 N ATOM 876 CA GLN A 341 4.066 6.487 7.153 1.00 0.00 C ATOM 877 C GLN A 341 5.135 5.426 6.917 1.00 0.00 C ATOM 878 O GLN A 341 6.303 5.647 7.150 1.00 0.00 O ATOM 879 CB GLN A 341 3.321 6.181 8.454 1.00 0.00 C ATOM 880 CG GLN A 341 2.480 7.391 8.862 1.00 0.00 C ATOM 881 CD GLN A 341 1.568 7.009 10.029 1.00 0.00 C ATOM 882 OE1 GLN A 341 0.316 6.727 9.795 1.00 0.00 O flip ATOM 883 NE2 GLN A 341 2.000 6.965 11.164 1.00 0.00 N flip ATOM 0 H GLN A 341 2.153 6.193 6.248 1.00 0.00 H new ATOM 0 HA GLN A 341 4.529 7.471 7.229 1.00 0.00 H new ATOM 0 HB2 GLN A 341 2.681 5.309 8.321 1.00 0.00 H new ATOM 0 HB3 GLN A 341 4.032 5.937 9.243 1.00 0.00 H new ATOM 0 HG2 GLN A 341 3.129 8.218 9.150 1.00 0.00 H new ATOM 0 HG3 GLN A 341 1.883 7.734 8.017 1.00 0.00 H new ATOM 0 HE21 GLN A 341 2.979 7.186 11.346 1.00 0.00 H new ATOM 0 HE22 GLN A 341 1.384 6.707 11.935 1.00 0.00 H new ATOM 892 N TYR A 342 4.738 4.273 6.452 1.00 0.00 N ATOM 893 CA TYR A 342 5.731 3.186 6.196 1.00 0.00 C ATOM 894 C TYR A 342 6.903 3.749 5.389 1.00 0.00 C ATOM 895 O TYR A 342 8.051 3.440 5.641 1.00 0.00 O ATOM 896 CB TYR A 342 5.057 2.051 5.420 1.00 0.00 C ATOM 897 CG TYR A 342 6.078 1.005 5.025 1.00 0.00 C ATOM 898 CD1 TYR A 342 6.819 0.341 6.008 1.00 0.00 C ATOM 899 CD2 TYR A 342 6.279 0.699 3.673 1.00 0.00 C ATOM 900 CE1 TYR A 342 7.761 -0.628 5.640 1.00 0.00 C ATOM 901 CE2 TYR A 342 7.222 -0.270 3.305 1.00 0.00 C ATOM 902 CZ TYR A 342 7.963 -0.932 4.289 1.00 0.00 C ATOM 903 OH TYR A 342 8.892 -1.887 3.925 1.00 0.00 O ATOM 0 H TYR A 342 3.770 4.035 6.238 1.00 0.00 H new ATOM 0 HA TYR A 342 6.103 2.797 7.144 1.00 0.00 H new ATOM 0 HB2 TYR A 342 4.278 1.596 6.032 1.00 0.00 H new ATOM 0 HB3 TYR A 342 4.571 2.449 4.529 1.00 0.00 H new ATOM 0 HD1 TYR A 342 6.665 0.575 7.051 1.00 0.00 H new ATOM 0 HD2 TYR A 342 5.707 1.210 2.913 1.00 0.00 H new ATOM 0 HE1 TYR A 342 8.332 -1.141 6.400 1.00 0.00 H new ATOM 0 HE2 TYR A 342 7.376 -0.505 2.262 1.00 0.00 H new ATOM 0 HH TYR A 342 8.966 -2.559 4.635 1.00 0.00 H new ATOM 913 N LEU A 343 6.627 4.571 4.417 1.00 0.00 N ATOM 914 CA LEU A 343 7.740 5.158 3.606 1.00 0.00 C ATOM 915 C LEU A 343 8.360 6.343 4.347 1.00 0.00 C ATOM 916 O LEU A 343 9.563 6.501 4.378 1.00 0.00 O ATOM 917 CB LEU A 343 7.224 5.649 2.247 1.00 0.00 C ATOM 918 CG LEU A 343 6.128 4.732 1.720 1.00 0.00 C ATOM 919 CD1 LEU A 343 5.637 5.301 0.399 1.00 0.00 C ATOM 920 CD2 LEU A 343 6.694 3.338 1.473 1.00 0.00 C ATOM 0 H LEU A 343 5.688 4.863 4.147 1.00 0.00 H new ATOM 0 HA LEU A 343 8.487 4.379 3.450 1.00 0.00 H new ATOM 0 HB2 LEU A 343 6.839 6.664 2.344 1.00 0.00 H new ATOM 0 HB3 LEU A 343 8.047 5.687 1.533 1.00 0.00 H new ATOM 0 HG LEU A 343 5.316 4.666 2.444 1.00 0.00 H new ATOM 0 HD11 LEU A 343 4.850 4.663 -0.002 1.00 0.00 H new ATOM 0 HD12 LEU A 343 5.244 6.305 0.559 1.00 0.00 H new ATOM 0 HD13 LEU A 343 6.465 5.344 -0.309 1.00 0.00 H new ATOM 0 HD21 LEU A 343 5.905 2.687 1.096 1.00 0.00 H new ATOM 0 HD22 LEU A 343 7.498 3.396 0.739 1.00 0.00 H new ATOM 0 HD23 LEU A 343 7.084 2.933 2.407 1.00 0.00 H new ATOM 932 N SER A 344 7.552 7.186 4.933 1.00 0.00 N ATOM 933 CA SER A 344 8.113 8.359 5.660 1.00 0.00 C ATOM 934 C SER A 344 9.239 7.881 6.574 1.00 0.00 C ATOM 935 O SER A 344 10.146 8.621 6.898 1.00 0.00 O ATOM 936 CB SER A 344 7.016 9.020 6.495 1.00 0.00 C ATOM 937 OG SER A 344 7.490 10.264 6.992 1.00 0.00 O ATOM 0 H SER A 344 6.535 7.113 4.939 1.00 0.00 H new ATOM 0 HA SER A 344 8.501 9.085 4.946 1.00 0.00 H new ATOM 0 HB2 SER A 344 6.124 9.174 5.888 1.00 0.00 H new ATOM 0 HB3 SER A 344 6.731 8.370 7.322 1.00 0.00 H new ATOM 0 HG SER A 344 6.789 10.691 7.527 1.00 0.00 H new ATOM 943 N THR A 345 9.187 6.635 6.977 1.00 0.00 N ATOM 944 CA THR A 345 10.254 6.076 7.859 1.00 0.00 C ATOM 945 C THR A 345 11.195 5.198 7.025 1.00 0.00 C ATOM 946 O THR A 345 12.140 4.630 7.534 1.00 0.00 O ATOM 947 CB THR A 345 9.609 5.263 8.991 1.00 0.00 C ATOM 948 OG1 THR A 345 10.613 4.849 9.906 1.00 0.00 O ATOM 949 CG2 THR A 345 8.891 4.036 8.432 1.00 0.00 C ATOM 0 H THR A 345 8.446 5.979 6.730 1.00 0.00 H new ATOM 0 HA THR A 345 10.834 6.886 8.301 1.00 0.00 H new ATOM 0 HB THR A 345 8.879 5.891 9.501 1.00 0.00 H new ATOM 0 HG1 THR A 345 11.473 4.782 9.440 1.00 0.00 H new ATOM 0 HG21 THR A 345 8.441 3.474 9.250 1.00 0.00 H new ATOM 0 HG22 THR A 345 8.112 4.354 7.739 1.00 0.00 H new ATOM 0 HG23 THR A 345 9.607 3.403 7.907 1.00 0.00 H new ATOM 957 N ASN A 346 10.948 5.091 5.736 1.00 0.00 N ATOM 958 CA ASN A 346 11.830 4.260 4.855 1.00 0.00 C ATOM 959 C ASN A 346 12.058 5.025 3.540 1.00 0.00 C ATOM 960 O ASN A 346 11.437 4.746 2.534 1.00 0.00 O ATOM 961 CB ASN A 346 11.148 2.908 4.579 1.00 0.00 C ATOM 962 CG ASN A 346 11.771 2.238 3.350 1.00 0.00 C ATOM 963 OD1 ASN A 346 11.184 2.360 2.190 1.00 0.00 O flip ATOM 964 ND2 ASN A 346 12.801 1.600 3.446 1.00 0.00 N flip ATOM 0 H ASN A 346 10.170 5.546 5.258 1.00 0.00 H new ATOM 0 HA ASN A 346 12.788 4.072 5.339 1.00 0.00 H new ATOM 0 HB2 ASN A 346 11.251 2.257 5.447 1.00 0.00 H new ATOM 0 HB3 ASN A 346 10.080 3.058 4.418 1.00 0.00 H new ATOM 0 HD21 ASN A 346 13.259 1.505 4.352 1.00 0.00 H new ATOM 0 HD22 ASN A 346 13.207 1.160 2.620 1.00 0.00 H new ATOM 971 N PRO A 347 12.940 5.995 3.563 1.00 0.00 N ATOM 972 CA PRO A 347 13.265 6.840 2.369 1.00 0.00 C ATOM 973 C PRO A 347 13.586 6.016 1.113 1.00 0.00 C ATOM 974 O PRO A 347 13.313 6.431 0.003 1.00 0.00 O ATOM 975 CB PRO A 347 14.496 7.641 2.820 1.00 0.00 C ATOM 976 CG PRO A 347 14.382 7.713 4.307 1.00 0.00 C ATOM 977 CD PRO A 347 13.733 6.397 4.739 1.00 0.00 C ATOM 0 HA PRO A 347 12.417 7.459 2.077 1.00 0.00 H new ATOM 0 HB2 PRO A 347 15.420 7.149 2.518 1.00 0.00 H new ATOM 0 HB3 PRO A 347 14.505 8.636 2.376 1.00 0.00 H new ATOM 0 HG2 PRO A 347 15.362 7.836 4.769 1.00 0.00 H new ATOM 0 HG3 PRO A 347 13.776 8.566 4.612 1.00 0.00 H new ATOM 0 HD2 PRO A 347 14.481 5.646 4.993 1.00 0.00 H new ATOM 0 HD3 PRO A 347 13.104 6.531 5.619 1.00 0.00 H new ATOM 985 N ALA A 348 14.174 4.862 1.274 1.00 0.00 N ATOM 986 CA ALA A 348 14.523 4.028 0.086 1.00 0.00 C ATOM 987 C ALA A 348 13.334 3.963 -0.877 1.00 0.00 C ATOM 988 O ALA A 348 13.466 4.202 -2.065 1.00 0.00 O ATOM 989 CB ALA A 348 14.887 2.612 0.538 1.00 0.00 C ATOM 0 H ALA A 348 14.428 4.460 2.176 1.00 0.00 H new ATOM 0 HA ALA A 348 15.374 4.479 -0.424 1.00 0.00 H new ATOM 0 HB1 ALA A 348 15.141 2.006 -0.332 1.00 0.00 H new ATOM 0 HB2 ALA A 348 15.742 2.654 1.213 1.00 0.00 H new ATOM 0 HB3 ALA A 348 14.038 2.166 1.055 1.00 0.00 H new ATOM 995 N LEU A 349 12.170 3.643 -0.385 1.00 0.00 N ATOM 996 CA LEU A 349 10.996 3.565 -1.294 1.00 0.00 C ATOM 997 C LEU A 349 10.623 4.975 -1.758 1.00 0.00 C ATOM 998 O LEU A 349 10.568 5.247 -2.937 1.00 0.00 O ATOM 999 CB LEU A 349 9.802 2.943 -0.566 1.00 0.00 C ATOM 1000 CG LEU A 349 9.927 1.413 -0.522 1.00 0.00 C ATOM 1001 CD1 LEU A 349 8.749 0.857 0.283 1.00 0.00 C ATOM 1002 CD2 LEU A 349 9.913 0.812 -1.947 1.00 0.00 C ATOM 0 H LEU A 349 11.983 3.434 0.596 1.00 0.00 H new ATOM 0 HA LEU A 349 11.252 2.944 -2.152 1.00 0.00 H new ATOM 0 HB2 LEU A 349 9.743 3.337 0.449 1.00 0.00 H new ATOM 0 HB3 LEU A 349 8.877 3.222 -1.070 1.00 0.00 H new ATOM 0 HG LEU A 349 10.874 1.144 -0.055 1.00 0.00 H new ATOM 0 HD11 LEU A 349 8.819 -0.230 0.327 1.00 0.00 H new ATOM 0 HD12 LEU A 349 8.775 1.263 1.294 1.00 0.00 H new ATOM 0 HD13 LEU A 349 7.813 1.142 -0.198 1.00 0.00 H new ATOM 0 HD21 LEU A 349 10.003 -0.273 -1.885 1.00 0.00 H new ATOM 0 HD22 LEU A 349 8.977 1.071 -2.442 1.00 0.00 H new ATOM 0 HD23 LEU A 349 10.749 1.213 -2.519 1.00 0.00 H new ATOM 1014 N GLN A 350 10.359 5.870 -0.839 1.00 0.00 N ATOM 1015 CA GLN A 350 9.978 7.264 -1.229 1.00 0.00 C ATOM 1016 C GLN A 350 10.890 7.742 -2.368 1.00 0.00 C ATOM 1017 O GLN A 350 10.476 8.492 -3.229 1.00 0.00 O ATOM 1018 CB GLN A 350 10.103 8.192 0.005 1.00 0.00 C ATOM 1019 CG GLN A 350 8.714 8.663 0.464 1.00 0.00 C ATOM 1020 CD GLN A 350 8.853 9.542 1.707 1.00 0.00 C ATOM 1021 OE1 GLN A 350 9.920 9.435 2.450 1.00 0.00 O flip ATOM 1022 NE2 GLN A 350 7.982 10.335 2.006 1.00 0.00 N flip ATOM 0 H GLN A 350 10.391 5.696 0.166 1.00 0.00 H new ATOM 0 HA GLN A 350 8.946 7.287 -1.579 1.00 0.00 H new ATOM 0 HB2 GLN A 350 10.601 7.663 0.817 1.00 0.00 H new ATOM 0 HB3 GLN A 350 10.723 9.054 -0.241 1.00 0.00 H new ATOM 0 HG2 GLN A 350 8.226 9.221 -0.335 1.00 0.00 H new ATOM 0 HG3 GLN A 350 8.082 7.803 0.684 1.00 0.00 H new ATOM 0 HE21 GLN A 350 7.148 10.419 1.425 1.00 0.00 H new ATOM 0 HE22 GLN A 350 8.085 10.917 2.838 1.00 0.00 H new ATOM 1031 N ARG A 351 12.114 7.294 -2.396 1.00 0.00 N ATOM 1032 CA ARG A 351 13.017 7.702 -3.490 1.00 0.00 C ATOM 1033 C ARG A 351 12.437 7.180 -4.803 1.00 0.00 C ATOM 1034 O ARG A 351 12.325 7.897 -5.777 1.00 0.00 O ATOM 1035 CB ARG A 351 14.394 7.088 -3.254 1.00 0.00 C ATOM 1036 CG ARG A 351 15.345 7.588 -4.329 1.00 0.00 C ATOM 1037 CD ARG A 351 16.753 7.053 -4.063 1.00 0.00 C ATOM 1038 NE ARG A 351 16.803 5.602 -4.395 1.00 0.00 N ATOM 1039 CZ ARG A 351 17.953 5.000 -4.522 1.00 0.00 C ATOM 1040 NH1 ARG A 351 19.061 5.665 -4.345 1.00 0.00 N ATOM 1041 NH2 ARG A 351 17.995 3.730 -4.826 1.00 0.00 N ATOM 0 H ARG A 351 12.522 6.663 -1.706 1.00 0.00 H new ATOM 0 HA ARG A 351 13.112 8.787 -3.528 1.00 0.00 H new ATOM 0 HB2 ARG A 351 14.764 7.361 -2.266 1.00 0.00 H new ATOM 0 HB3 ARG A 351 14.332 6.000 -3.282 1.00 0.00 H new ATOM 0 HG2 ARG A 351 15.002 7.263 -5.311 1.00 0.00 H new ATOM 0 HG3 ARG A 351 15.356 8.678 -4.340 1.00 0.00 H new ATOM 0 HD2 ARG A 351 17.481 7.600 -4.663 1.00 0.00 H new ATOM 0 HD3 ARG A 351 17.021 7.207 -3.018 1.00 0.00 H new ATOM 0 HE ARG A 351 15.937 5.079 -4.523 1.00 0.00 H new ATOM 0 HH11 ARG A 351 19.028 6.656 -4.107 1.00 0.00 H new ATOM 0 HH12 ARG A 351 19.960 5.194 -4.444 1.00 0.00 H new ATOM 0 HH21 ARG A 351 17.129 3.210 -4.964 1.00 0.00 H new ATOM 0 HH22 ARG A 351 18.894 3.259 -4.925 1.00 0.00 H new ATOM 1055 N ILE A 352 12.054 5.929 -4.826 1.00 0.00 N ATOM 1056 CA ILE A 352 11.462 5.345 -6.067 1.00 0.00 C ATOM 1057 C ILE A 352 9.943 5.533 -6.026 1.00 0.00 C ATOM 1058 O ILE A 352 9.360 6.168 -6.880 1.00 0.00 O ATOM 1059 CB ILE A 352 11.792 3.850 -6.142 1.00 0.00 C ATOM 1060 CG1 ILE A 352 13.272 3.623 -5.814 1.00 0.00 C ATOM 1061 CG2 ILE A 352 11.508 3.341 -7.557 1.00 0.00 C ATOM 1062 CD1 ILE A 352 13.552 2.122 -5.743 1.00 0.00 C ATOM 0 H ILE A 352 12.126 5.286 -4.038 1.00 0.00 H new ATOM 0 HA ILE A 352 11.874 5.845 -6.943 1.00 0.00 H new ATOM 0 HB ILE A 352 11.177 3.311 -5.421 1.00 0.00 H new ATOM 0 HG12 ILE A 352 13.900 4.086 -6.576 1.00 0.00 H new ATOM 0 HG13 ILE A 352 13.522 4.096 -4.864 1.00 0.00 H new ATOM 0 HG21 ILE A 352 11.741 2.278 -7.615 1.00 0.00 H new ATOM 0 HG22 ILE A 352 10.455 3.495 -7.795 1.00 0.00 H new ATOM 0 HG23 ILE A 352 12.125 3.887 -8.271 1.00 0.00 H new ATOM 0 HD11 ILE A 352 14.604 1.959 -5.510 1.00 0.00 H new ATOM 0 HD12 ILE A 352 12.934 1.673 -4.965 1.00 0.00 H new ATOM 0 HD13 ILE A 352 13.318 1.662 -6.703 1.00 0.00 H new ATOM 1074 N ILE A 353 9.303 4.995 -5.023 1.00 0.00 N ATOM 1075 CA ILE A 353 7.827 5.147 -4.903 1.00 0.00 C ATOM 1076 C ILE A 353 7.507 6.612 -4.581 1.00 0.00 C ATOM 1077 O ILE A 353 6.402 7.075 -4.777 1.00 0.00 O ATOM 1078 CB ILE A 353 7.320 4.221 -3.780 1.00 0.00 C ATOM 1079 CG1 ILE A 353 7.342 2.773 -4.299 1.00 0.00 C ATOM 1080 CG2 ILE A 353 5.890 4.609 -3.359 1.00 0.00 C ATOM 1081 CD1 ILE A 353 6.843 1.802 -3.221 1.00 0.00 C ATOM 0 H ILE A 353 9.743 4.454 -4.278 1.00 0.00 H new ATOM 0 HA ILE A 353 7.334 4.873 -5.835 1.00 0.00 H new ATOM 0 HB ILE A 353 7.965 4.319 -2.907 1.00 0.00 H new ATOM 0 HG12 ILE A 353 6.716 2.691 -5.187 1.00 0.00 H new ATOM 0 HG13 ILE A 353 8.355 2.504 -4.597 1.00 0.00 H new ATOM 0 HG21 ILE A 353 5.551 3.943 -2.565 1.00 0.00 H new ATOM 0 HG22 ILE A 353 5.884 5.637 -2.997 1.00 0.00 H new ATOM 0 HG23 ILE A 353 5.222 4.522 -4.216 1.00 0.00 H new ATOM 0 HD11 ILE A 353 6.867 0.784 -3.609 1.00 0.00 H new ATOM 0 HD12 ILE A 353 7.486 1.871 -2.343 1.00 0.00 H new ATOM 0 HD13 ILE A 353 5.821 2.061 -2.943 1.00 0.00 H new