USER MOD reduce.3.24.130724 H: found=0, std=0, add=819, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 822 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: B 55 THR OG1 : rot 113:sc= 0.0501 USER MOD Set 1.2: B 57 SER OG : rot 180:sc= 0.396 USER MOD Single : A 255 TYR OH : rot 180:sc= 0 USER MOD Single : A 265 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 270 SER OG : rot 110:sc= -0.299 USER MOD Single : A 272 LYS NZ :NH3+ 166:sc= -0.0349 (180deg=-0.234) USER MOD Single : A 274 SER OG : rot -22:sc= 1.09 USER MOD Single : A 276 ASN : amide:sc= -0.133 K(o=-0.13,f=-3.4!) USER MOD Single : A 277 SER OG : rot 180:sc= 0 USER MOD Single : B 1 MET CE :methyl -157:sc= -0.333 (180deg=-1.57!) USER MOD Single : B 1 MET N :NH3+ 173:sc= 1.02 (180deg=0.902) USER MOD Single : B 2 GLN : amide:sc= -0.0013 X(o=-0.0013,f=-0.17) USER MOD Single : B 6 LYS NZ :NH3+ -164:sc= -0.0348 (180deg=-0.323) USER MOD Single : B 7 THR OG1 : rot -170:sc= -0.0728 USER MOD Single : B 9 THR OG1 : rot 180:sc= 0 USER MOD Single : B 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 12 THR OG1 : rot 180:sc= -0.199 USER MOD Single : B 14 THR OG1 : rot -26:sc= 2.06 USER MOD Single : B 19 SER OG : rot 180:sc= 0 USER MOD Single : B 20 SER OG : rot 180:sc= 0 USER MOD Single : B 22 THR OG1 : rot 180:sc= 0 USER MOD Single : B 25 ASN : amide:sc= -2.18! C(o=-2.2!,f=-7.9!) USER MOD Single : B 27 LYS NZ :NH3+ -175:sc= -1.13 (180deg=-1.16) USER MOD Single : B 28 SER OG : rot 180:sc= 0 USER MOD Single : B 29 LYS NZ :NH3+ -128:sc= 1.24 (180deg=-0.232) USER MOD Single : B 31 GLN : amide:sc= -2.6! C(o=-2.6!,f=-2.2!) USER MOD Single : B 33 LYS NZ :NH3+ -159:sc= -2.47! (180deg=-3.85!) USER MOD Single : B 40 GLN : amide:sc= -2.64! K(o=-2.6!,f=-1) USER MOD Single : B 41 GLN : amide:sc= -6.82! C(o=-6.8!,f=-15!) USER MOD Single : B 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 49 GLN : amide:sc= -4.62! K(o=-4.6!,f=-1.5) USER MOD Single : B 59 TYR OH : rot 165:sc= -0.0731 USER MOD Single : B 60 ASN : amide:sc= -0.589 X(o=-0.59,f=-0.54) USER MOD Single : B 62 GLN : amide:sc= -1.07! K(o=-1.1!,f=0) USER MOD Single : B 63 LYS NZ :NH3+ 143:sc= -3.1! (180deg=-5.77!) USER MOD Single : B 65 SER OG : rot 100:sc= -0.115 USER MOD Single : B 66 THR OG1 : rot 180:sc= 0 USER MOD Single : B 68 HIS : no HE2:sc= -2.85! X(o=-2.8!,f=-2.5) USER MOD ----------------------------------------------------------------- ATOM 1 N TYR A 255 24.244 -2.453 -7.587 1.00 0.00 N ATOM 2 CA TYR A 255 23.639 -2.685 -6.249 1.00 0.00 C ATOM 3 C TYR A 255 22.175 -2.244 -6.222 1.00 0.00 C ATOM 4 O TYR A 255 21.863 -1.095 -6.534 1.00 0.00 O ATOM 5 CB TYR A 255 24.448 -1.899 -5.212 1.00 0.00 C ATOM 6 CG TYR A 255 23.927 -2.027 -3.796 1.00 0.00 C ATOM 7 CD1 TYR A 255 23.783 -3.271 -3.193 1.00 0.00 C ATOM 8 CD2 TYR A 255 23.576 -0.900 -3.064 1.00 0.00 C ATOM 9 CE1 TYR A 255 23.305 -3.387 -1.901 1.00 0.00 C ATOM 10 CE2 TYR A 255 23.098 -1.008 -1.771 1.00 0.00 C ATOM 11 CZ TYR A 255 22.964 -2.253 -1.195 1.00 0.00 C ATOM 12 OH TYR A 255 22.488 -2.363 0.090 1.00 0.00 O ATOM 0 HA TYR A 255 23.664 -3.750 -6.020 1.00 0.00 H new ATOM 0 HB2 TYR A 255 25.483 -2.240 -5.239 1.00 0.00 H new ATOM 0 HB3 TYR A 255 24.452 -0.846 -5.492 1.00 0.00 H new ATOM 0 HD1 TYR A 255 24.049 -4.162 -3.743 1.00 0.00 H new ATOM 0 HD2 TYR A 255 23.678 0.077 -3.512 1.00 0.00 H new ATOM 0 HE1 TYR A 255 23.199 -4.361 -1.447 1.00 0.00 H new ATOM 0 HE2 TYR A 255 22.831 -0.121 -1.215 1.00 0.00 H new ATOM 0 HH TYR A 255 22.296 -1.470 0.445 1.00 0.00 H new ATOM 24 N PRO A 256 21.254 -3.151 -5.844 1.00 0.00 N ATOM 25 CA PRO A 256 19.821 -2.841 -5.776 1.00 0.00 C ATOM 26 C PRO A 256 19.518 -1.763 -4.741 1.00 0.00 C ATOM 27 O PRO A 256 20.042 -1.797 -3.627 1.00 0.00 O ATOM 28 CB PRO A 256 19.175 -4.172 -5.365 1.00 0.00 C ATOM 29 CG PRO A 256 20.203 -5.213 -5.652 1.00 0.00 C ATOM 30 CD PRO A 256 21.530 -4.543 -5.453 1.00 0.00 C ATOM 0 HA PRO A 256 19.446 -2.451 -6.722 1.00 0.00 H new ATOM 0 HB2 PRO A 256 18.903 -4.168 -4.309 1.00 0.00 H new ATOM 0 HB3 PRO A 256 18.261 -4.356 -5.929 1.00 0.00 H new ATOM 0 HG2 PRO A 256 20.092 -6.067 -4.984 1.00 0.00 H new ATOM 0 HG3 PRO A 256 20.104 -5.590 -6.670 1.00 0.00 H new ATOM 0 HD2 PRO A 256 21.868 -4.613 -4.419 1.00 0.00 H new ATOM 0 HD3 PRO A 256 22.306 -4.991 -6.073 1.00 0.00 H new ATOM 38 N GLU A 257 18.671 -0.808 -5.112 1.00 0.00 N ATOM 39 CA GLU A 257 18.302 0.278 -4.210 1.00 0.00 C ATOM 40 C GLU A 257 17.636 -0.264 -2.948 1.00 0.00 C ATOM 41 O GLU A 257 16.894 -1.245 -3.000 1.00 0.00 O ATOM 42 CB GLU A 257 17.370 1.267 -4.914 1.00 0.00 C ATOM 43 CG GLU A 257 16.072 0.643 -5.402 1.00 0.00 C ATOM 44 CD GLU A 257 15.179 1.641 -6.111 1.00 0.00 C ATOM 45 OE1 GLU A 257 14.799 2.651 -5.481 1.00 0.00 O ATOM 46 OE2 GLU A 257 14.860 1.415 -7.298 1.00 0.00 O ATOM 0 H GLU A 257 18.228 -0.764 -6.030 1.00 0.00 H new ATOM 0 HA GLU A 257 19.214 0.800 -3.921 1.00 0.00 H new ATOM 0 HB2 GLU A 257 17.136 2.082 -4.229 1.00 0.00 H new ATOM 0 HB3 GLU A 257 17.894 1.705 -5.764 1.00 0.00 H new ATOM 0 HG2 GLU A 257 16.300 -0.180 -6.079 1.00 0.00 H new ATOM 0 HG3 GLU A 257 15.535 0.219 -4.554 1.00 0.00 H new ATOM 53 N ASP A 258 17.914 0.380 -1.817 1.00 0.00 N ATOM 54 CA ASP A 258 17.352 -0.031 -0.531 1.00 0.00 C ATOM 55 C ASP A 258 15.831 -0.151 -0.611 1.00 0.00 C ATOM 56 O ASP A 258 15.216 -0.908 0.141 1.00 0.00 O ATOM 57 CB ASP A 258 17.742 0.971 0.560 1.00 0.00 C ATOM 58 CG ASP A 258 17.360 0.502 1.951 1.00 0.00 C ATOM 59 OD1 ASP A 258 16.862 -0.636 2.082 1.00 0.00 O ATOM 60 OD2 ASP A 258 17.568 1.270 2.914 1.00 0.00 O ATOM 0 H ASP A 258 18.528 1.193 -1.764 1.00 0.00 H new ATOM 0 HA ASP A 258 17.760 -1.010 -0.280 1.00 0.00 H new ATOM 0 HB2 ASP A 258 18.818 1.143 0.522 1.00 0.00 H new ATOM 0 HB3 ASP A 258 17.259 1.927 0.358 1.00 0.00 H new ATOM 65 N GLU A 259 15.231 0.603 -1.526 1.00 0.00 N ATOM 66 CA GLU A 259 13.785 0.591 -1.710 1.00 0.00 C ATOM 67 C GLU A 259 13.272 -0.814 -2.020 1.00 0.00 C ATOM 68 O GLU A 259 12.244 -1.238 -1.490 1.00 0.00 O ATOM 69 CB GLU A 259 13.399 1.541 -2.844 1.00 0.00 C ATOM 70 CG GLU A 259 11.917 1.525 -3.168 1.00 0.00 C ATOM 71 CD GLU A 259 11.575 2.368 -4.380 1.00 0.00 C ATOM 72 OE1 GLU A 259 12.134 2.101 -5.465 1.00 0.00 O ATOM 73 OE2 GLU A 259 10.743 3.289 -4.248 1.00 0.00 O ATOM 0 H GLU A 259 15.728 1.234 -2.155 1.00 0.00 H new ATOM 0 HA GLU A 259 13.326 0.921 -0.778 1.00 0.00 H new ATOM 0 HB2 GLU A 259 13.693 2.555 -2.574 1.00 0.00 H new ATOM 0 HB3 GLU A 259 13.961 1.274 -3.739 1.00 0.00 H new ATOM 0 HG2 GLU A 259 11.599 0.497 -3.344 1.00 0.00 H new ATOM 0 HG3 GLU A 259 11.357 1.890 -2.307 1.00 0.00 H new ATOM 80 N GLU A 260 13.985 -1.525 -2.888 1.00 0.00 N ATOM 81 CA GLU A 260 13.595 -2.878 -3.278 1.00 0.00 C ATOM 82 C GLU A 260 13.457 -3.797 -2.066 1.00 0.00 C ATOM 83 O GLU A 260 12.534 -4.608 -1.998 1.00 0.00 O ATOM 84 CB GLU A 260 14.613 -3.464 -4.260 1.00 0.00 C ATOM 85 CG GLU A 260 14.699 -2.712 -5.581 1.00 0.00 C ATOM 86 CD GLU A 260 13.410 -2.769 -6.382 1.00 0.00 C ATOM 87 OE1 GLU A 260 12.453 -3.433 -5.929 1.00 0.00 O ATOM 88 OE2 GLU A 260 13.360 -2.153 -7.468 1.00 0.00 O ATOM 0 H GLU A 260 14.837 -1.187 -3.336 1.00 0.00 H new ATOM 0 HA GLU A 260 12.621 -2.810 -3.763 1.00 0.00 H new ATOM 0 HB2 GLU A 260 15.596 -3.467 -3.790 1.00 0.00 H new ATOM 0 HB3 GLU A 260 14.353 -4.503 -4.461 1.00 0.00 H new ATOM 0 HG2 GLU A 260 14.952 -1.670 -5.384 1.00 0.00 H new ATOM 0 HG3 GLU A 260 15.510 -3.129 -6.178 1.00 0.00 H new ATOM 95 N GLU A 261 14.381 -3.674 -1.117 1.00 0.00 N ATOM 96 CA GLU A 261 14.358 -4.505 0.084 1.00 0.00 C ATOM 97 C GLU A 261 13.056 -4.335 0.862 1.00 0.00 C ATOM 98 O GLU A 261 12.384 -5.314 1.175 1.00 0.00 O ATOM 99 CB GLU A 261 15.550 -4.180 0.987 1.00 0.00 C ATOM 100 CG GLU A 261 16.876 -4.720 0.472 1.00 0.00 C ATOM 101 CD GLU A 261 17.235 -4.191 -0.902 1.00 0.00 C ATOM 102 OE1 GLU A 261 17.373 -2.960 -1.045 1.00 0.00 O ATOM 103 OE2 GLU A 261 17.379 -5.009 -1.834 1.00 0.00 O ATOM 0 H GLU A 261 15.153 -3.009 -1.156 1.00 0.00 H new ATOM 0 HA GLU A 261 14.426 -5.544 -0.239 1.00 0.00 H new ATOM 0 HB2 GLU A 261 15.627 -3.098 1.096 1.00 0.00 H new ATOM 0 HB3 GLU A 261 15.363 -4.588 1.980 1.00 0.00 H new ATOM 0 HG2 GLU A 261 17.667 -4.458 1.175 1.00 0.00 H new ATOM 0 HG3 GLU A 261 16.830 -5.808 0.436 1.00 0.00 H new ATOM 110 N LEU A 262 12.703 -3.092 1.174 1.00 0.00 N ATOM 111 CA LEU A 262 11.479 -2.813 1.923 1.00 0.00 C ATOM 112 C LEU A 262 10.242 -3.300 1.172 1.00 0.00 C ATOM 113 O LEU A 262 9.387 -3.984 1.741 1.00 0.00 O ATOM 114 CB LEU A 262 11.359 -1.314 2.217 1.00 0.00 C ATOM 115 CG LEU A 262 12.202 -0.802 3.392 1.00 0.00 C ATOM 116 CD1 LEU A 262 11.769 -1.469 4.691 1.00 0.00 C ATOM 117 CD2 LEU A 262 13.684 -1.037 3.139 1.00 0.00 C ATOM 0 H LEU A 262 13.243 -2.264 0.922 1.00 0.00 H new ATOM 0 HA LEU A 262 11.538 -3.357 2.866 1.00 0.00 H new ATOM 0 HB2 LEU A 262 11.643 -0.762 1.321 1.00 0.00 H new ATOM 0 HB3 LEU A 262 10.312 -1.083 2.416 1.00 0.00 H new ATOM 0 HG LEU A 262 12.040 0.272 3.484 1.00 0.00 H new ATOM 0 HD11 LEU A 262 12.378 -1.094 5.513 1.00 0.00 H new ATOM 0 HD12 LEU A 262 10.720 -1.244 4.884 1.00 0.00 H new ATOM 0 HD13 LEU A 262 11.899 -2.548 4.607 1.00 0.00 H new ATOM 0 HD21 LEU A 262 14.261 -0.666 3.986 1.00 0.00 H new ATOM 0 HD22 LEU A 262 13.867 -2.104 3.015 1.00 0.00 H new ATOM 0 HD23 LEU A 262 13.987 -0.510 2.234 1.00 0.00 H new ATOM 129 N ILE A 263 10.152 -2.945 -0.105 1.00 0.00 N ATOM 130 CA ILE A 263 9.019 -3.343 -0.933 1.00 0.00 C ATOM 131 C ILE A 263 8.782 -4.853 -0.877 1.00 0.00 C ATOM 132 O ILE A 263 7.675 -5.301 -0.573 1.00 0.00 O ATOM 133 CB ILE A 263 9.221 -2.904 -2.400 1.00 0.00 C ATOM 134 CG1 ILE A 263 8.925 -1.414 -2.562 1.00 0.00 C ATOM 135 CG2 ILE A 263 8.352 -3.729 -3.341 1.00 0.00 C ATOM 136 CD1 ILE A 263 9.200 -0.888 -3.955 1.00 0.00 C ATOM 0 H ILE A 263 10.851 -2.382 -0.590 1.00 0.00 H new ATOM 0 HA ILE A 263 8.140 -2.841 -0.529 1.00 0.00 H new ATOM 0 HB ILE A 263 10.264 -3.078 -2.664 1.00 0.00 H new ATOM 0 HG12 ILE A 263 7.880 -1.231 -2.314 1.00 0.00 H new ATOM 0 HG13 ILE A 263 9.526 -0.853 -1.846 1.00 0.00 H new ATOM 0 HG21 ILE A 263 8.513 -3.400 -4.368 1.00 0.00 H new ATOM 0 HG22 ILE A 263 8.618 -4.782 -3.252 1.00 0.00 H new ATOM 0 HG23 ILE A 263 7.303 -3.596 -3.078 1.00 0.00 H new ATOM 0 HD11 ILE A 263 8.967 0.176 -3.995 1.00 0.00 H new ATOM 0 HD12 ILE A 263 10.251 -1.039 -4.200 1.00 0.00 H new ATOM 0 HD13 ILE A 263 8.580 -1.422 -4.675 1.00 0.00 H new ATOM 148 N ARG A 264 9.818 -5.635 -1.172 1.00 0.00 N ATOM 149 CA ARG A 264 9.692 -7.088 -1.153 1.00 0.00 C ATOM 150 C ARG A 264 9.344 -7.595 0.240 1.00 0.00 C ATOM 151 O ARG A 264 8.581 -8.548 0.378 1.00 0.00 O ATOM 152 CB ARG A 264 10.963 -7.764 -1.660 1.00 0.00 C ATOM 153 CG ARG A 264 12.195 -7.478 -0.818 1.00 0.00 C ATOM 154 CD ARG A 264 13.430 -8.153 -1.393 1.00 0.00 C ATOM 155 NE ARG A 264 13.265 -9.600 -1.496 1.00 0.00 N ATOM 156 CZ ARG A 264 14.200 -10.416 -1.972 1.00 0.00 C ATOM 157 NH1 ARG A 264 15.363 -9.930 -2.384 1.00 0.00 N ATOM 158 NH2 ARG A 264 13.971 -11.721 -2.037 1.00 0.00 N ATOM 0 H ARG A 264 10.744 -5.291 -1.424 1.00 0.00 H new ATOM 0 HA ARG A 264 8.875 -7.348 -1.826 1.00 0.00 H new ATOM 0 HB2 ARG A 264 10.801 -8.841 -1.693 1.00 0.00 H new ATOM 0 HB3 ARG A 264 11.152 -7.439 -2.683 1.00 0.00 H new ATOM 0 HG2 ARG A 264 12.359 -6.402 -0.764 1.00 0.00 H new ATOM 0 HG3 ARG A 264 12.030 -7.827 0.201 1.00 0.00 H new ATOM 0 HD2 ARG A 264 13.642 -7.741 -2.380 1.00 0.00 H new ATOM 0 HD3 ARG A 264 14.291 -7.930 -0.763 1.00 0.00 H new ATOM 0 HE ARG A 264 12.383 -10.007 -1.185 1.00 0.00 H new ATOM 0 HH11 ARG A 264 15.542 -8.927 -2.336 1.00 0.00 H new ATOM 0 HH12 ARG A 264 16.078 -10.559 -2.749 1.00 0.00 H new ATOM 0 HH21 ARG A 264 13.077 -12.098 -1.722 1.00 0.00 H new ATOM 0 HH22 ARG A 264 14.689 -12.347 -2.402 1.00 0.00 H new ATOM 172 N LYS A 265 9.886 -6.951 1.275 1.00 0.00 N ATOM 173 CA LYS A 265 9.587 -7.357 2.644 1.00 0.00 C ATOM 174 C LYS A 265 8.082 -7.367 2.838 1.00 0.00 C ATOM 175 O LYS A 265 7.511 -8.329 3.355 1.00 0.00 O ATOM 176 CB LYS A 265 10.234 -6.410 3.656 1.00 0.00 C ATOM 177 CG LYS A 265 11.745 -6.545 3.746 1.00 0.00 C ATOM 178 CD LYS A 265 12.329 -5.587 4.772 1.00 0.00 C ATOM 179 CE LYS A 265 13.840 -5.725 4.865 1.00 0.00 C ATOM 180 NZ LYS A 265 14.422 -4.791 5.867 1.00 0.00 N ATOM 0 H LYS A 265 10.524 -6.159 1.192 1.00 0.00 H new ATOM 0 HA LYS A 265 9.994 -8.354 2.811 1.00 0.00 H new ATOM 0 HB2 LYS A 265 9.986 -5.383 3.388 1.00 0.00 H new ATOM 0 HB3 LYS A 265 9.803 -6.596 4.640 1.00 0.00 H new ATOM 0 HG2 LYS A 265 12.005 -7.569 4.014 1.00 0.00 H new ATOM 0 HG3 LYS A 265 12.188 -6.349 2.770 1.00 0.00 H new ATOM 0 HD2 LYS A 265 12.072 -4.563 4.503 1.00 0.00 H new ATOM 0 HD3 LYS A 265 11.884 -5.781 5.748 1.00 0.00 H new ATOM 0 HE2 LYS A 265 14.095 -6.750 5.133 1.00 0.00 H new ATOM 0 HE3 LYS A 265 14.283 -5.532 3.888 1.00 0.00 H new ATOM 0 HZ1 LYS A 265 15.454 -4.916 5.900 1.00 0.00 H new ATOM 0 HZ2 LYS A 265 14.201 -3.811 5.598 1.00 0.00 H new ATOM 0 HZ3 LYS A 265 14.019 -4.992 6.804 1.00 0.00 H new ATOM 194 N ALA A 266 7.444 -6.297 2.384 1.00 0.00 N ATOM 195 CA ALA A 266 6.000 -6.180 2.467 1.00 0.00 C ATOM 196 C ALA A 266 5.343 -7.235 1.587 1.00 0.00 C ATOM 197 O ALA A 266 4.280 -7.762 1.913 1.00 0.00 O ATOM 198 CB ALA A 266 5.559 -4.784 2.052 1.00 0.00 C ATOM 0 H ALA A 266 7.908 -5.497 1.954 1.00 0.00 H new ATOM 0 HA ALA A 266 5.689 -6.344 3.499 1.00 0.00 H new ATOM 0 HB1 ALA A 266 4.474 -4.710 2.119 1.00 0.00 H new ATOM 0 HB2 ALA A 266 6.014 -4.047 2.714 1.00 0.00 H new ATOM 0 HB3 ALA A 266 5.873 -4.593 1.026 1.00 0.00 H new ATOM 204 N ILE A 267 5.994 -7.537 0.463 1.00 0.00 N ATOM 205 CA ILE A 267 5.488 -8.528 -0.478 1.00 0.00 C ATOM 206 C ILE A 267 5.389 -9.914 0.160 1.00 0.00 C ATOM 207 O ILE A 267 4.358 -10.578 0.058 1.00 0.00 O ATOM 208 CB ILE A 267 6.370 -8.611 -1.742 1.00 0.00 C ATOM 209 CG1 ILE A 267 6.330 -7.279 -2.498 1.00 0.00 C ATOM 210 CG2 ILE A 267 5.910 -9.753 -2.641 1.00 0.00 C ATOM 211 CD1 ILE A 267 7.199 -7.253 -3.737 1.00 0.00 C ATOM 0 H ILE A 267 6.876 -7.106 0.184 1.00 0.00 H new ATOM 0 HA ILE A 267 4.489 -8.200 -0.764 1.00 0.00 H new ATOM 0 HB ILE A 267 7.398 -8.810 -1.440 1.00 0.00 H new ATOM 0 HG12 ILE A 267 5.300 -7.065 -2.783 1.00 0.00 H new ATOM 0 HG13 ILE A 267 6.647 -6.481 -1.826 1.00 0.00 H new ATOM 0 HG21 ILE A 267 6.543 -9.796 -3.527 1.00 0.00 H new ATOM 0 HG22 ILE A 267 5.981 -10.695 -2.098 1.00 0.00 H new ATOM 0 HG23 ILE A 267 4.876 -9.585 -2.942 1.00 0.00 H new ATOM 0 HD11 ILE A 267 7.118 -6.278 -4.218 1.00 0.00 H new ATOM 0 HD12 ILE A 267 8.237 -7.435 -3.457 1.00 0.00 H new ATOM 0 HD13 ILE A 267 6.869 -8.027 -4.429 1.00 0.00 H new ATOM 223 N GLU A 268 6.465 -10.347 0.812 1.00 0.00 N ATOM 224 CA GLU A 268 6.494 -11.657 1.456 1.00 0.00 C ATOM 225 C GLU A 268 5.517 -11.729 2.625 1.00 0.00 C ATOM 226 O GLU A 268 4.771 -12.698 2.759 1.00 0.00 O ATOM 227 CB GLU A 268 7.908 -11.983 1.936 1.00 0.00 C ATOM 228 CG GLU A 268 8.916 -12.109 0.807 1.00 0.00 C ATOM 229 CD GLU A 268 10.307 -12.452 1.304 1.00 0.00 C ATOM 230 OE1 GLU A 268 10.871 -11.656 2.084 1.00 0.00 O ATOM 231 OE2 GLU A 268 10.830 -13.516 0.914 1.00 0.00 O ATOM 0 H GLU A 268 7.327 -9.811 0.908 1.00 0.00 H new ATOM 0 HA GLU A 268 6.187 -12.395 0.715 1.00 0.00 H new ATOM 0 HB2 GLU A 268 8.239 -11.204 2.623 1.00 0.00 H new ATOM 0 HB3 GLU A 268 7.886 -12.916 2.499 1.00 0.00 H new ATOM 0 HG2 GLU A 268 8.583 -12.879 0.111 1.00 0.00 H new ATOM 0 HG3 GLU A 268 8.953 -11.172 0.252 1.00 0.00 H new ATOM 238 N LEU A 269 5.529 -10.704 3.472 1.00 0.00 N ATOM 239 CA LEU A 269 4.641 -10.665 4.630 1.00 0.00 C ATOM 240 C LEU A 269 3.179 -10.748 4.201 1.00 0.00 C ATOM 241 O LEU A 269 2.383 -11.460 4.813 1.00 0.00 O ATOM 242 CB LEU A 269 4.881 -9.391 5.443 1.00 0.00 C ATOM 243 CG LEU A 269 6.296 -9.239 6.010 1.00 0.00 C ATOM 244 CD1 LEU A 269 6.417 -7.943 6.796 1.00 0.00 C ATOM 245 CD2 LEU A 269 6.657 -10.430 6.887 1.00 0.00 C ATOM 0 H LEU A 269 6.141 -9.893 3.379 1.00 0.00 H new ATOM 0 HA LEU A 269 4.863 -11.530 5.255 1.00 0.00 H new ATOM 0 HB2 LEU A 269 4.665 -8.529 4.811 1.00 0.00 H new ATOM 0 HB3 LEU A 269 4.171 -9.367 6.269 1.00 0.00 H new ATOM 0 HG LEU A 269 6.997 -9.205 5.176 1.00 0.00 H new ATOM 0 HD11 LEU A 269 7.428 -7.851 7.192 1.00 0.00 H new ATOM 0 HD12 LEU A 269 6.206 -7.099 6.140 1.00 0.00 H new ATOM 0 HD13 LEU A 269 5.704 -7.949 7.620 1.00 0.00 H new ATOM 0 HD21 LEU A 269 7.666 -10.301 7.279 1.00 0.00 H new ATOM 0 HD22 LEU A 269 5.952 -10.499 7.715 1.00 0.00 H new ATOM 0 HD23 LEU A 269 6.612 -11.344 6.295 1.00 0.00 H new ATOM 257 N SER A 270 2.833 -10.017 3.145 1.00 0.00 N ATOM 258 CA SER A 270 1.467 -10.012 2.633 1.00 0.00 C ATOM 259 C SER A 270 1.081 -11.390 2.102 1.00 0.00 C ATOM 260 O SER A 270 -0.003 -11.895 2.391 1.00 0.00 O ATOM 261 CB SER A 270 1.321 -8.965 1.528 1.00 0.00 C ATOM 262 OG SER A 270 -0.015 -8.896 1.064 1.00 0.00 O ATOM 0 H SER A 270 3.479 -9.421 2.628 1.00 0.00 H new ATOM 0 HA SER A 270 0.796 -9.759 3.454 1.00 0.00 H new ATOM 0 HB2 SER A 270 1.629 -7.990 1.904 1.00 0.00 H new ATOM 0 HB3 SER A 270 1.985 -9.211 0.699 1.00 0.00 H new ATOM 0 HG SER A 270 -0.417 -8.049 1.350 1.00 0.00 H new ATOM 268 N LEU A 271 1.979 -11.992 1.327 1.00 0.00 N ATOM 269 CA LEU A 271 1.738 -13.314 0.755 1.00 0.00 C ATOM 270 C LEU A 271 1.509 -14.351 1.850 1.00 0.00 C ATOM 271 O LEU A 271 0.682 -15.251 1.702 1.00 0.00 O ATOM 272 CB LEU A 271 2.918 -13.739 -0.122 1.00 0.00 C ATOM 273 CG LEU A 271 3.109 -12.921 -1.401 1.00 0.00 C ATOM 274 CD1 LEU A 271 4.404 -13.315 -2.093 1.00 0.00 C ATOM 275 CD2 LEU A 271 1.926 -13.114 -2.339 1.00 0.00 C ATOM 0 H LEU A 271 2.881 -11.585 1.080 1.00 0.00 H new ATOM 0 HA LEU A 271 0.839 -13.254 0.141 1.00 0.00 H new ATOM 0 HB2 LEU A 271 3.831 -13.676 0.470 1.00 0.00 H new ATOM 0 HB3 LEU A 271 2.788 -14.786 -0.396 1.00 0.00 H new ATOM 0 HG LEU A 271 3.167 -11.867 -1.131 1.00 0.00 H new ATOM 0 HD11 LEU A 271 4.526 -12.724 -3.001 1.00 0.00 H new ATOM 0 HD12 LEU A 271 5.245 -13.130 -1.424 1.00 0.00 H new ATOM 0 HD13 LEU A 271 4.371 -14.374 -2.350 1.00 0.00 H new ATOM 0 HD21 LEU A 271 2.079 -12.525 -3.243 1.00 0.00 H new ATOM 0 HD22 LEU A 271 1.839 -14.168 -2.603 1.00 0.00 H new ATOM 0 HD23 LEU A 271 1.012 -12.787 -1.843 1.00 0.00 H new ATOM 287 N LYS A 272 2.252 -14.224 2.945 1.00 0.00 N ATOM 288 CA LYS A 272 2.135 -15.154 4.063 1.00 0.00 C ATOM 289 C LYS A 272 0.712 -15.173 4.616 1.00 0.00 C ATOM 290 O LYS A 272 0.165 -16.236 4.912 1.00 0.00 O ATOM 291 CB LYS A 272 3.118 -14.774 5.173 1.00 0.00 C ATOM 292 CG LYS A 272 3.086 -15.712 6.372 1.00 0.00 C ATOM 293 CD LYS A 272 3.497 -17.129 5.994 1.00 0.00 C ATOM 294 CE LYS A 272 4.943 -17.191 5.524 1.00 0.00 C ATOM 295 NZ LYS A 272 5.892 -16.735 6.578 1.00 0.00 N ATOM 0 H LYS A 272 2.942 -13.485 3.082 1.00 0.00 H new ATOM 0 HA LYS A 272 2.375 -16.152 3.696 1.00 0.00 H new ATOM 0 HB2 LYS A 272 4.127 -14.760 4.762 1.00 0.00 H new ATOM 0 HB3 LYS A 272 2.897 -13.761 5.510 1.00 0.00 H new ATOM 0 HG2 LYS A 272 3.754 -15.334 7.146 1.00 0.00 H new ATOM 0 HG3 LYS A 272 2.082 -15.726 6.796 1.00 0.00 H new ATOM 0 HD2 LYS A 272 3.365 -17.787 6.853 1.00 0.00 H new ATOM 0 HD3 LYS A 272 2.842 -17.499 5.205 1.00 0.00 H new ATOM 0 HE2 LYS A 272 5.187 -18.213 5.234 1.00 0.00 H new ATOM 0 HE3 LYS A 272 5.062 -16.571 4.636 1.00 0.00 H new ATOM 0 HZ1 LYS A 272 6.860 -17.010 6.316 1.00 0.00 H new ATOM 0 HZ2 LYS A 272 5.839 -15.700 6.669 1.00 0.00 H new ATOM 0 HZ3 LYS A 272 5.640 -17.176 7.486 1.00 0.00 H new ATOM 309 N GLU A 273 0.122 -13.991 4.758 1.00 0.00 N ATOM 310 CA GLU A 273 -1.234 -13.870 5.282 1.00 0.00 C ATOM 311 C GLU A 273 -2.253 -14.495 4.332 1.00 0.00 C ATOM 312 O GLU A 273 -3.127 -15.251 4.758 1.00 0.00 O ATOM 313 CB GLU A 273 -1.576 -12.398 5.521 1.00 0.00 C ATOM 314 CG GLU A 273 -0.631 -11.698 6.487 1.00 0.00 C ATOM 315 CD GLU A 273 -0.670 -12.288 7.885 1.00 0.00 C ATOM 316 OE1 GLU A 273 -0.330 -13.480 8.040 1.00 0.00 O ATOM 317 OE2 GLU A 273 -1.039 -11.555 8.827 1.00 0.00 O ATOM 0 H GLU A 273 0.562 -13.103 4.517 1.00 0.00 H new ATOM 0 HA GLU A 273 -1.278 -14.409 6.228 1.00 0.00 H new ATOM 0 HB2 GLU A 273 -1.561 -11.871 4.567 1.00 0.00 H new ATOM 0 HB3 GLU A 273 -2.593 -12.329 5.907 1.00 0.00 H new ATOM 0 HG2 GLU A 273 0.386 -11.760 6.101 1.00 0.00 H new ATOM 0 HG3 GLU A 273 -0.889 -10.640 6.537 1.00 0.00 H new ATOM 324 N SER A 274 -2.136 -14.173 3.047 1.00 0.00 N ATOM 325 CA SER A 274 -3.050 -14.701 2.038 1.00 0.00 C ATOM 326 C SER A 274 -3.010 -16.226 2.004 1.00 0.00 C ATOM 327 O SER A 274 -4.042 -16.878 1.845 1.00 0.00 O ATOM 328 CB SER A 274 -2.700 -14.140 0.658 1.00 0.00 C ATOM 329 OG SER A 274 -1.381 -14.494 0.282 1.00 0.00 O ATOM 0 H SER A 274 -1.418 -13.549 2.679 1.00 0.00 H new ATOM 0 HA SER A 274 -4.060 -14.390 2.305 1.00 0.00 H new ATOM 0 HB2 SER A 274 -3.406 -14.518 -0.081 1.00 0.00 H new ATOM 0 HB3 SER A 274 -2.800 -13.055 0.668 1.00 0.00 H new ATOM 0 HG SER A 274 -0.860 -14.712 1.083 1.00 0.00 H new ATOM 335 N ARG A 275 -1.811 -16.783 2.154 1.00 0.00 N ATOM 336 CA ARG A 275 -1.624 -18.231 2.143 1.00 0.00 C ATOM 337 C ARG A 275 -2.006 -18.823 0.787 1.00 0.00 C ATOM 338 O ARG A 275 -2.868 -19.699 0.700 1.00 0.00 O ATOM 339 CB ARG A 275 -2.441 -18.890 3.261 1.00 0.00 C ATOM 340 CG ARG A 275 -2.162 -20.378 3.442 1.00 0.00 C ATOM 341 CD ARG A 275 -0.775 -20.635 4.017 1.00 0.00 C ATOM 342 NE ARG A 275 0.295 -20.242 3.102 1.00 0.00 N ATOM 343 CZ ARG A 275 1.588 -20.354 3.389 1.00 0.00 C ATOM 344 NH1 ARG A 275 1.970 -20.851 4.558 1.00 0.00 N ATOM 345 NH2 ARG A 275 2.501 -19.972 2.506 1.00 0.00 N ATOM 0 H ARG A 275 -0.951 -16.251 2.285 1.00 0.00 H new ATOM 0 HA ARG A 275 -0.567 -18.434 2.318 1.00 0.00 H new ATOM 0 HB2 ARG A 275 -2.234 -18.376 4.199 1.00 0.00 H new ATOM 0 HB3 ARG A 275 -3.502 -18.753 3.050 1.00 0.00 H new ATOM 0 HG2 ARG A 275 -2.914 -20.810 4.103 1.00 0.00 H new ATOM 0 HG3 ARG A 275 -2.255 -20.883 2.481 1.00 0.00 H new ATOM 0 HD2 ARG A 275 -0.667 -20.087 4.953 1.00 0.00 H new ATOM 0 HD3 ARG A 275 -0.675 -21.694 4.254 1.00 0.00 H new ATOM 0 HE ARG A 275 0.035 -19.861 2.192 1.00 0.00 H new ATOM 0 HH11 ARG A 275 1.271 -21.148 5.239 1.00 0.00 H new ATOM 0 HH12 ARG A 275 2.963 -20.936 4.776 1.00 0.00 H new ATOM 0 HH21 ARG A 275 2.211 -19.592 1.605 1.00 0.00 H new ATOM 0 HH22 ARG A 275 3.493 -20.059 2.728 1.00 0.00 H new ATOM 359 N ASN A 276 -1.352 -18.336 -0.267 1.00 0.00 N ATOM 360 CA ASN A 276 -1.604 -18.809 -1.628 1.00 0.00 C ATOM 361 C ASN A 276 -3.011 -18.448 -2.096 1.00 0.00 C ATOM 362 O ASN A 276 -3.984 -18.608 -1.357 1.00 0.00 O ATOM 363 CB ASN A 276 -1.396 -20.323 -1.717 1.00 0.00 C ATOM 364 CG ASN A 276 0.005 -20.741 -1.315 1.00 0.00 C ATOM 365 OD1 ASN A 276 0.434 -20.505 -0.185 1.00 0.00 O ATOM 366 ND2 ASN A 276 0.725 -21.365 -2.239 1.00 0.00 N ATOM 0 H ASN A 276 -0.639 -17.609 -0.203 1.00 0.00 H new ATOM 0 HA ASN A 276 -0.891 -18.311 -2.285 1.00 0.00 H new ATOM 0 HB2 ASN A 276 -2.120 -20.824 -1.074 1.00 0.00 H new ATOM 0 HB3 ASN A 276 -1.592 -20.654 -2.737 1.00 0.00 H new ATOM 0 HD21 ASN A 276 1.675 -21.670 -2.026 1.00 0.00 H new ATOM 0 HD22 ASN A 276 0.329 -21.540 -3.163 1.00 0.00 H new ATOM 373 N SER A 277 -3.104 -17.965 -3.335 1.00 0.00 N ATOM 374 CA SER A 277 -4.383 -17.578 -3.929 1.00 0.00 C ATOM 375 C SER A 277 -5.015 -16.409 -3.175 1.00 0.00 C ATOM 376 O SER A 277 -5.143 -16.439 -1.951 1.00 0.00 O ATOM 377 CB SER A 277 -5.345 -18.769 -3.953 1.00 0.00 C ATOM 378 OG SER A 277 -4.811 -19.841 -4.712 1.00 0.00 O ATOM 0 H SER A 277 -2.302 -17.832 -3.951 1.00 0.00 H new ATOM 0 HA SER A 277 -4.189 -17.257 -4.952 1.00 0.00 H new ATOM 0 HB2 SER A 277 -5.541 -19.103 -2.934 1.00 0.00 H new ATOM 0 HB3 SER A 277 -6.301 -18.460 -4.376 1.00 0.00 H new ATOM 0 HG SER A 277 -5.443 -20.590 -4.710 1.00 0.00 H new ATOM 384 N ALA A 278 -5.413 -15.380 -3.920 1.00 0.00 N ATOM 385 CA ALA A 278 -6.035 -14.198 -3.330 1.00 0.00 C ATOM 386 C ALA A 278 -6.523 -13.240 -4.412 1.00 0.00 C ATOM 387 O ALA A 278 -6.670 -13.684 -5.571 1.00 0.00 O ATOM 388 CB ALA A 278 -5.058 -13.492 -2.400 1.00 0.00 C ATOM 389 OXT ALA A 278 -6.756 -12.055 -4.092 1.00 0.00 O ATOM 0 H ALA A 278 -5.315 -15.341 -4.935 1.00 0.00 H new ATOM 0 HA ALA A 278 -6.898 -14.524 -2.750 1.00 0.00 H new ATOM 0 HB1 ALA A 278 -5.537 -12.613 -1.968 1.00 0.00 H new ATOM 0 HB2 ALA A 278 -4.760 -14.172 -1.602 1.00 0.00 H new ATOM 0 HB3 ALA A 278 -4.177 -13.185 -2.963 1.00 0.00 H new TER 395 ALA A 278 ATOM 396 N MET B 1 -15.417 1.188 2.673 1.00 0.00 N ATOM 397 CA MET B 1 -14.808 0.300 3.697 1.00 0.00 C ATOM 398 C MET B 1 -13.522 0.899 4.260 1.00 0.00 C ATOM 399 O MET B 1 -12.711 1.467 3.525 1.00 0.00 O ATOM 400 CB MET B 1 -14.526 -1.062 3.060 1.00 0.00 C ATOM 401 CG MET B 1 -13.629 -0.989 1.836 1.00 0.00 C ATOM 402 SD MET B 1 -13.313 -2.609 1.112 1.00 0.00 S ATOM 403 CE MET B 1 -12.293 -2.159 -0.289 1.00 0.00 C ATOM 0 H1 MET B 1 -16.221 0.702 2.226 1.00 0.00 H new ATOM 0 H2 MET B 1 -15.750 2.063 3.126 1.00 0.00 H new ATOM 0 H3 MET B 1 -14.707 1.421 1.949 1.00 0.00 H new ATOM 0 HA MET B 1 -15.504 0.187 4.528 1.00 0.00 H new ATOM 0 HB2 MET B 1 -14.061 -1.711 3.802 1.00 0.00 H new ATOM 0 HB3 MET B 1 -15.472 -1.525 2.779 1.00 0.00 H new ATOM 0 HG2 MET B 1 -14.092 -0.345 1.088 1.00 0.00 H new ATOM 0 HG3 MET B 1 -12.681 -0.527 2.112 1.00 0.00 H new ATOM 0 HE1 MET B 1 -12.349 -2.941 -1.046 1.00 0.00 H new ATOM 0 HE2 MET B 1 -12.649 -1.219 -0.711 1.00 0.00 H new ATOM 0 HE3 MET B 1 -11.259 -2.042 0.036 1.00 0.00 H new ATOM 415 N GLN B 2 -13.348 0.770 5.572 1.00 0.00 N ATOM 416 CA GLN B 2 -12.167 1.294 6.249 1.00 0.00 C ATOM 417 C GLN B 2 -10.959 0.385 6.038 1.00 0.00 C ATOM 418 O GLN B 2 -11.087 -0.838 6.003 1.00 0.00 O ATOM 419 CB GLN B 2 -12.438 1.451 7.746 1.00 0.00 C ATOM 420 CG GLN B 2 -13.575 2.407 8.065 1.00 0.00 C ATOM 421 CD GLN B 2 -13.824 2.538 9.554 1.00 0.00 C ATOM 422 OE1 GLN B 2 -12.935 2.923 10.313 1.00 0.00 O ATOM 423 NE2 GLN B 2 -15.041 2.218 9.981 1.00 0.00 N ATOM 0 H GLN B 2 -14.013 0.305 6.190 1.00 0.00 H new ATOM 0 HA GLN B 2 -11.943 2.270 5.818 1.00 0.00 H new ATOM 0 HB2 GLN B 2 -12.668 0.473 8.169 1.00 0.00 H new ATOM 0 HB3 GLN B 2 -11.530 1.804 8.235 1.00 0.00 H new ATOM 0 HG2 GLN B 2 -13.347 3.389 7.651 1.00 0.00 H new ATOM 0 HG3 GLN B 2 -14.485 2.059 7.577 1.00 0.00 H new ATOM 0 HE21 GLN B 2 -15.748 1.903 9.317 1.00 0.00 H new ATOM 0 HE22 GLN B 2 -15.268 2.287 10.973 1.00 0.00 H new ATOM 432 N ILE B 3 -9.785 0.996 5.912 1.00 0.00 N ATOM 433 CA ILE B 3 -8.540 0.257 5.718 1.00 0.00 C ATOM 434 C ILE B 3 -7.386 0.985 6.397 1.00 0.00 C ATOM 435 O ILE B 3 -7.324 2.215 6.377 1.00 0.00 O ATOM 436 CB ILE B 3 -8.202 0.069 4.224 1.00 0.00 C ATOM 437 CG1 ILE B 3 -7.995 1.428 3.548 1.00 0.00 C ATOM 438 CG2 ILE B 3 -9.301 -0.718 3.523 1.00 0.00 C ATOM 439 CD1 ILE B 3 -7.483 1.330 2.127 1.00 0.00 C ATOM 0 H ILE B 3 -9.669 2.009 5.941 1.00 0.00 H new ATOM 0 HA ILE B 3 -8.682 -0.728 6.163 1.00 0.00 H new ATOM 0 HB ILE B 3 -7.274 -0.498 4.147 1.00 0.00 H new ATOM 0 HG12 ILE B 3 -8.940 1.971 3.547 1.00 0.00 H new ATOM 0 HG13 ILE B 3 -7.291 2.014 4.139 1.00 0.00 H new ATOM 0 HG21 ILE B 3 -9.046 -0.841 2.470 1.00 0.00 H new ATOM 0 HG22 ILE B 3 -9.400 -1.698 3.989 1.00 0.00 H new ATOM 0 HG23 ILE B 3 -10.245 -0.179 3.607 1.00 0.00 H new ATOM 0 HD11 ILE B 3 -7.361 2.331 1.714 1.00 0.00 H new ATOM 0 HD12 ILE B 3 -6.522 0.816 2.121 1.00 0.00 H new ATOM 0 HD13 ILE B 3 -8.197 0.772 1.521 1.00 0.00 H new ATOM 451 N PHE B 4 -6.478 0.230 7.006 1.00 0.00 N ATOM 452 CA PHE B 4 -5.339 0.834 7.691 1.00 0.00 C ATOM 453 C PHE B 4 -4.082 0.826 6.833 1.00 0.00 C ATOM 454 O PHE B 4 -3.639 -0.222 6.368 1.00 0.00 O ATOM 455 CB PHE B 4 -5.048 0.120 9.010 1.00 0.00 C ATOM 456 CG PHE B 4 -5.937 0.545 10.141 1.00 0.00 C ATOM 457 CD1 PHE B 4 -7.226 0.052 10.256 1.00 0.00 C ATOM 458 CD2 PHE B 4 -5.472 1.433 11.099 1.00 0.00 C ATOM 459 CE1 PHE B 4 -8.037 0.439 11.307 1.00 0.00 C ATOM 460 CE2 PHE B 4 -6.276 1.822 12.151 1.00 0.00 C ATOM 461 CZ PHE B 4 -7.561 1.325 12.255 1.00 0.00 C ATOM 0 H PHE B 4 -6.506 -0.789 7.040 1.00 0.00 H new ATOM 0 HA PHE B 4 -5.615 1.870 7.889 1.00 0.00 H new ATOM 0 HB2 PHE B 4 -5.155 -0.955 8.861 1.00 0.00 H new ATOM 0 HB3 PHE B 4 -4.010 0.302 9.289 1.00 0.00 H new ATOM 0 HD1 PHE B 4 -7.601 -0.641 9.518 1.00 0.00 H new ATOM 0 HD2 PHE B 4 -4.469 1.825 11.021 1.00 0.00 H new ATOM 0 HE1 PHE B 4 -9.041 0.049 11.387 1.00 0.00 H new ATOM 0 HE2 PHE B 4 -5.902 2.513 12.891 1.00 0.00 H new ATOM 0 HZ PHE B 4 -8.193 1.629 13.076 1.00 0.00 H new ATOM 471 N VAL B 5 -3.491 2.003 6.664 1.00 0.00 N ATOM 472 CA VAL B 5 -2.259 2.137 5.904 1.00 0.00 C ATOM 473 C VAL B 5 -1.068 1.974 6.839 1.00 0.00 C ATOM 474 O VAL B 5 -1.005 2.619 7.885 1.00 0.00 O ATOM 475 CB VAL B 5 -2.174 3.504 5.198 1.00 0.00 C ATOM 476 CG1 VAL B 5 -0.878 3.625 4.412 1.00 0.00 C ATOM 477 CG2 VAL B 5 -3.376 3.708 4.289 1.00 0.00 C ATOM 0 H VAL B 5 -3.848 2.879 7.045 1.00 0.00 H new ATOM 0 HA VAL B 5 -2.247 1.361 5.139 1.00 0.00 H new ATOM 0 HB VAL B 5 -2.182 4.284 5.959 1.00 0.00 H new ATOM 0 HG11 VAL B 5 -0.839 4.598 3.922 1.00 0.00 H new ATOM 0 HG12 VAL B 5 -0.031 3.526 5.090 1.00 0.00 H new ATOM 0 HG13 VAL B 5 -0.834 2.838 3.660 1.00 0.00 H new ATOM 0 HG21 VAL B 5 -3.300 4.678 3.798 1.00 0.00 H new ATOM 0 HG22 VAL B 5 -3.400 2.921 3.535 1.00 0.00 H new ATOM 0 HG23 VAL B 5 -4.290 3.671 4.881 1.00 0.00 H new ATOM 487 N LYS B 6 -0.133 1.105 6.474 1.00 0.00 N ATOM 488 CA LYS B 6 1.036 0.866 7.310 1.00 0.00 C ATOM 489 C LYS B 6 2.326 0.921 6.504 1.00 0.00 C ATOM 490 O LYS B 6 2.440 0.312 5.437 1.00 0.00 O ATOM 491 CB LYS B 6 0.919 -0.490 8.008 1.00 0.00 C ATOM 492 CG LYS B 6 2.112 -0.825 8.890 1.00 0.00 C ATOM 493 CD LYS B 6 1.969 -2.197 9.528 1.00 0.00 C ATOM 494 CE LYS B 6 3.181 -2.544 10.377 1.00 0.00 C ATOM 495 NZ LYS B 6 4.433 -2.575 9.572 1.00 0.00 N ATOM 0 H LYS B 6 -0.161 0.559 5.613 1.00 0.00 H new ATOM 0 HA LYS B 6 1.072 1.659 8.057 1.00 0.00 H new ATOM 0 HB2 LYS B 6 0.014 -0.500 8.616 1.00 0.00 H new ATOM 0 HB3 LYS B 6 0.805 -1.269 7.254 1.00 0.00 H new ATOM 0 HG2 LYS B 6 3.025 -0.793 8.295 1.00 0.00 H new ATOM 0 HG3 LYS B 6 2.213 -0.070 9.669 1.00 0.00 H new ATOM 0 HD2 LYS B 6 1.071 -2.221 10.146 1.00 0.00 H new ATOM 0 HD3 LYS B 6 1.840 -2.950 8.750 1.00 0.00 H new ATOM 0 HE2 LYS B 6 3.283 -1.813 11.179 1.00 0.00 H new ATOM 0 HE3 LYS B 6 3.028 -3.515 10.848 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 5.177 -3.069 10.106 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 4.258 -3.076 8.677 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 4.740 -1.602 9.370 1.00 0.00 H new ATOM 509 N THR B 7 3.302 1.649 7.036 1.00 0.00 N ATOM 510 CA THR B 7 4.598 1.784 6.389 1.00 0.00 C ATOM 511 C THR B 7 5.462 0.555 6.659 1.00 0.00 C ATOM 512 O THR B 7 4.944 -0.544 6.860 1.00 0.00 O ATOM 513 CB THR B 7 5.337 3.048 6.868 1.00 0.00 C ATOM 514 OG1 THR B 7 5.553 2.985 8.283 1.00 0.00 O ATOM 515 CG2 THR B 7 4.543 4.299 6.524 1.00 0.00 C ATOM 0 H THR B 7 3.217 2.156 7.917 1.00 0.00 H new ATOM 0 HA THR B 7 4.420 1.873 5.317 1.00 0.00 H new ATOM 0 HB THR B 7 6.299 3.096 6.358 1.00 0.00 H new ATOM 0 HG1 THR B 7 5.878 3.852 8.603 1.00 0.00 H new ATOM 0 HG21 THR B 7 5.083 5.180 6.871 1.00 0.00 H new ATOM 0 HG22 THR B 7 4.408 4.359 5.444 1.00 0.00 H new ATOM 0 HG23 THR B 7 3.568 4.256 7.010 1.00 0.00 H new ATOM 523 N LEU B 8 6.777 0.744 6.666 1.00 0.00 N ATOM 524 CA LEU B 8 7.703 -0.351 6.915 1.00 0.00 C ATOM 525 C LEU B 8 8.741 0.053 7.956 1.00 0.00 C ATOM 526 O LEU B 8 9.941 -0.154 7.774 1.00 0.00 O ATOM 527 CB LEU B 8 8.379 -0.777 5.612 1.00 0.00 C ATOM 528 CG LEU B 8 7.426 -1.334 4.551 1.00 0.00 C ATOM 529 CD1 LEU B 8 8.192 -1.738 3.305 1.00 0.00 C ATOM 530 CD2 LEU B 8 6.643 -2.518 5.102 1.00 0.00 C ATOM 0 H LEU B 8 7.224 1.646 6.502 1.00 0.00 H new ATOM 0 HA LEU B 8 7.143 -1.200 7.307 1.00 0.00 H new ATOM 0 HB2 LEU B 8 8.905 0.081 5.194 1.00 0.00 H new ATOM 0 HB3 LEU B 8 9.131 -1.533 5.839 1.00 0.00 H new ATOM 0 HG LEU B 8 6.719 -0.550 4.281 1.00 0.00 H new ATOM 0 HD11 LEU B 8 7.498 -2.131 2.563 1.00 0.00 H new ATOM 0 HD12 LEU B 8 8.706 -0.868 2.896 1.00 0.00 H new ATOM 0 HD13 LEU B 8 8.923 -2.505 3.560 1.00 0.00 H new ATOM 0 HD21 LEU B 8 5.971 -2.900 4.333 1.00 0.00 H new ATOM 0 HD22 LEU B 8 7.336 -3.304 5.402 1.00 0.00 H new ATOM 0 HD23 LEU B 8 6.061 -2.199 5.966 1.00 0.00 H new ATOM 542 N THR B 9 8.257 0.630 9.052 1.00 0.00 N ATOM 543 CA THR B 9 9.121 1.069 10.138 1.00 0.00 C ATOM 544 C THR B 9 8.374 1.057 11.470 1.00 0.00 C ATOM 545 O THR B 9 8.912 0.617 12.486 1.00 0.00 O ATOM 546 CB THR B 9 9.684 2.481 9.880 1.00 0.00 C ATOM 547 OG1 THR B 9 10.477 2.905 10.996 1.00 0.00 O ATOM 548 CG2 THR B 9 8.564 3.482 9.640 1.00 0.00 C ATOM 0 H THR B 9 7.264 0.804 9.210 1.00 0.00 H new ATOM 0 HA THR B 9 9.953 0.366 10.186 1.00 0.00 H new ATOM 0 HB THR B 9 10.306 2.438 8.986 1.00 0.00 H new ATOM 0 HG1 THR B 9 10.832 3.802 10.823 1.00 0.00 H new ATOM 0 HG21 THR B 9 8.990 4.469 9.461 1.00 0.00 H new ATOM 0 HG22 THR B 9 7.982 3.175 8.771 1.00 0.00 H new ATOM 0 HG23 THR B 9 7.916 3.520 10.516 1.00 0.00 H new ATOM 556 N GLY B 10 7.131 1.539 11.460 1.00 0.00 N ATOM 557 CA GLY B 10 6.343 1.564 12.680 1.00 0.00 C ATOM 558 C GLY B 10 5.243 2.610 12.658 1.00 0.00 C ATOM 559 O GLY B 10 5.231 3.515 13.492 1.00 0.00 O ATOM 0 H GLY B 10 6.660 1.910 10.635 1.00 0.00 H new ATOM 0 HA2 GLY B 10 5.898 0.581 12.838 1.00 0.00 H new ATOM 0 HA3 GLY B 10 7.002 1.756 13.527 1.00 0.00 H new ATOM 563 N LYS B 11 4.316 2.495 11.708 1.00 0.00 N ATOM 564 CA LYS B 11 3.221 3.455 11.606 1.00 0.00 C ATOM 565 C LYS B 11 2.019 2.868 10.869 1.00 0.00 C ATOM 566 O LYS B 11 2.163 2.230 9.823 1.00 0.00 O ATOM 567 CB LYS B 11 3.694 4.722 10.896 1.00 0.00 C ATOM 568 CG LYS B 11 2.670 5.847 10.914 1.00 0.00 C ATOM 569 CD LYS B 11 3.197 7.095 10.223 1.00 0.00 C ATOM 570 CE LYS B 11 3.433 6.860 8.740 1.00 0.00 C ATOM 571 NZ LYS B 11 3.987 8.068 8.067 1.00 0.00 N ATOM 0 H LYS B 11 4.301 1.755 11.006 1.00 0.00 H new ATOM 0 HA LYS B 11 2.906 3.701 12.620 1.00 0.00 H new ATOM 0 HB2 LYS B 11 4.613 5.071 11.367 1.00 0.00 H new ATOM 0 HB3 LYS B 11 3.937 4.480 9.862 1.00 0.00 H new ATOM 0 HG2 LYS B 11 1.756 5.516 10.421 1.00 0.00 H new ATOM 0 HG3 LYS B 11 2.408 6.085 11.945 1.00 0.00 H new ATOM 0 HD2 LYS B 11 2.486 7.911 10.353 1.00 0.00 H new ATOM 0 HD3 LYS B 11 4.129 7.406 10.695 1.00 0.00 H new ATOM 0 HE2 LYS B 11 4.121 6.024 8.610 1.00 0.00 H new ATOM 0 HE3 LYS B 11 2.494 6.577 8.263 1.00 0.00 H new ATOM 0 HZ1 LYS B 11 4.134 7.866 7.057 1.00 0.00 H new ATOM 0 HZ2 LYS B 11 3.319 8.859 8.169 1.00 0.00 H new ATOM 0 HZ3 LYS B 11 4.895 8.323 8.504 1.00 0.00 H new ATOM 585 N THR B 12 0.834 3.106 11.429 1.00 0.00 N ATOM 586 CA THR B 12 -0.419 2.626 10.853 1.00 0.00 C ATOM 587 C THR B 12 -1.555 3.590 11.188 1.00 0.00 C ATOM 588 O THR B 12 -1.629 4.096 12.307 1.00 0.00 O ATOM 589 CB THR B 12 -0.776 1.221 11.375 1.00 0.00 C ATOM 590 OG1 THR B 12 0.299 0.312 11.113 1.00 0.00 O ATOM 591 CG2 THR B 12 -2.048 0.707 10.719 1.00 0.00 C ATOM 0 H THR B 12 0.717 3.636 12.293 1.00 0.00 H new ATOM 0 HA THR B 12 -0.286 2.571 9.773 1.00 0.00 H new ATOM 0 HB THR B 12 -0.941 1.290 12.450 1.00 0.00 H new ATOM 0 HG1 THR B 12 0.064 -0.578 11.449 1.00 0.00 H new ATOM 0 HG21 THR B 12 -2.280 -0.286 11.103 1.00 0.00 H new ATOM 0 HG22 THR B 12 -2.872 1.384 10.943 1.00 0.00 H new ATOM 0 HG23 THR B 12 -1.905 0.654 9.640 1.00 0.00 H new ATOM 599 N ILE B 13 -2.426 3.859 10.214 1.00 0.00 N ATOM 600 CA ILE B 13 -3.536 4.788 10.425 1.00 0.00 C ATOM 601 C ILE B 13 -4.769 4.433 9.595 1.00 0.00 C ATOM 602 O ILE B 13 -4.663 3.983 8.455 1.00 0.00 O ATOM 603 CB ILE B 13 -3.109 6.236 10.099 1.00 0.00 C ATOM 604 CG1 ILE B 13 -2.171 6.759 11.189 1.00 0.00 C ATOM 605 CG2 ILE B 13 -4.323 7.143 9.940 1.00 0.00 C ATOM 606 CD1 ILE B 13 -1.738 8.192 10.985 1.00 0.00 C ATOM 0 H ILE B 13 -2.385 3.451 9.280 1.00 0.00 H new ATOM 0 HA ILE B 13 -3.804 4.706 11.478 1.00 0.00 H new ATOM 0 HB ILE B 13 -2.575 6.237 9.149 1.00 0.00 H new ATOM 0 HG12 ILE B 13 -2.669 6.674 12.155 1.00 0.00 H new ATOM 0 HG13 ILE B 13 -1.286 6.124 11.229 1.00 0.00 H new ATOM 0 HG21 ILE B 13 -3.993 8.156 9.711 1.00 0.00 H new ATOM 0 HG22 ILE B 13 -4.950 6.773 9.128 1.00 0.00 H new ATOM 0 HG23 ILE B 13 -4.896 7.149 10.867 1.00 0.00 H new ATOM 0 HD11 ILE B 13 -1.075 8.491 11.797 1.00 0.00 H new ATOM 0 HD12 ILE B 13 -1.211 8.281 10.035 1.00 0.00 H new ATOM 0 HD13 ILE B 13 -2.615 8.839 10.975 1.00 0.00 H new ATOM 618 N THR B 14 -5.940 4.659 10.191 1.00 0.00 N ATOM 619 CA THR B 14 -7.218 4.390 9.540 1.00 0.00 C ATOM 620 C THR B 14 -7.365 5.201 8.256 1.00 0.00 C ATOM 621 O THR B 14 -6.870 6.324 8.159 1.00 0.00 O ATOM 622 CB THR B 14 -8.399 4.740 10.468 1.00 0.00 C ATOM 623 OG1 THR B 14 -8.243 4.093 11.734 1.00 0.00 O ATOM 624 CG2 THR B 14 -9.723 4.325 9.843 1.00 0.00 C ATOM 0 H THR B 14 -6.027 5.033 11.136 1.00 0.00 H new ATOM 0 HA THR B 14 -7.233 3.325 9.307 1.00 0.00 H new ATOM 0 HB THR B 14 -8.404 5.820 10.612 1.00 0.00 H new ATOM 0 HG1 THR B 14 -7.701 3.284 11.623 1.00 0.00 H new ATOM 0 HG21 THR B 14 -10.540 4.583 10.517 1.00 0.00 H new ATOM 0 HG22 THR B 14 -9.857 4.846 8.895 1.00 0.00 H new ATOM 0 HG23 THR B 14 -9.722 3.249 9.669 1.00 0.00 H new ATOM 632 N LEU B 15 -8.060 4.629 7.278 1.00 0.00 N ATOM 633 CA LEU B 15 -8.283 5.306 6.007 1.00 0.00 C ATOM 634 C LEU B 15 -9.535 4.770 5.318 1.00 0.00 C ATOM 635 O LEU B 15 -9.577 3.619 4.887 1.00 0.00 O ATOM 636 CB LEU B 15 -7.069 5.129 5.094 1.00 0.00 C ATOM 637 CG LEU B 15 -7.204 5.755 3.705 1.00 0.00 C ATOM 638 CD1 LEU B 15 -7.343 7.268 3.805 1.00 0.00 C ATOM 639 CD2 LEU B 15 -6.013 5.382 2.839 1.00 0.00 C ATOM 0 H LEU B 15 -8.477 3.700 7.342 1.00 0.00 H new ATOM 0 HA LEU B 15 -8.427 6.368 6.208 1.00 0.00 H new ATOM 0 HB2 LEU B 15 -6.198 5.560 5.587 1.00 0.00 H new ATOM 0 HB3 LEU B 15 -6.874 4.063 4.977 1.00 0.00 H new ATOM 0 HG LEU B 15 -8.108 5.363 3.238 1.00 0.00 H new ATOM 0 HD11 LEU B 15 -7.438 7.692 2.805 1.00 0.00 H new ATOM 0 HD12 LEU B 15 -8.230 7.514 4.389 1.00 0.00 H new ATOM 0 HD13 LEU B 15 -6.461 7.683 4.293 1.00 0.00 H new ATOM 0 HD21 LEU B 15 -6.124 5.835 1.854 1.00 0.00 H new ATOM 0 HD22 LEU B 15 -5.097 5.745 3.305 1.00 0.00 H new ATOM 0 HD23 LEU B 15 -5.963 4.298 2.736 1.00 0.00 H new ATOM 651 N GLU B 16 -10.552 5.621 5.215 1.00 0.00 N ATOM 652 CA GLU B 16 -11.810 5.248 4.577 1.00 0.00 C ATOM 653 C GLU B 16 -11.687 5.326 3.058 1.00 0.00 C ATOM 654 O GLU B 16 -11.226 6.333 2.520 1.00 0.00 O ATOM 655 CB GLU B 16 -12.933 6.172 5.056 1.00 0.00 C ATOM 656 CG GLU B 16 -14.297 5.828 4.483 1.00 0.00 C ATOM 657 CD GLU B 16 -14.811 4.487 4.969 1.00 0.00 C ATOM 658 OE1 GLU B 16 -14.994 4.332 6.194 1.00 0.00 O ATOM 659 OE2 GLU B 16 -15.031 3.594 4.125 1.00 0.00 O ATOM 0 H GLU B 16 -10.528 6.578 5.567 1.00 0.00 H new ATOM 0 HA GLU B 16 -12.046 4.221 4.854 1.00 0.00 H new ATOM 0 HB2 GLU B 16 -12.985 6.131 6.144 1.00 0.00 H new ATOM 0 HB3 GLU B 16 -12.685 7.199 4.788 1.00 0.00 H new ATOM 0 HG2 GLU B 16 -15.009 6.607 4.756 1.00 0.00 H new ATOM 0 HG3 GLU B 16 -14.238 5.818 3.395 1.00 0.00 H new ATOM 666 N VAL B 17 -12.104 4.264 2.368 1.00 0.00 N ATOM 667 CA VAL B 17 -12.036 4.232 0.908 1.00 0.00 C ATOM 668 C VAL B 17 -13.162 3.391 0.311 1.00 0.00 C ATOM 669 O VAL B 17 -13.386 2.250 0.717 1.00 0.00 O ATOM 670 CB VAL B 17 -10.687 3.672 0.408 1.00 0.00 C ATOM 671 CG1 VAL B 17 -9.533 4.576 0.815 1.00 0.00 C ATOM 672 CG2 VAL B 17 -10.469 2.259 0.926 1.00 0.00 C ATOM 0 H VAL B 17 -12.490 3.421 2.793 1.00 0.00 H new ATOM 0 HA VAL B 17 -12.140 5.266 0.579 1.00 0.00 H new ATOM 0 HB VAL B 17 -10.720 3.640 -0.681 1.00 0.00 H new ATOM 0 HG11 VAL B 17 -8.596 4.157 0.449 1.00 0.00 H new ATOM 0 HG12 VAL B 17 -9.679 5.567 0.386 1.00 0.00 H new ATOM 0 HG13 VAL B 17 -9.497 4.653 1.902 1.00 0.00 H new ATOM 0 HG21 VAL B 17 -9.513 1.882 0.563 1.00 0.00 H new ATOM 0 HG22 VAL B 17 -10.465 2.268 2.016 1.00 0.00 H new ATOM 0 HG23 VAL B 17 -11.272 1.613 0.571 1.00 0.00 H new ATOM 682 N GLU B 18 -13.860 3.961 -0.666 1.00 0.00 N ATOM 683 CA GLU B 18 -14.954 3.266 -1.333 1.00 0.00 C ATOM 684 C GLU B 18 -14.411 2.250 -2.332 1.00 0.00 C ATOM 685 O GLU B 18 -13.437 2.521 -3.035 1.00 0.00 O ATOM 686 CB GLU B 18 -15.865 4.266 -2.049 1.00 0.00 C ATOM 687 CG GLU B 18 -16.507 5.282 -1.119 1.00 0.00 C ATOM 688 CD GLU B 18 -17.401 6.261 -1.856 1.00 0.00 C ATOM 689 OE1 GLU B 18 -16.890 6.979 -2.742 1.00 0.00 O ATOM 690 OE2 GLU B 18 -18.610 6.308 -1.550 1.00 0.00 O ATOM 0 H GLU B 18 -13.687 4.904 -1.014 1.00 0.00 H new ATOM 0 HA GLU B 18 -15.535 2.739 -0.577 1.00 0.00 H new ATOM 0 HB2 GLU B 18 -15.285 4.795 -2.806 1.00 0.00 H new ATOM 0 HB3 GLU B 18 -16.649 3.719 -2.572 1.00 0.00 H new ATOM 0 HG2 GLU B 18 -17.092 4.759 -0.363 1.00 0.00 H new ATOM 0 HG3 GLU B 18 -15.727 5.832 -0.593 1.00 0.00 H new ATOM 697 N SER B 19 -15.044 1.082 -2.391 1.00 0.00 N ATOM 698 CA SER B 19 -14.620 0.027 -3.307 1.00 0.00 C ATOM 699 C SER B 19 -14.576 0.541 -4.742 1.00 0.00 C ATOM 700 O SER B 19 -13.652 0.234 -5.495 1.00 0.00 O ATOM 701 CB SER B 19 -15.562 -1.175 -3.209 1.00 0.00 C ATOM 702 OG SER B 19 -16.892 -0.811 -3.535 1.00 0.00 O ATOM 0 H SER B 19 -15.852 0.842 -1.816 1.00 0.00 H new ATOM 0 HA SER B 19 -13.616 -0.287 -3.021 1.00 0.00 H new ATOM 0 HB2 SER B 19 -15.222 -1.962 -3.882 1.00 0.00 H new ATOM 0 HB3 SER B 19 -15.531 -1.583 -2.199 1.00 0.00 H new ATOM 0 HG SER B 19 -17.473 -1.597 -3.466 1.00 0.00 H new ATOM 708 N SER B 20 -15.582 1.326 -5.113 1.00 0.00 N ATOM 709 CA SER B 20 -15.662 1.886 -6.456 1.00 0.00 C ATOM 710 C SER B 20 -14.499 2.838 -6.725 1.00 0.00 C ATOM 711 O SER B 20 -13.929 2.842 -7.815 1.00 0.00 O ATOM 712 CB SER B 20 -16.990 2.619 -6.647 1.00 0.00 C ATOM 713 OG SER B 20 -18.088 1.739 -6.479 1.00 0.00 O ATOM 0 H SER B 20 -16.354 1.589 -4.501 1.00 0.00 H new ATOM 0 HA SER B 20 -15.602 1.062 -7.167 1.00 0.00 H new ATOM 0 HB2 SER B 20 -17.063 3.437 -5.931 1.00 0.00 H new ATOM 0 HB3 SER B 20 -17.024 3.062 -7.642 1.00 0.00 H new ATOM 0 HG SER B 20 -18.925 2.233 -6.605 1.00 0.00 H new ATOM 719 N ASP B 21 -14.158 3.648 -5.726 1.00 0.00 N ATOM 720 CA ASP B 21 -13.066 4.610 -5.858 1.00 0.00 C ATOM 721 C ASP B 21 -11.761 3.918 -6.244 1.00 0.00 C ATOM 722 O ASP B 21 -11.385 2.904 -5.655 1.00 0.00 O ATOM 723 CB ASP B 21 -12.877 5.381 -4.550 1.00 0.00 C ATOM 724 CG ASP B 21 -14.096 6.204 -4.177 1.00 0.00 C ATOM 725 OD1 ASP B 21 -15.087 6.180 -4.938 1.00 0.00 O ATOM 726 OD2 ASP B 21 -14.059 6.873 -3.123 1.00 0.00 O ATOM 0 H ASP B 21 -14.621 3.658 -4.817 1.00 0.00 H new ATOM 0 HA ASP B 21 -13.331 5.307 -6.653 1.00 0.00 H new ATOM 0 HB2 ASP B 21 -12.658 4.678 -3.746 1.00 0.00 H new ATOM 0 HB3 ASP B 21 -12.013 6.039 -4.642 1.00 0.00 H new ATOM 731 N THR B 22 -11.076 4.478 -7.237 1.00 0.00 N ATOM 732 CA THR B 22 -9.811 3.927 -7.710 1.00 0.00 C ATOM 733 C THR B 22 -8.675 4.230 -6.738 1.00 0.00 C ATOM 734 O THR B 22 -8.797 5.104 -5.879 1.00 0.00 O ATOM 735 CB THR B 22 -9.439 4.477 -9.099 1.00 0.00 C ATOM 736 OG1 THR B 22 -9.358 5.906 -9.056 1.00 0.00 O ATOM 737 CG2 THR B 22 -10.463 4.052 -10.142 1.00 0.00 C ATOM 0 H THR B 22 -11.378 5.317 -7.732 1.00 0.00 H new ATOM 0 HA THR B 22 -9.949 2.848 -7.778 1.00 0.00 H new ATOM 0 HB THR B 22 -8.468 4.068 -9.379 1.00 0.00 H new ATOM 0 HG1 THR B 22 -9.119 6.247 -9.943 1.00 0.00 H new ATOM 0 HG21 THR B 22 -10.179 4.452 -11.115 1.00 0.00 H new ATOM 0 HG22 THR B 22 -10.499 2.964 -10.194 1.00 0.00 H new ATOM 0 HG23 THR B 22 -11.445 4.435 -9.865 1.00 0.00 H new ATOM 745 N ILE B 23 -7.571 3.502 -6.884 1.00 0.00 N ATOM 746 CA ILE B 23 -6.404 3.686 -6.026 1.00 0.00 C ATOM 747 C ILE B 23 -5.986 5.153 -5.967 1.00 0.00 C ATOM 748 O ILE B 23 -5.565 5.645 -4.919 1.00 0.00 O ATOM 749 CB ILE B 23 -5.215 2.828 -6.511 1.00 0.00 C ATOM 750 CG1 ILE B 23 -5.540 1.338 -6.358 1.00 0.00 C ATOM 751 CG2 ILE B 23 -3.944 3.183 -5.748 1.00 0.00 C ATOM 752 CD1 ILE B 23 -5.742 0.901 -4.921 1.00 0.00 C ATOM 0 H ILE B 23 -7.460 2.776 -7.592 1.00 0.00 H new ATOM 0 HA ILE B 23 -6.688 3.362 -5.025 1.00 0.00 H new ATOM 0 HB ILE B 23 -5.044 3.040 -7.566 1.00 0.00 H new ATOM 0 HG12 ILE B 23 -6.442 1.112 -6.927 1.00 0.00 H new ATOM 0 HG13 ILE B 23 -4.732 0.752 -6.796 1.00 0.00 H new ATOM 0 HG21 ILE B 23 -3.120 2.566 -6.107 1.00 0.00 H new ATOM 0 HG22 ILE B 23 -3.706 4.235 -5.907 1.00 0.00 H new ATOM 0 HG23 ILE B 23 -4.096 3.002 -4.684 1.00 0.00 H new ATOM 0 HD11 ILE B 23 -5.968 -0.165 -4.893 1.00 0.00 H new ATOM 0 HD12 ILE B 23 -4.833 1.094 -4.351 1.00 0.00 H new ATOM 0 HD13 ILE B 23 -6.570 1.459 -4.484 1.00 0.00 H new ATOM 764 N ASP B 24 -6.111 5.849 -7.095 1.00 0.00 N ATOM 765 CA ASP B 24 -5.751 7.262 -7.167 1.00 0.00 C ATOM 766 C ASP B 24 -6.437 8.045 -6.051 1.00 0.00 C ATOM 767 O ASP B 24 -5.813 8.869 -5.379 1.00 0.00 O ATOM 768 CB ASP B 24 -6.144 7.838 -8.530 1.00 0.00 C ATOM 769 CG ASP B 24 -5.711 9.282 -8.706 1.00 0.00 C ATOM 770 OD1 ASP B 24 -5.057 9.825 -7.791 1.00 0.00 O ATOM 771 OD2 ASP B 24 -6.021 9.868 -9.764 1.00 0.00 O ATOM 0 H ASP B 24 -6.459 5.457 -7.970 1.00 0.00 H new ATOM 0 HA ASP B 24 -4.672 7.351 -7.043 1.00 0.00 H new ATOM 0 HB2 ASP B 24 -5.698 7.231 -9.318 1.00 0.00 H new ATOM 0 HB3 ASP B 24 -7.225 7.771 -8.650 1.00 0.00 H new ATOM 776 N ASN B 25 -7.722 7.769 -5.853 1.00 0.00 N ATOM 777 CA ASN B 25 -8.498 8.433 -4.813 1.00 0.00 C ATOM 778 C ASN B 25 -7.844 8.224 -3.450 1.00 0.00 C ATOM 779 O ASN B 25 -7.703 9.163 -2.662 1.00 0.00 O ATOM 780 CB ASN B 25 -9.927 7.885 -4.799 1.00 0.00 C ATOM 781 CG ASN B 25 -10.820 8.607 -3.810 1.00 0.00 C ATOM 782 OD1 ASN B 25 -10.553 8.623 -2.609 1.00 0.00 O ATOM 783 ND2 ASN B 25 -11.891 9.209 -4.313 1.00 0.00 N ATOM 0 H ASN B 25 -8.248 7.088 -6.401 1.00 0.00 H new ATOM 0 HA ASN B 25 -8.529 9.502 -5.025 1.00 0.00 H new ATOM 0 HB2 ASN B 25 -10.354 7.971 -5.798 1.00 0.00 H new ATOM 0 HB3 ASN B 25 -9.902 6.824 -4.553 1.00 0.00 H new ATOM 0 HD21 ASN B 25 -12.531 9.710 -3.697 1.00 0.00 H new ATOM 0 HD22 ASN B 25 -12.074 9.170 -5.316 1.00 0.00 H new ATOM 790 N VAL B 26 -7.436 6.985 -3.189 1.00 0.00 N ATOM 791 CA VAL B 26 -6.784 6.639 -1.933 1.00 0.00 C ATOM 792 C VAL B 26 -5.544 7.497 -1.720 1.00 0.00 C ATOM 793 O VAL B 26 -5.315 8.013 -0.627 1.00 0.00 O ATOM 794 CB VAL B 26 -6.381 5.152 -1.903 1.00 0.00 C ATOM 795 CG1 VAL B 26 -5.738 4.792 -0.573 1.00 0.00 C ATOM 796 CG2 VAL B 26 -7.589 4.270 -2.175 1.00 0.00 C ATOM 0 H VAL B 26 -7.547 6.203 -3.834 1.00 0.00 H new ATOM 0 HA VAL B 26 -7.500 6.826 -1.132 1.00 0.00 H new ATOM 0 HB VAL B 26 -5.645 4.980 -2.689 1.00 0.00 H new ATOM 0 HG11 VAL B 26 -5.462 3.737 -0.576 1.00 0.00 H new ATOM 0 HG12 VAL B 26 -4.846 5.400 -0.424 1.00 0.00 H new ATOM 0 HG13 VAL B 26 -6.445 4.980 0.235 1.00 0.00 H new ATOM 0 HG21 VAL B 26 -7.288 3.223 -2.150 1.00 0.00 H new ATOM 0 HG22 VAL B 26 -8.348 4.447 -1.413 1.00 0.00 H new ATOM 0 HG23 VAL B 26 -7.999 4.507 -3.157 1.00 0.00 H new ATOM 806 N LYS B 27 -4.753 7.654 -2.778 1.00 0.00 N ATOM 807 CA LYS B 27 -3.541 8.462 -2.712 1.00 0.00 C ATOM 808 C LYS B 27 -3.873 9.900 -2.339 1.00 0.00 C ATOM 809 O LYS B 27 -3.161 10.526 -1.556 1.00 0.00 O ATOM 810 CB LYS B 27 -2.797 8.426 -4.048 1.00 0.00 C ATOM 811 CG LYS B 27 -2.214 7.064 -4.385 1.00 0.00 C ATOM 812 CD LYS B 27 -1.129 6.665 -3.397 1.00 0.00 C ATOM 813 CE LYS B 27 -0.538 5.307 -3.738 1.00 0.00 C ATOM 814 NZ LYS B 27 -1.564 4.229 -3.695 1.00 0.00 N ATOM 0 H LYS B 27 -4.930 7.233 -3.690 1.00 0.00 H new ATOM 0 HA LYS B 27 -2.896 8.042 -1.940 1.00 0.00 H new ATOM 0 HB2 LYS B 27 -3.480 8.726 -4.843 1.00 0.00 H new ATOM 0 HB3 LYS B 27 -1.992 9.161 -4.026 1.00 0.00 H new ATOM 0 HG2 LYS B 27 -3.007 6.316 -4.379 1.00 0.00 H new ATOM 0 HG3 LYS B 27 -1.801 7.083 -5.393 1.00 0.00 H new ATOM 0 HD2 LYS B 27 -0.340 7.417 -3.398 1.00 0.00 H new ATOM 0 HD3 LYS B 27 -1.544 6.640 -2.389 1.00 0.00 H new ATOM 0 HE2 LYS B 27 -0.092 5.344 -4.732 1.00 0.00 H new ATOM 0 HE3 LYS B 27 0.264 5.074 -3.037 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 -1.106 3.308 -3.850 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 -2.032 4.232 -2.766 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 -2.272 4.393 -4.439 1.00 0.00 H new ATOM 828 N SER B 28 -4.959 10.419 -2.904 1.00 0.00 N ATOM 829 CA SER B 28 -5.383 11.787 -2.625 1.00 0.00 C ATOM 830 C SER B 28 -5.659 11.976 -1.137 1.00 0.00 C ATOM 831 O SER B 28 -5.195 12.941 -0.527 1.00 0.00 O ATOM 832 CB SER B 28 -6.635 12.133 -3.434 1.00 0.00 C ATOM 833 OG SER B 28 -7.060 13.460 -3.171 1.00 0.00 O ATOM 0 H SER B 28 -5.560 9.915 -3.556 1.00 0.00 H new ATOM 0 HA SER B 28 -4.575 12.457 -2.917 1.00 0.00 H new ATOM 0 HB2 SER B 28 -6.428 12.018 -4.498 1.00 0.00 H new ATOM 0 HB3 SER B 28 -7.436 11.435 -3.188 1.00 0.00 H new ATOM 0 HG SER B 28 -7.860 13.658 -3.701 1.00 0.00 H new ATOM 839 N LYS B 29 -6.417 11.049 -0.557 1.00 0.00 N ATOM 840 CA LYS B 29 -6.755 11.117 0.862 1.00 0.00 C ATOM 841 C LYS B 29 -5.508 10.995 1.736 1.00 0.00 C ATOM 842 O LYS B 29 -5.328 11.761 2.683 1.00 0.00 O ATOM 843 CB LYS B 29 -7.756 10.020 1.232 1.00 0.00 C ATOM 844 CG LYS B 29 -9.102 10.159 0.540 1.00 0.00 C ATOM 845 CD LYS B 29 -10.086 9.106 1.022 1.00 0.00 C ATOM 846 CE LYS B 29 -11.444 9.265 0.357 1.00 0.00 C ATOM 847 NZ LYS B 29 -12.430 8.268 0.859 1.00 0.00 N ATOM 0 H LYS B 29 -6.808 10.244 -1.046 1.00 0.00 H new ATOM 0 HA LYS B 29 -7.210 12.091 1.044 1.00 0.00 H new ATOM 0 HB2 LYS B 29 -7.327 9.050 0.981 1.00 0.00 H new ATOM 0 HB3 LYS B 29 -7.910 10.030 2.311 1.00 0.00 H new ATOM 0 HG2 LYS B 29 -9.509 11.152 0.729 1.00 0.00 H new ATOM 0 HG3 LYS B 29 -8.969 10.069 -0.538 1.00 0.00 H new ATOM 0 HD2 LYS B 29 -9.690 8.113 0.810 1.00 0.00 H new ATOM 0 HD3 LYS B 29 -10.199 9.180 2.104 1.00 0.00 H new ATOM 0 HE2 LYS B 29 -11.821 10.271 0.539 1.00 0.00 H new ATOM 0 HE3 LYS B 29 -11.335 9.155 -0.722 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 -12.865 7.775 0.054 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 -11.946 7.577 1.468 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 -13.168 8.755 1.407 1.00 0.00 H new ATOM 861 N ILE B 30 -4.654 10.026 1.417 1.00 0.00 N ATOM 862 CA ILE B 30 -3.428 9.805 2.180 1.00 0.00 C ATOM 863 C ILE B 30 -2.521 11.030 2.131 1.00 0.00 C ATOM 864 O ILE B 30 -1.965 11.443 3.148 1.00 0.00 O ATOM 865 CB ILE B 30 -2.650 8.578 1.658 1.00 0.00 C ATOM 866 CG1 ILE B 30 -3.514 7.319 1.759 1.00 0.00 C ATOM 867 CG2 ILE B 30 -1.356 8.401 2.442 1.00 0.00 C ATOM 868 CD1 ILE B 30 -2.844 6.075 1.215 1.00 0.00 C ATOM 0 H ILE B 30 -4.788 9.382 0.637 1.00 0.00 H new ATOM 0 HA ILE B 30 -3.728 9.620 3.212 1.00 0.00 H new ATOM 0 HB ILE B 30 -2.400 8.742 0.610 1.00 0.00 H new ATOM 0 HG12 ILE B 30 -3.776 7.152 2.804 1.00 0.00 H new ATOM 0 HG13 ILE B 30 -4.446 7.485 1.219 1.00 0.00 H new ATOM 0 HG21 ILE B 30 -0.817 7.532 2.064 1.00 0.00 H new ATOM 0 HG22 ILE B 30 -0.736 9.290 2.327 1.00 0.00 H new ATOM 0 HG23 ILE B 30 -1.587 8.253 3.497 1.00 0.00 H new ATOM 0 HD11 ILE B 30 -3.517 5.224 1.321 1.00 0.00 H new ATOM 0 HD12 ILE B 30 -2.606 6.221 0.161 1.00 0.00 H new ATOM 0 HD13 ILE B 30 -1.926 5.883 1.771 1.00 0.00 H new ATOM 880 N GLN B 31 -2.379 11.606 0.944 1.00 0.00 N ATOM 881 CA GLN B 31 -1.542 12.785 0.760 1.00 0.00 C ATOM 882 C GLN B 31 -2.065 13.950 1.593 1.00 0.00 C ATOM 883 O GLN B 31 -1.294 14.683 2.207 1.00 0.00 O ATOM 884 CB GLN B 31 -1.489 13.169 -0.724 1.00 0.00 C ATOM 885 CG GLN B 31 -0.603 14.371 -1.029 1.00 0.00 C ATOM 886 CD GLN B 31 -1.226 15.689 -0.611 1.00 0.00 C ATOM 887 OE1 GLN B 31 -2.318 16.041 -1.056 1.00 0.00 O ATOM 888 NE2 GLN B 31 -0.530 16.428 0.246 1.00 0.00 N ATOM 0 H GLN B 31 -2.833 11.275 0.093 1.00 0.00 H new ATOM 0 HA GLN B 31 -0.533 12.550 1.097 1.00 0.00 H new ATOM 0 HB2 GLN B 31 -1.130 12.313 -1.296 1.00 0.00 H new ATOM 0 HB3 GLN B 31 -2.501 13.381 -1.069 1.00 0.00 H new ATOM 0 HG2 GLN B 31 0.353 14.249 -0.519 1.00 0.00 H new ATOM 0 HG3 GLN B 31 -0.393 14.398 -2.098 1.00 0.00 H new ATOM 0 HE21 GLN B 31 0.372 16.097 0.590 1.00 0.00 H new ATOM 0 HE22 GLN B 31 -0.897 17.326 0.560 1.00 0.00 H new ATOM 897 N ASP B 32 -3.381 14.117 1.602 1.00 0.00 N ATOM 898 CA ASP B 32 -4.012 15.197 2.351 1.00 0.00 C ATOM 899 C ASP B 32 -3.782 15.052 3.856 1.00 0.00 C ATOM 900 O ASP B 32 -3.442 16.023 4.534 1.00 0.00 O ATOM 901 CB ASP B 32 -5.513 15.231 2.059 1.00 0.00 C ATOM 902 CG ASP B 32 -6.225 16.342 2.806 1.00 0.00 C ATOM 903 OD1 ASP B 32 -5.873 17.521 2.594 1.00 0.00 O ATOM 904 OD2 ASP B 32 -7.136 16.032 3.602 1.00 0.00 O ATOM 0 H ASP B 32 -4.034 13.517 1.098 1.00 0.00 H new ATOM 0 HA ASP B 32 -3.554 16.132 2.030 1.00 0.00 H new ATOM 0 HB2 ASP B 32 -5.669 15.360 0.988 1.00 0.00 H new ATOM 0 HB3 ASP B 32 -5.955 14.273 2.332 1.00 0.00 H new ATOM 909 N LYS B 33 -3.991 13.845 4.377 1.00 0.00 N ATOM 910 CA LYS B 33 -3.828 13.591 5.808 1.00 0.00 C ATOM 911 C LYS B 33 -2.357 13.548 6.223 1.00 0.00 C ATOM 912 O LYS B 33 -1.898 14.385 7.001 1.00 0.00 O ATOM 913 CB LYS B 33 -4.502 12.272 6.191 1.00 0.00 C ATOM 914 CG LYS B 33 -4.552 12.034 7.692 1.00 0.00 C ATOM 915 CD LYS B 33 -5.183 10.692 8.024 1.00 0.00 C ATOM 916 CE LYS B 33 -5.284 10.483 9.526 1.00 0.00 C ATOM 917 NZ LYS B 33 -3.950 10.546 10.186 1.00 0.00 N ATOM 0 H LYS B 33 -4.273 13.030 3.833 1.00 0.00 H new ATOM 0 HA LYS B 33 -4.302 14.419 6.336 1.00 0.00 H new ATOM 0 HB2 LYS B 33 -5.517 12.263 5.795 1.00 0.00 H new ATOM 0 HB3 LYS B 33 -3.968 11.448 5.717 1.00 0.00 H new ATOM 0 HG2 LYS B 33 -3.542 12.073 8.101 1.00 0.00 H new ATOM 0 HG3 LYS B 33 -5.121 12.832 8.169 1.00 0.00 H new ATOM 0 HD2 LYS B 33 -6.177 10.636 7.580 1.00 0.00 H new ATOM 0 HD3 LYS B 33 -4.591 9.891 7.583 1.00 0.00 H new ATOM 0 HE2 LYS B 33 -5.938 11.242 9.955 1.00 0.00 H new ATOM 0 HE3 LYS B 33 -5.744 9.516 9.728 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 -3.995 10.063 11.106 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 -3.242 10.079 9.584 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 -3.680 11.540 10.329 1.00 0.00 H new ATOM 931 N GLU B 34 -1.633 12.555 5.718 1.00 0.00 N ATOM 932 CA GLU B 34 -0.221 12.380 6.054 1.00 0.00 C ATOM 933 C GLU B 34 0.633 13.532 5.535 1.00 0.00 C ATOM 934 O GLU B 34 1.608 13.928 6.175 1.00 0.00 O ATOM 935 CB GLU B 34 0.299 11.061 5.481 1.00 0.00 C ATOM 936 CG GLU B 34 -0.568 9.861 5.828 1.00 0.00 C ATOM 937 CD GLU B 34 -0.688 9.638 7.323 1.00 0.00 C ATOM 938 OE1 GLU B 34 0.355 9.427 7.978 1.00 0.00 O ATOM 939 OE2 GLU B 34 -1.825 9.674 7.839 1.00 0.00 O ATOM 0 H GLU B 34 -2.000 11.856 5.072 1.00 0.00 H new ATOM 0 HA GLU B 34 -0.145 12.366 7.141 1.00 0.00 H new ATOM 0 HB2 GLU B 34 0.367 11.148 4.397 1.00 0.00 H new ATOM 0 HB3 GLU B 34 1.309 10.887 5.851 1.00 0.00 H new ATOM 0 HG2 GLU B 34 -1.563 10.002 5.405 1.00 0.00 H new ATOM 0 HG3 GLU B 34 -0.148 8.968 5.364 1.00 0.00 H new ATOM 946 N GLY B 35 0.279 14.049 4.365 1.00 0.00 N ATOM 947 CA GLY B 35 1.045 15.130 3.775 1.00 0.00 C ATOM 948 C GLY B 35 2.269 14.611 3.051 1.00 0.00 C ATOM 949 O GLY B 35 3.346 15.204 3.123 1.00 0.00 O ATOM 0 H GLY B 35 -0.523 13.740 3.815 1.00 0.00 H new ATOM 0 HA2 GLY B 35 0.417 15.685 3.078 1.00 0.00 H new ATOM 0 HA3 GLY B 35 1.351 15.828 4.554 1.00 0.00 H new ATOM 953 N ILE B 36 2.096 13.491 2.354 1.00 0.00 N ATOM 954 CA ILE B 36 3.183 12.867 1.610 1.00 0.00 C ATOM 955 C ILE B 36 2.777 12.640 0.154 1.00 0.00 C ATOM 956 O ILE B 36 1.669 12.174 -0.118 1.00 0.00 O ATOM 957 CB ILE B 36 3.576 11.510 2.234 1.00 0.00 C ATOM 958 CG1 ILE B 36 3.746 11.637 3.753 1.00 0.00 C ATOM 959 CG2 ILE B 36 4.850 10.977 1.597 1.00 0.00 C ATOM 960 CD1 ILE B 36 4.767 12.671 4.176 1.00 0.00 C ATOM 0 H ILE B 36 1.207 12.995 2.290 1.00 0.00 H new ATOM 0 HA ILE B 36 4.037 13.543 1.653 1.00 0.00 H new ATOM 0 HB ILE B 36 2.771 10.801 2.040 1.00 0.00 H new ATOM 0 HG12 ILE B 36 2.783 11.891 4.196 1.00 0.00 H new ATOM 0 HG13 ILE B 36 4.037 10.668 4.158 1.00 0.00 H new ATOM 0 HG21 ILE B 36 5.111 10.020 2.050 1.00 0.00 H new ATOM 0 HG22 ILE B 36 4.692 10.841 0.527 1.00 0.00 H new ATOM 0 HG23 ILE B 36 5.661 11.687 1.757 1.00 0.00 H new ATOM 0 HD11 ILE B 36 4.827 12.699 5.264 1.00 0.00 H new ATOM 0 HD12 ILE B 36 5.742 12.409 3.765 1.00 0.00 H new ATOM 0 HD13 ILE B 36 4.468 13.651 3.804 1.00 0.00 H new ATOM 972 N PRO B 37 3.664 12.965 -0.806 1.00 0.00 N ATOM 973 CA PRO B 37 3.377 12.787 -2.235 1.00 0.00 C ATOM 974 C PRO B 37 2.897 11.373 -2.556 1.00 0.00 C ATOM 975 O PRO B 37 3.410 10.397 -2.008 1.00 0.00 O ATOM 976 CB PRO B 37 4.725 13.060 -2.906 1.00 0.00 C ATOM 977 CG PRO B 37 5.449 13.948 -1.956 1.00 0.00 C ATOM 978 CD PRO B 37 5.009 13.529 -0.580 1.00 0.00 C ATOM 0 HA PRO B 37 2.577 13.444 -2.576 1.00 0.00 H new ATOM 0 HB2 PRO B 37 5.275 12.135 -3.080 1.00 0.00 H new ATOM 0 HB3 PRO B 37 4.594 13.541 -3.876 1.00 0.00 H new ATOM 0 HG2 PRO B 37 6.528 13.844 -2.069 1.00 0.00 H new ATOM 0 HG3 PRO B 37 5.209 14.995 -2.140 1.00 0.00 H new ATOM 0 HD2 PRO B 37 5.686 12.792 -0.149 1.00 0.00 H new ATOM 0 HD3 PRO B 37 4.980 14.375 0.107 1.00 0.00 H new ATOM 986 N PRO B 38 1.899 11.241 -3.451 1.00 0.00 N ATOM 987 CA PRO B 38 1.350 9.935 -3.838 1.00 0.00 C ATOM 988 C PRO B 38 2.404 9.020 -4.451 1.00 0.00 C ATOM 989 O PRO B 38 2.506 7.847 -4.090 1.00 0.00 O ATOM 990 CB PRO B 38 0.275 10.281 -4.877 1.00 0.00 C ATOM 991 CG PRO B 38 0.602 11.661 -5.334 1.00 0.00 C ATOM 992 CD PRO B 38 1.228 12.346 -4.154 1.00 0.00 C ATOM 0 HA PRO B 38 0.964 9.391 -2.976 1.00 0.00 H new ATOM 0 HB2 PRO B 38 0.291 9.577 -5.709 1.00 0.00 H new ATOM 0 HB3 PRO B 38 -0.723 10.237 -4.441 1.00 0.00 H new ATOM 0 HG2 PRO B 38 1.286 11.640 -6.182 1.00 0.00 H new ATOM 0 HG3 PRO B 38 -0.295 12.187 -5.661 1.00 0.00 H new ATOM 0 HD2 PRO B 38 1.934 13.117 -4.462 1.00 0.00 H new ATOM 0 HD3 PRO B 38 0.481 12.831 -3.525 1.00 0.00 H new ATOM 1000 N ASP B 39 3.188 9.563 -5.377 1.00 0.00 N ATOM 1001 CA ASP B 39 4.236 8.793 -6.039 1.00 0.00 C ATOM 1002 C ASP B 39 5.264 8.299 -5.026 1.00 0.00 C ATOM 1003 O ASP B 39 5.731 7.163 -5.105 1.00 0.00 O ATOM 1004 CB ASP B 39 4.922 9.639 -7.113 1.00 0.00 C ATOM 1005 CG ASP B 39 5.570 10.885 -6.543 1.00 0.00 C ATOM 1006 OD1 ASP B 39 4.845 11.716 -5.957 1.00 0.00 O ATOM 1007 OD2 ASP B 39 6.803 11.030 -6.680 1.00 0.00 O ATOM 0 H ASP B 39 3.118 10.533 -5.686 1.00 0.00 H new ATOM 0 HA ASP B 39 3.774 7.928 -6.514 1.00 0.00 H new ATOM 0 HB2 ASP B 39 5.679 9.038 -7.617 1.00 0.00 H new ATOM 0 HB3 ASP B 39 4.190 9.927 -7.867 1.00 0.00 H new ATOM 1012 N GLN B 40 5.609 9.163 -4.076 1.00 0.00 N ATOM 1013 CA GLN B 40 6.581 8.825 -3.041 1.00 0.00 C ATOM 1014 C GLN B 40 6.184 7.540 -2.318 1.00 0.00 C ATOM 1015 O GLN B 40 7.008 6.644 -2.123 1.00 0.00 O ATOM 1016 CB GLN B 40 6.690 9.976 -2.037 1.00 0.00 C ATOM 1017 CG GLN B 40 7.689 9.727 -0.920 1.00 0.00 C ATOM 1018 CD GLN B 40 9.107 9.571 -1.430 1.00 0.00 C ATOM 1019 OE1 GLN B 40 9.659 10.480 -2.050 1.00 0.00 O ATOM 1020 NE2 GLN B 40 9.704 8.416 -1.172 1.00 0.00 N ATOM 0 H GLN B 40 5.228 10.106 -4.001 1.00 0.00 H new ATOM 0 HA GLN B 40 7.549 8.665 -3.516 1.00 0.00 H new ATOM 0 HB2 GLN B 40 6.974 10.884 -2.569 1.00 0.00 H new ATOM 0 HB3 GLN B 40 5.708 10.157 -1.599 1.00 0.00 H new ATOM 0 HG2 GLN B 40 7.651 10.555 -0.212 1.00 0.00 H new ATOM 0 HG3 GLN B 40 7.402 8.828 -0.375 1.00 0.00 H new ATOM 0 HE21 GLN B 40 9.208 7.690 -0.654 1.00 0.00 H new ATOM 0 HE22 GLN B 40 10.659 8.253 -1.491 1.00 0.00 H new ATOM 1029 N GLN B 41 4.919 7.462 -1.922 1.00 0.00 N ATOM 1030 CA GLN B 41 4.403 6.293 -1.218 1.00 0.00 C ATOM 1031 C GLN B 41 4.096 5.158 -2.192 1.00 0.00 C ATOM 1032 O GLN B 41 3.520 5.384 -3.257 1.00 0.00 O ATOM 1033 CB GLN B 41 3.139 6.666 -0.442 1.00 0.00 C ATOM 1034 CG GLN B 41 3.313 7.880 0.454 1.00 0.00 C ATOM 1035 CD GLN B 41 2.029 8.274 1.157 1.00 0.00 C ATOM 1036 OE1 GLN B 41 1.485 7.509 1.952 1.00 0.00 O ATOM 1037 NE2 GLN B 41 1.535 9.470 0.862 1.00 0.00 N ATOM 0 H GLN B 41 4.229 8.197 -2.077 1.00 0.00 H new ATOM 0 HA GLN B 41 5.168 5.950 -0.522 1.00 0.00 H new ATOM 0 HB2 GLN B 41 2.332 6.859 -1.149 1.00 0.00 H new ATOM 0 HB3 GLN B 41 2.832 5.816 0.167 1.00 0.00 H new ATOM 0 HG2 GLN B 41 4.081 7.670 1.199 1.00 0.00 H new ATOM 0 HG3 GLN B 41 3.669 8.720 -0.143 1.00 0.00 H new ATOM 0 HE21 GLN B 41 2.020 10.072 0.196 1.00 0.00 H new ATOM 0 HE22 GLN B 41 0.671 9.787 1.301 1.00 0.00 H new ATOM 1046 N ARG B 42 4.474 3.938 -1.820 1.00 0.00 N ATOM 1047 CA ARG B 42 4.225 2.774 -2.665 1.00 0.00 C ATOM 1048 C ARG B 42 3.390 1.732 -1.923 1.00 0.00 C ATOM 1049 O ARG B 42 3.910 0.969 -1.109 1.00 0.00 O ATOM 1050 CB ARG B 42 5.547 2.154 -3.124 1.00 0.00 C ATOM 1051 CG ARG B 42 6.417 3.101 -3.936 1.00 0.00 C ATOM 1052 CD ARG B 42 7.645 2.393 -4.486 1.00 0.00 C ATOM 1053 NE ARG B 42 7.290 1.305 -5.397 1.00 0.00 N ATOM 1054 CZ ARG B 42 6.645 1.482 -6.547 1.00 0.00 C ATOM 1055 NH1 ARG B 42 6.306 2.701 -6.944 1.00 0.00 N ATOM 1056 NH2 ARG B 42 6.345 0.438 -7.307 1.00 0.00 N ATOM 0 H ARG B 42 4.952 3.730 -0.943 1.00 0.00 H new ATOM 0 HA ARG B 42 3.667 3.106 -3.540 1.00 0.00 H new ATOM 0 HB2 ARG B 42 6.106 1.822 -2.249 1.00 0.00 H new ATOM 0 HB3 ARG B 42 5.334 1.268 -3.722 1.00 0.00 H new ATOM 0 HG2 ARG B 42 5.835 3.516 -4.759 1.00 0.00 H new ATOM 0 HG3 ARG B 42 6.727 3.938 -3.311 1.00 0.00 H new ATOM 0 HD2 ARG B 42 8.274 3.113 -5.009 1.00 0.00 H new ATOM 0 HD3 ARG B 42 8.235 1.996 -3.660 1.00 0.00 H new ATOM 0 HE ARG B 42 7.552 0.355 -5.135 1.00 0.00 H new ATOM 0 HH11 ARG B 42 6.540 3.509 -6.367 1.00 0.00 H new ATOM 0 HH12 ARG B 42 5.812 2.831 -7.827 1.00 0.00 H new ATOM 0 HH21 ARG B 42 6.609 -0.502 -7.010 1.00 0.00 H new ATOM 0 HH22 ARG B 42 5.850 0.574 -8.189 1.00 0.00 H new ATOM 1070 N LEU B 43 2.092 1.705 -2.213 1.00 0.00 N ATOM 1071 CA LEU B 43 1.179 0.758 -1.577 1.00 0.00 C ATOM 1072 C LEU B 43 1.285 -0.630 -2.202 1.00 0.00 C ATOM 1073 O LEU B 43 1.416 -0.769 -3.417 1.00 0.00 O ATOM 1074 CB LEU B 43 -0.267 1.260 -1.662 1.00 0.00 C ATOM 1075 CG LEU B 43 -0.651 2.352 -0.655 1.00 0.00 C ATOM 1076 CD1 LEU B 43 -0.500 1.840 0.769 1.00 0.00 C ATOM 1077 CD2 LEU B 43 0.188 3.604 -0.864 1.00 0.00 C ATOM 0 H LEU B 43 1.647 2.329 -2.886 1.00 0.00 H new ATOM 0 HA LEU B 43 1.469 0.681 -0.529 1.00 0.00 H new ATOM 0 HB2 LEU B 43 -0.442 1.641 -2.668 1.00 0.00 H new ATOM 0 HB3 LEU B 43 -0.936 0.411 -1.522 1.00 0.00 H new ATOM 0 HG LEU B 43 -1.696 2.614 -0.820 1.00 0.00 H new ATOM 0 HD11 LEU B 43 -0.777 2.628 1.470 1.00 0.00 H new ATOM 0 HD12 LEU B 43 -1.151 0.978 0.917 1.00 0.00 H new ATOM 0 HD13 LEU B 43 0.535 1.547 0.942 1.00 0.00 H new ATOM 0 HD21 LEU B 43 -0.104 4.363 -0.138 1.00 0.00 H new ATOM 0 HD22 LEU B 43 1.242 3.362 -0.732 1.00 0.00 H new ATOM 0 HD23 LEU B 43 0.027 3.986 -1.872 1.00 0.00 H new ATOM 1089 N ILE B 44 1.218 -1.654 -1.354 1.00 0.00 N ATOM 1090 CA ILE B 44 1.297 -3.039 -1.802 1.00 0.00 C ATOM 1091 C ILE B 44 0.260 -3.894 -1.080 1.00 0.00 C ATOM 1092 O ILE B 44 0.018 -3.715 0.117 1.00 0.00 O ATOM 1093 CB ILE B 44 2.699 -3.635 -1.556 1.00 0.00 C ATOM 1094 CG1 ILE B 44 3.764 -2.807 -2.277 1.00 0.00 C ATOM 1095 CG2 ILE B 44 2.751 -5.086 -2.016 1.00 0.00 C ATOM 1096 CD1 ILE B 44 5.178 -3.288 -2.025 1.00 0.00 C ATOM 0 H ILE B 44 1.108 -1.547 -0.346 1.00 0.00 H new ATOM 0 HA ILE B 44 1.098 -3.043 -2.874 1.00 0.00 H new ATOM 0 HB ILE B 44 2.903 -3.606 -0.486 1.00 0.00 H new ATOM 0 HG12 ILE B 44 3.567 -2.830 -3.349 1.00 0.00 H new ATOM 0 HG13 ILE B 44 3.681 -1.767 -1.960 1.00 0.00 H new ATOM 0 HG21 ILE B 44 3.747 -5.490 -1.835 1.00 0.00 H new ATOM 0 HG22 ILE B 44 2.016 -5.670 -1.462 1.00 0.00 H new ATOM 0 HG23 ILE B 44 2.527 -5.138 -3.081 1.00 0.00 H new ATOM 0 HD11 ILE B 44 5.880 -2.655 -2.567 1.00 0.00 H new ATOM 0 HD12 ILE B 44 5.394 -3.238 -0.958 1.00 0.00 H new ATOM 0 HD13 ILE B 44 5.279 -4.318 -2.368 1.00 0.00 H new ATOM 1108 N PHE B 45 -0.351 -4.821 -1.812 1.00 0.00 N ATOM 1109 CA PHE B 45 -1.363 -5.700 -1.238 1.00 0.00 C ATOM 1110 C PHE B 45 -1.306 -7.079 -1.885 1.00 0.00 C ATOM 1111 O PHE B 45 -1.000 -7.199 -3.072 1.00 0.00 O ATOM 1112 CB PHE B 45 -2.760 -5.098 -1.409 1.00 0.00 C ATOM 1113 CG PHE B 45 -3.842 -5.870 -0.702 1.00 0.00 C ATOM 1114 CD1 PHE B 45 -3.690 -6.251 0.623 1.00 0.00 C ATOM 1115 CD2 PHE B 45 -5.010 -6.212 -1.363 1.00 0.00 C ATOM 1116 CE1 PHE B 45 -4.683 -6.958 1.274 1.00 0.00 C ATOM 1117 CE2 PHE B 45 -6.007 -6.920 -0.717 1.00 0.00 C ATOM 1118 CZ PHE B 45 -5.843 -7.293 0.603 1.00 0.00 C ATOM 0 H PHE B 45 -0.163 -4.982 -2.801 1.00 0.00 H new ATOM 0 HA PHE B 45 -1.155 -5.805 -0.173 1.00 0.00 H new ATOM 0 HB2 PHE B 45 -2.753 -4.074 -1.035 1.00 0.00 H new ATOM 0 HB3 PHE B 45 -2.997 -5.048 -2.472 1.00 0.00 H new ATOM 0 HD1 PHE B 45 -2.785 -5.992 1.152 1.00 0.00 H new ATOM 0 HD2 PHE B 45 -5.144 -5.922 -2.395 1.00 0.00 H new ATOM 0 HE1 PHE B 45 -4.552 -7.248 2.306 1.00 0.00 H new ATOM 0 HE2 PHE B 45 -6.913 -7.181 -1.244 1.00 0.00 H new ATOM 0 HZ PHE B 45 -6.620 -7.846 1.110 1.00 0.00 H new ATOM 1128 N ALA B 46 -1.590 -8.109 -1.085 1.00 0.00 N ATOM 1129 CA ALA B 46 -1.568 -9.496 -1.550 1.00 0.00 C ATOM 1130 C ALA B 46 -0.164 -9.901 -1.983 1.00 0.00 C ATOM 1131 O ALA B 46 0.516 -10.657 -1.289 1.00 0.00 O ATOM 1132 CB ALA B 46 -2.556 -9.695 -2.692 1.00 0.00 C ATOM 0 H ALA B 46 -1.840 -8.005 -0.102 1.00 0.00 H new ATOM 0 HA ALA B 46 -1.867 -10.136 -0.720 1.00 0.00 H new ATOM 0 HB1 ALA B 46 -2.525 -10.733 -3.024 1.00 0.00 H new ATOM 0 HB2 ALA B 46 -3.562 -9.454 -2.349 1.00 0.00 H new ATOM 0 HB3 ALA B 46 -2.289 -9.041 -3.522 1.00 0.00 H new ATOM 1138 N GLY B 47 0.263 -9.383 -3.125 1.00 0.00 N ATOM 1139 CA GLY B 47 1.583 -9.682 -3.638 1.00 0.00 C ATOM 1140 C GLY B 47 1.907 -8.858 -4.865 1.00 0.00 C ATOM 1141 O GLY B 47 2.552 -9.343 -5.794 1.00 0.00 O ATOM 0 H GLY B 47 -0.288 -8.755 -3.710 1.00 0.00 H new ATOM 0 HA2 GLY B 47 2.326 -9.490 -2.864 1.00 0.00 H new ATOM 0 HA3 GLY B 47 1.646 -10.742 -3.884 1.00 0.00 H new ATOM 1145 N LYS B 48 1.450 -7.606 -4.869 1.00 0.00 N ATOM 1146 CA LYS B 48 1.690 -6.713 -5.998 1.00 0.00 C ATOM 1147 C LYS B 48 1.289 -5.277 -5.675 1.00 0.00 C ATOM 1148 O LYS B 48 0.428 -5.034 -4.826 1.00 0.00 O ATOM 1149 CB LYS B 48 0.923 -7.199 -7.229 1.00 0.00 C ATOM 1150 CG LYS B 48 -0.562 -7.402 -6.977 1.00 0.00 C ATOM 1151 CD LYS B 48 -1.294 -7.792 -8.250 1.00 0.00 C ATOM 1152 CE LYS B 48 -2.763 -8.073 -7.983 1.00 0.00 C ATOM 1153 NZ LYS B 48 -3.504 -8.386 -9.235 1.00 0.00 N ATOM 0 H LYS B 48 0.915 -7.191 -4.107 1.00 0.00 H new ATOM 0 HA LYS B 48 2.760 -6.726 -6.206 1.00 0.00 H new ATOM 0 HB2 LYS B 48 1.051 -6.477 -8.036 1.00 0.00 H new ATOM 0 HB3 LYS B 48 1.357 -8.139 -7.570 1.00 0.00 H new ATOM 0 HG2 LYS B 48 -0.702 -8.177 -6.224 1.00 0.00 H new ATOM 0 HG3 LYS B 48 -0.993 -6.485 -6.575 1.00 0.00 H new ATOM 0 HD2 LYS B 48 -1.203 -6.991 -8.983 1.00 0.00 H new ATOM 0 HD3 LYS B 48 -0.826 -8.676 -8.684 1.00 0.00 H new ATOM 0 HE2 LYS B 48 -2.853 -8.909 -7.289 1.00 0.00 H new ATOM 0 HE3 LYS B 48 -3.216 -7.208 -7.499 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 -4.502 -8.572 -9.010 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 -3.440 -7.578 -9.887 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 -3.088 -9.227 -9.684 1.00 0.00 H new ATOM 1167 N GLN B 49 1.924 -4.333 -6.366 1.00 0.00 N ATOM 1168 CA GLN B 49 1.648 -2.913 -6.176 1.00 0.00 C ATOM 1169 C GLN B 49 0.181 -2.607 -6.468 1.00 0.00 C ATOM 1170 O GLN B 49 -0.419 -3.202 -7.363 1.00 0.00 O ATOM 1171 CB GLN B 49 2.543 -2.075 -7.092 1.00 0.00 C ATOM 1172 CG GLN B 49 4.032 -2.306 -6.877 1.00 0.00 C ATOM 1173 CD GLN B 49 4.541 -1.767 -5.550 1.00 0.00 C ATOM 1174 OE1 GLN B 49 5.704 -1.964 -5.197 1.00 0.00 O ATOM 1175 NE2 GLN B 49 3.682 -1.072 -4.810 1.00 0.00 N ATOM 0 H GLN B 49 2.638 -4.529 -7.067 1.00 0.00 H new ATOM 0 HA GLN B 49 1.859 -2.659 -5.137 1.00 0.00 H new ATOM 0 HB2 GLN B 49 2.296 -2.300 -8.130 1.00 0.00 H new ATOM 0 HB3 GLN B 49 2.322 -1.019 -6.933 1.00 0.00 H new ATOM 0 HG2 GLN B 49 4.238 -3.375 -6.929 1.00 0.00 H new ATOM 0 HG3 GLN B 49 4.586 -1.835 -7.689 1.00 0.00 H new ATOM 0 HE21 GLN B 49 2.726 -0.930 -5.136 1.00 0.00 H new ATOM 0 HE22 GLN B 49 3.979 -0.681 -3.916 1.00 0.00 H new ATOM 1184 N LEU B 50 -0.390 -1.681 -5.705 1.00 0.00 N ATOM 1185 CA LEU B 50 -1.787 -1.298 -5.881 1.00 0.00 C ATOM 1186 C LEU B 50 -1.978 -0.376 -7.083 1.00 0.00 C ATOM 1187 O LEU B 50 -2.792 0.544 -7.036 1.00 0.00 O ATOM 1188 CB LEU B 50 -2.314 -0.617 -4.615 1.00 0.00 C ATOM 1189 CG LEU B 50 -2.611 -1.560 -3.448 1.00 0.00 C ATOM 1190 CD1 LEU B 50 -3.020 -0.770 -2.215 1.00 0.00 C ATOM 1191 CD2 LEU B 50 -3.704 -2.545 -3.833 1.00 0.00 C ATOM 0 H LEU B 50 0.093 -1.181 -4.958 1.00 0.00 H new ATOM 0 HA LEU B 50 -2.353 -2.210 -6.067 1.00 0.00 H new ATOM 0 HB2 LEU B 50 -1.583 0.123 -4.288 1.00 0.00 H new ATOM 0 HB3 LEU B 50 -3.226 -0.075 -4.865 1.00 0.00 H new ATOM 0 HG LEU B 50 -1.705 -2.118 -3.214 1.00 0.00 H new ATOM 0 HD11 LEU B 50 -3.227 -1.457 -1.395 1.00 0.00 H new ATOM 0 HD12 LEU B 50 -2.211 -0.097 -1.929 1.00 0.00 H new ATOM 0 HD13 LEU B 50 -3.915 -0.188 -2.436 1.00 0.00 H new ATOM 0 HD21 LEU B 50 -3.906 -3.211 -2.994 1.00 0.00 H new ATOM 0 HD22 LEU B 50 -4.612 -1.999 -4.090 1.00 0.00 H new ATOM 0 HD23 LEU B 50 -3.379 -3.132 -4.692 1.00 0.00 H new ATOM 1203 N GLU B 51 -1.244 -0.642 -8.163 1.00 0.00 N ATOM 1204 CA GLU B 51 -1.352 0.151 -9.383 1.00 0.00 C ATOM 1205 C GLU B 51 -1.518 1.638 -9.074 1.00 0.00 C ATOM 1206 O GLU B 51 -0.949 2.150 -8.110 1.00 0.00 O ATOM 1207 CB GLU B 51 -2.518 -0.376 -10.212 1.00 0.00 C ATOM 1208 CG GLU B 51 -2.349 -1.831 -10.605 1.00 0.00 C ATOM 1209 CD GLU B 51 -1.095 -2.076 -11.421 1.00 0.00 C ATOM 1210 OE1 GLU B 51 -0.968 -1.477 -12.509 1.00 0.00 O ATOM 1211 OE2 GLU B 51 -0.239 -2.866 -10.970 1.00 0.00 O ATOM 0 H GLU B 51 -0.567 -1.403 -8.216 1.00 0.00 H new ATOM 0 HA GLU B 51 -0.429 0.054 -9.954 1.00 0.00 H new ATOM 0 HB2 GLU B 51 -3.442 -0.263 -9.645 1.00 0.00 H new ATOM 0 HB3 GLU B 51 -2.621 0.229 -11.113 1.00 0.00 H new ATOM 0 HG2 GLU B 51 -2.317 -2.445 -9.705 1.00 0.00 H new ATOM 0 HG3 GLU B 51 -3.219 -2.151 -11.178 1.00 0.00 H new ATOM 1218 N ASP B 52 -2.302 2.318 -9.897 1.00 0.00 N ATOM 1219 CA ASP B 52 -2.557 3.742 -9.725 1.00 0.00 C ATOM 1220 C ASP B 52 -3.701 4.194 -10.628 1.00 0.00 C ATOM 1221 O ASP B 52 -3.683 5.300 -11.169 1.00 0.00 O ATOM 1222 CB ASP B 52 -1.292 4.548 -10.028 1.00 0.00 C ATOM 1223 CG ASP B 52 -0.744 4.279 -11.418 1.00 0.00 C ATOM 1224 OD1 ASP B 52 -1.458 4.558 -12.404 1.00 0.00 O ATOM 1225 OD2 ASP B 52 0.400 3.790 -11.519 1.00 0.00 O ATOM 0 H ASP B 52 -2.777 1.902 -10.698 1.00 0.00 H new ATOM 0 HA ASP B 52 -2.845 3.918 -8.689 1.00 0.00 H new ATOM 0 HB2 ASP B 52 -1.511 5.611 -9.928 1.00 0.00 H new ATOM 0 HB3 ASP B 52 -0.528 4.309 -9.288 1.00 0.00 H new ATOM 1230 N GLY B 53 -4.698 3.327 -10.783 1.00 0.00 N ATOM 1231 CA GLY B 53 -5.843 3.645 -11.617 1.00 0.00 C ATOM 1232 C GLY B 53 -6.755 2.451 -11.822 1.00 0.00 C ATOM 1233 O GLY B 53 -7.201 2.187 -12.939 1.00 0.00 O ATOM 0 H GLY B 53 -4.733 2.407 -10.344 1.00 0.00 H new ATOM 0 HA2 GLY B 53 -6.408 4.457 -11.160 1.00 0.00 H new ATOM 0 HA3 GLY B 53 -5.496 4.005 -12.586 1.00 0.00 H new ATOM 1237 N ARG B 54 -7.027 1.725 -10.741 1.00 0.00 N ATOM 1238 CA ARG B 54 -7.884 0.548 -10.803 1.00 0.00 C ATOM 1239 C ARG B 54 -8.857 0.521 -9.626 1.00 0.00 C ATOM 1240 O ARG B 54 -8.470 0.766 -8.484 1.00 0.00 O ATOM 1241 CB ARG B 54 -7.034 -0.724 -10.798 1.00 0.00 C ATOM 1242 CG ARG B 54 -6.062 -0.824 -11.965 1.00 0.00 C ATOM 1243 CD ARG B 54 -6.790 -0.905 -13.299 1.00 0.00 C ATOM 1244 NE ARG B 54 -5.867 -1.051 -14.423 1.00 0.00 N ATOM 1245 CZ ARG B 54 -4.968 -0.133 -14.771 1.00 0.00 C ATOM 1246 NH1 ARG B 54 -4.873 1.002 -14.091 1.00 0.00 N ATOM 1247 NH2 ARG B 54 -4.164 -0.349 -15.804 1.00 0.00 N ATOM 0 H ARG B 54 -6.665 1.933 -9.810 1.00 0.00 H new ATOM 0 HA ARG B 54 -8.458 0.595 -11.728 1.00 0.00 H new ATOM 0 HB2 ARG B 54 -6.472 -0.769 -9.865 1.00 0.00 H new ATOM 0 HB3 ARG B 54 -7.695 -1.590 -10.814 1.00 0.00 H new ATOM 0 HG2 ARG B 54 -5.401 0.043 -11.963 1.00 0.00 H new ATOM 0 HG3 ARG B 54 -5.433 -1.705 -11.840 1.00 0.00 H new ATOM 0 HD2 ARG B 54 -7.479 -1.750 -13.284 1.00 0.00 H new ATOM 0 HD3 ARG B 54 -7.391 -0.006 -13.439 1.00 0.00 H new ATOM 0 HE ARG B 54 -5.915 -1.908 -14.974 1.00 0.00 H new ATOM 0 HH11 ARG B 54 -5.490 1.174 -13.298 1.00 0.00 H new ATOM 0 HH12 ARG B 54 -4.183 1.702 -14.362 1.00 0.00 H new ATOM 0 HH21 ARG B 54 -4.235 -1.219 -16.332 1.00 0.00 H new ATOM 0 HH22 ARG B 54 -3.475 0.355 -16.070 1.00 0.00 H new ATOM 1261 N THR B 55 -10.120 0.220 -9.914 1.00 0.00 N ATOM 1262 CA THR B 55 -11.147 0.159 -8.881 1.00 0.00 C ATOM 1263 C THR B 55 -10.870 -0.971 -7.891 1.00 0.00 C ATOM 1264 O THR B 55 -10.484 -2.073 -8.282 1.00 0.00 O ATOM 1265 CB THR B 55 -12.549 -0.035 -9.489 1.00 0.00 C ATOM 1266 OG1 THR B 55 -12.587 -1.239 -10.261 1.00 0.00 O ATOM 1267 CG2 THR B 55 -12.927 1.149 -10.368 1.00 0.00 C ATOM 0 H THR B 55 -10.456 0.015 -10.855 1.00 0.00 H new ATOM 0 HA THR B 55 -11.119 1.113 -8.354 1.00 0.00 H new ATOM 0 HB THR B 55 -13.267 -0.105 -8.672 1.00 0.00 H new ATOM 0 HG1 THR B 55 -13.181 -1.887 -9.827 1.00 0.00 H new ATOM 0 HG21 THR B 55 -13.921 0.989 -10.786 1.00 0.00 H new ATOM 0 HG22 THR B 55 -12.927 2.061 -9.770 1.00 0.00 H new ATOM 0 HG23 THR B 55 -12.204 1.246 -11.178 1.00 0.00 H new ATOM 1275 N LEU B 56 -11.068 -0.683 -6.608 1.00 0.00 N ATOM 1276 CA LEU B 56 -10.841 -1.663 -5.550 1.00 0.00 C ATOM 1277 C LEU B 56 -11.732 -2.890 -5.721 1.00 0.00 C ATOM 1278 O LEU B 56 -11.380 -3.985 -5.282 1.00 0.00 O ATOM 1279 CB LEU B 56 -11.089 -1.030 -4.180 1.00 0.00 C ATOM 1280 CG LEU B 56 -10.146 0.116 -3.811 1.00 0.00 C ATOM 1281 CD1 LEU B 56 -10.533 0.713 -2.468 1.00 0.00 C ATOM 1282 CD2 LEU B 56 -8.705 -0.370 -3.783 1.00 0.00 C ATOM 0 H LEU B 56 -11.387 0.227 -6.274 1.00 0.00 H new ATOM 0 HA LEU B 56 -9.802 -1.987 -5.618 1.00 0.00 H new ATOM 0 HB2 LEU B 56 -12.114 -0.660 -4.149 1.00 0.00 H new ATOM 0 HB3 LEU B 56 -11.007 -1.806 -3.419 1.00 0.00 H new ATOM 0 HG LEU B 56 -10.234 0.893 -4.570 1.00 0.00 H new ATOM 0 HD11 LEU B 56 -9.851 1.527 -2.222 1.00 0.00 H new ATOM 0 HD12 LEU B 56 -11.552 1.096 -2.520 1.00 0.00 H new ATOM 0 HD13 LEU B 56 -10.474 -0.056 -1.697 1.00 0.00 H new ATOM 0 HD21 LEU B 56 -8.047 0.458 -3.519 1.00 0.00 H new ATOM 0 HD22 LEU B 56 -8.603 -1.165 -3.044 1.00 0.00 H new ATOM 0 HD23 LEU B 56 -8.431 -0.752 -4.766 1.00 0.00 H new ATOM 1294 N SER B 57 -12.891 -2.697 -6.346 1.00 0.00 N ATOM 1295 CA SER B 57 -13.840 -3.786 -6.559 1.00 0.00 C ATOM 1296 C SER B 57 -13.165 -4.992 -7.207 1.00 0.00 C ATOM 1297 O SER B 57 -13.346 -6.125 -6.761 1.00 0.00 O ATOM 1298 CB SER B 57 -15.001 -3.311 -7.433 1.00 0.00 C ATOM 1299 OG SER B 57 -14.541 -2.884 -8.704 1.00 0.00 O ATOM 0 H SER B 57 -13.196 -1.796 -6.714 1.00 0.00 H new ATOM 0 HA SER B 57 -14.221 -4.091 -5.585 1.00 0.00 H new ATOM 0 HB2 SER B 57 -15.722 -4.119 -7.556 1.00 0.00 H new ATOM 0 HB3 SER B 57 -15.522 -2.492 -6.937 1.00 0.00 H new ATOM 0 HG SER B 57 -15.302 -2.587 -9.245 1.00 0.00 H new ATOM 1305 N ASP B 58 -12.383 -4.745 -8.254 1.00 0.00 N ATOM 1306 CA ASP B 58 -11.681 -5.820 -8.947 1.00 0.00 C ATOM 1307 C ASP B 58 -10.769 -6.571 -7.982 1.00 0.00 C ATOM 1308 O ASP B 58 -10.717 -7.801 -7.989 1.00 0.00 O ATOM 1309 CB ASP B 58 -10.866 -5.262 -10.115 1.00 0.00 C ATOM 1310 CG ASP B 58 -11.743 -4.661 -11.196 1.00 0.00 C ATOM 1311 OD1 ASP B 58 -12.512 -3.728 -10.885 1.00 0.00 O ATOM 1312 OD2 ASP B 58 -11.660 -5.123 -12.353 1.00 0.00 O ATOM 0 H ASP B 58 -12.220 -3.815 -8.639 1.00 0.00 H new ATOM 0 HA ASP B 58 -12.423 -6.516 -9.340 1.00 0.00 H new ATOM 0 HB2 ASP B 58 -10.178 -4.502 -9.744 1.00 0.00 H new ATOM 0 HB3 ASP B 58 -10.259 -6.059 -10.545 1.00 0.00 H new ATOM 1317 N TYR B 59 -10.059 -5.819 -7.148 1.00 0.00 N ATOM 1318 CA TYR B 59 -9.153 -6.404 -6.166 1.00 0.00 C ATOM 1319 C TYR B 59 -9.928 -7.225 -5.140 1.00 0.00 C ATOM 1320 O TYR B 59 -9.418 -8.212 -4.608 1.00 0.00 O ATOM 1321 CB TYR B 59 -8.348 -5.311 -5.453 1.00 0.00 C ATOM 1322 CG TYR B 59 -7.422 -4.526 -6.361 1.00 0.00 C ATOM 1323 CD1 TYR B 59 -7.897 -3.904 -7.510 1.00 0.00 C ATOM 1324 CD2 TYR B 59 -6.069 -4.403 -6.062 1.00 0.00 C ATOM 1325 CE1 TYR B 59 -7.052 -3.186 -8.334 1.00 0.00 C ATOM 1326 CE2 TYR B 59 -5.219 -3.685 -6.882 1.00 0.00 C ATOM 1327 CZ TYR B 59 -5.716 -3.079 -8.016 1.00 0.00 C ATOM 1328 OH TYR B 59 -4.874 -2.364 -8.836 1.00 0.00 O ATOM 0 H TYR B 59 -10.094 -4.800 -7.133 1.00 0.00 H new ATOM 0 HA TYR B 59 -8.463 -7.061 -6.696 1.00 0.00 H new ATOM 0 HB2 TYR B 59 -9.041 -4.619 -4.975 1.00 0.00 H new ATOM 0 HB3 TYR B 59 -7.757 -5.770 -4.660 1.00 0.00 H new ATOM 0 HD1 TYR B 59 -8.944 -3.983 -7.763 1.00 0.00 H new ATOM 0 HD2 TYR B 59 -5.676 -4.876 -5.174 1.00 0.00 H new ATOM 0 HE1 TYR B 59 -7.437 -2.711 -9.224 1.00 0.00 H new ATOM 0 HE2 TYR B 59 -4.171 -3.599 -6.636 1.00 0.00 H new ATOM 0 HH TYR B 59 -4.035 -2.181 -8.364 1.00 0.00 H new ATOM 1338 N ASN B 60 -11.159 -6.799 -4.861 1.00 0.00 N ATOM 1339 CA ASN B 60 -12.014 -7.479 -3.892 1.00 0.00 C ATOM 1340 C ASN B 60 -11.395 -7.420 -2.497 1.00 0.00 C ATOM 1341 O ASN B 60 -11.325 -8.425 -1.790 1.00 0.00 O ATOM 1342 CB ASN B 60 -12.251 -8.934 -4.311 1.00 0.00 C ATOM 1343 CG ASN B 60 -13.213 -9.656 -3.386 1.00 0.00 C ATOM 1344 OD1 ASN B 60 -14.370 -9.260 -3.243 1.00 0.00 O ATOM 1345 ND2 ASN B 60 -12.737 -10.720 -2.751 1.00 0.00 N ATOM 0 H ASN B 60 -11.587 -5.982 -5.295 1.00 0.00 H new ATOM 0 HA ASN B 60 -12.976 -6.967 -3.865 1.00 0.00 H new ATOM 0 HB2 ASN B 60 -12.644 -8.957 -5.328 1.00 0.00 H new ATOM 0 HB3 ASN B 60 -11.299 -9.464 -4.325 1.00 0.00 H new ATOM 0 HD21 ASN B 60 -13.337 -11.245 -2.115 1.00 0.00 H new ATOM 0 HD22 ASN B 60 -11.771 -11.013 -2.899 1.00 0.00 H new ATOM 1352 N ILE B 61 -10.942 -6.231 -2.111 1.00 0.00 N ATOM 1353 CA ILE B 61 -10.325 -6.035 -0.804 1.00 0.00 C ATOM 1354 C ILE B 61 -11.364 -6.093 0.313 1.00 0.00 C ATOM 1355 O ILE B 61 -12.383 -5.403 0.263 1.00 0.00 O ATOM 1356 CB ILE B 61 -9.580 -4.686 -0.732 1.00 0.00 C ATOM 1357 CG1 ILE B 61 -8.522 -4.605 -1.837 1.00 0.00 C ATOM 1358 CG2 ILE B 61 -8.939 -4.508 0.638 1.00 0.00 C ATOM 1359 CD1 ILE B 61 -7.811 -3.270 -1.903 1.00 0.00 C ATOM 0 H ILE B 61 -10.991 -5.389 -2.685 1.00 0.00 H new ATOM 0 HA ILE B 61 -9.609 -6.845 -0.668 1.00 0.00 H new ATOM 0 HB ILE B 61 -10.299 -3.880 -0.882 1.00 0.00 H new ATOM 0 HG12 ILE B 61 -7.784 -5.392 -1.680 1.00 0.00 H new ATOM 0 HG13 ILE B 61 -8.997 -4.801 -2.798 1.00 0.00 H new ATOM 0 HG21 ILE B 61 -8.417 -3.552 0.674 1.00 0.00 H new ATOM 0 HG22 ILE B 61 -9.712 -4.529 1.407 1.00 0.00 H new ATOM 0 HG23 ILE B 61 -8.229 -5.316 0.815 1.00 0.00 H new ATOM 0 HD11 ILE B 61 -7.077 -3.288 -2.709 1.00 0.00 H new ATOM 0 HD12 ILE B 61 -8.538 -2.480 -2.092 1.00 0.00 H new ATOM 0 HD13 ILE B 61 -7.306 -3.080 -0.956 1.00 0.00 H new ATOM 1371 N GLN B 62 -11.094 -6.919 1.320 1.00 0.00 N ATOM 1372 CA GLN B 62 -11.998 -7.070 2.455 1.00 0.00 C ATOM 1373 C GLN B 62 -11.854 -5.901 3.427 1.00 0.00 C ATOM 1374 O GLN B 62 -10.763 -5.359 3.601 1.00 0.00 O ATOM 1375 CB GLN B 62 -11.730 -8.390 3.179 1.00 0.00 C ATOM 1376 CG GLN B 62 -10.311 -8.515 3.714 1.00 0.00 C ATOM 1377 CD GLN B 62 -10.080 -9.797 4.496 1.00 0.00 C ATOM 1378 OE1 GLN B 62 -8.979 -10.042 4.989 1.00 0.00 O ATOM 1379 NE2 GLN B 62 -11.114 -10.625 4.616 1.00 0.00 N ATOM 0 H GLN B 62 -10.254 -7.495 1.373 1.00 0.00 H new ATOM 0 HA GLN B 62 -13.019 -7.077 2.074 1.00 0.00 H new ATOM 0 HB2 GLN B 62 -12.432 -8.489 4.007 1.00 0.00 H new ATOM 0 HB3 GLN B 62 -11.925 -9.216 2.495 1.00 0.00 H new ATOM 0 HG2 GLN B 62 -9.610 -8.473 2.881 1.00 0.00 H new ATOM 0 HG3 GLN B 62 -10.094 -7.661 4.356 1.00 0.00 H new ATOM 0 HE21 GLN B 62 -12.011 -10.386 4.193 1.00 0.00 H new ATOM 0 HE22 GLN B 62 -11.010 -11.499 5.131 1.00 0.00 H new ATOM 1388 N LYS B 63 -12.960 -5.517 4.056 1.00 0.00 N ATOM 1389 CA LYS B 63 -12.957 -4.411 5.010 1.00 0.00 C ATOM 1390 C LYS B 63 -12.008 -4.686 6.174 1.00 0.00 C ATOM 1391 O LYS B 63 -11.808 -5.836 6.568 1.00 0.00 O ATOM 1392 CB LYS B 63 -14.370 -4.161 5.542 1.00 0.00 C ATOM 1393 CG LYS B 63 -14.963 -5.351 6.280 1.00 0.00 C ATOM 1394 CD LYS B 63 -16.365 -5.062 6.802 1.00 0.00 C ATOM 1395 CE LYS B 63 -16.362 -4.023 7.918 1.00 0.00 C ATOM 1396 NZ LYS B 63 -15.983 -2.667 7.431 1.00 0.00 N ATOM 0 H LYS B 63 -13.871 -5.955 3.923 1.00 0.00 H new ATOM 0 HA LYS B 63 -12.608 -3.522 4.485 1.00 0.00 H new ATOM 0 HB2 LYS B 63 -14.350 -3.302 6.212 1.00 0.00 H new ATOM 0 HB3 LYS B 63 -15.022 -3.900 4.708 1.00 0.00 H new ATOM 0 HG2 LYS B 63 -14.996 -6.212 5.612 1.00 0.00 H new ATOM 0 HG3 LYS B 63 -14.314 -5.620 7.114 1.00 0.00 H new ATOM 0 HD2 LYS B 63 -16.991 -4.710 5.982 1.00 0.00 H new ATOM 0 HD3 LYS B 63 -16.812 -5.986 7.169 1.00 0.00 H new ATOM 0 HE2 LYS B 63 -17.352 -3.979 8.373 1.00 0.00 H new ATOM 0 HE3 LYS B 63 -15.667 -4.333 8.698 1.00 0.00 H new ATOM 0 HZ1 LYS B 63 -16.543 -1.949 7.934 1.00 0.00 H new ATOM 0 HZ2 LYS B 63 -14.971 -2.505 7.609 1.00 0.00 H new ATOM 0 HZ3 LYS B 63 -16.170 -2.600 6.410 1.00 0.00 H new ATOM 1410 N GLU B 64 -11.432 -3.616 6.720 1.00 0.00 N ATOM 1411 CA GLU B 64 -10.505 -3.716 7.846 1.00 0.00 C ATOM 1412 C GLU B 64 -9.226 -4.452 7.458 1.00 0.00 C ATOM 1413 O GLU B 64 -8.819 -5.406 8.123 1.00 0.00 O ATOM 1414 CB GLU B 64 -11.174 -4.413 9.033 1.00 0.00 C ATOM 1415 CG GLU B 64 -12.410 -3.691 9.543 1.00 0.00 C ATOM 1416 CD GLU B 64 -13.060 -4.397 10.717 1.00 0.00 C ATOM 1417 OE1 GLU B 64 -12.549 -5.460 11.129 1.00 0.00 O ATOM 1418 OE2 GLU B 64 -14.081 -3.887 11.225 1.00 0.00 O ATOM 0 H GLU B 64 -11.593 -2.662 6.397 1.00 0.00 H new ATOM 0 HA GLU B 64 -10.233 -2.701 8.137 1.00 0.00 H new ATOM 0 HB2 GLU B 64 -11.450 -5.426 8.741 1.00 0.00 H new ATOM 0 HB3 GLU B 64 -10.453 -4.501 9.846 1.00 0.00 H new ATOM 0 HG2 GLU B 64 -12.137 -2.678 9.840 1.00 0.00 H new ATOM 0 HG3 GLU B 64 -13.133 -3.602 8.733 1.00 0.00 H new ATOM 1425 N SER B 65 -8.590 -3.998 6.382 1.00 0.00 N ATOM 1426 CA SER B 65 -7.351 -4.606 5.910 1.00 0.00 C ATOM 1427 C SER B 65 -6.201 -3.605 5.960 1.00 0.00 C ATOM 1428 O SER B 65 -6.376 -2.424 5.653 1.00 0.00 O ATOM 1429 CB SER B 65 -7.522 -5.136 4.487 1.00 0.00 C ATOM 1430 OG SER B 65 -8.474 -6.183 4.444 1.00 0.00 O ATOM 0 H SER B 65 -8.913 -3.210 5.820 1.00 0.00 H new ATOM 0 HA SER B 65 -7.113 -5.440 6.570 1.00 0.00 H new ATOM 0 HB2 SER B 65 -7.838 -4.326 3.829 1.00 0.00 H new ATOM 0 HB3 SER B 65 -6.564 -5.496 4.112 1.00 0.00 H new ATOM 0 HG SER B 65 -9.335 -5.830 4.136 1.00 0.00 H new ATOM 1436 N THR B 66 -5.024 -4.085 6.353 1.00 0.00 N ATOM 1437 CA THR B 66 -3.843 -3.235 6.442 1.00 0.00 C ATOM 1438 C THR B 66 -3.020 -3.307 5.158 1.00 0.00 C ATOM 1439 O THR B 66 -2.491 -4.361 4.808 1.00 0.00 O ATOM 1440 CB THR B 66 -2.955 -3.635 7.637 1.00 0.00 C ATOM 1441 OG1 THR B 66 -3.713 -3.574 8.851 1.00 0.00 O ATOM 1442 CG2 THR B 66 -1.745 -2.720 7.748 1.00 0.00 C ATOM 0 H THR B 66 -4.864 -5.058 6.615 1.00 0.00 H new ATOM 0 HA THR B 66 -4.193 -2.213 6.588 1.00 0.00 H new ATOM 0 HB THR B 66 -2.606 -4.654 7.473 1.00 0.00 H new ATOM 0 HG1 THR B 66 -3.143 -3.831 9.606 1.00 0.00 H new ATOM 0 HG21 THR B 66 -1.136 -3.024 8.599 1.00 0.00 H new ATOM 0 HG22 THR B 66 -1.153 -2.787 6.835 1.00 0.00 H new ATOM 0 HG23 THR B 66 -2.078 -1.692 7.889 1.00 0.00 H new ATOM 1450 N LEU B 67 -2.916 -2.178 4.460 1.00 0.00 N ATOM 1451 CA LEU B 67 -2.156 -2.113 3.216 1.00 0.00 C ATOM 1452 C LEU B 67 -0.710 -1.705 3.480 1.00 0.00 C ATOM 1453 O LEU B 67 -0.446 -0.808 4.279 1.00 0.00 O ATOM 1454 CB LEU B 67 -2.813 -1.129 2.245 1.00 0.00 C ATOM 1455 CG LEU B 67 -4.271 -1.440 1.896 1.00 0.00 C ATOM 1456 CD1 LEU B 67 -4.816 -0.411 0.919 1.00 0.00 C ATOM 1457 CD2 LEU B 67 -4.399 -2.843 1.319 1.00 0.00 C ATOM 0 H LEU B 67 -3.349 -1.296 4.736 1.00 0.00 H new ATOM 0 HA LEU B 67 -2.154 -3.106 2.767 1.00 0.00 H new ATOM 0 HB2 LEU B 67 -2.764 -0.129 2.676 1.00 0.00 H new ATOM 0 HB3 LEU B 67 -2.231 -1.108 1.324 1.00 0.00 H new ATOM 0 HG LEU B 67 -4.859 -1.392 2.812 1.00 0.00 H new ATOM 0 HD11 LEU B 67 -5.853 -0.648 0.682 1.00 0.00 H new ATOM 0 HD12 LEU B 67 -4.764 0.581 1.368 1.00 0.00 H new ATOM 0 HD13 LEU B 67 -4.222 -0.427 0.005 1.00 0.00 H new ATOM 0 HD21 LEU B 67 -5.443 -3.043 1.078 1.00 0.00 H new ATOM 0 HD22 LEU B 67 -3.796 -2.921 0.414 1.00 0.00 H new ATOM 0 HD23 LEU B 67 -4.050 -3.571 2.051 1.00 0.00 H new ATOM 1469 N HIS B 68 0.223 -2.370 2.804 1.00 0.00 N ATOM 1470 CA HIS B 68 1.644 -2.077 2.969 1.00 0.00 C ATOM 1471 C HIS B 68 2.041 -0.806 2.222 1.00 0.00 C ATOM 1472 O HIS B 68 1.492 -0.500 1.166 1.00 0.00 O ATOM 1473 CB HIS B 68 2.490 -3.252 2.479 1.00 0.00 C ATOM 1474 CG HIS B 68 2.261 -4.514 3.250 1.00 0.00 C ATOM 1475 ND1 HIS B 68 2.495 -4.622 4.605 1.00 0.00 N ATOM 1476 CD2 HIS B 68 1.818 -5.729 2.849 1.00 0.00 C ATOM 1477 CE1 HIS B 68 2.207 -5.848 5.003 1.00 0.00 C ATOM 1478 NE2 HIS B 68 1.793 -6.539 3.958 1.00 0.00 N ATOM 0 H HIS B 68 0.021 -3.115 2.137 1.00 0.00 H new ATOM 0 HA HIS B 68 1.828 -1.919 4.032 1.00 0.00 H new ATOM 0 HB2 HIS B 68 2.271 -3.433 1.427 1.00 0.00 H new ATOM 0 HB3 HIS B 68 3.544 -2.982 2.543 1.00 0.00 H new ATOM 0 HD1 HIS B 68 2.837 -3.872 5.206 1.00 0.00 H new ATOM 0 HD2 HIS B 68 1.537 -6.009 1.845 1.00 0.00 H new ATOM 0 HE1 HIS B 68 2.295 -6.222 6.012 1.00 0.00 H new ATOM 1487 N LEU B 69 2.999 -0.071 2.779 1.00 0.00 N ATOM 1488 CA LEU B 69 3.470 1.166 2.162 1.00 0.00 C ATOM 1489 C LEU B 69 4.999 1.209 2.167 1.00 0.00 C ATOM 1490 O LEU B 69 5.633 0.878 3.169 1.00 0.00 O ATOM 1491 CB LEU B 69 2.894 2.375 2.912 1.00 0.00 C ATOM 1492 CG LEU B 69 2.972 3.717 2.182 1.00 0.00 C ATOM 1493 CD1 LEU B 69 2.088 4.742 2.874 1.00 0.00 C ATOM 1494 CD2 LEU B 69 4.402 4.215 2.129 1.00 0.00 C ATOM 0 H LEU B 69 3.464 -0.309 3.655 1.00 0.00 H new ATOM 0 HA LEU B 69 3.129 1.201 1.127 1.00 0.00 H new ATOM 0 HB2 LEU B 69 1.849 2.170 3.143 1.00 0.00 H new ATOM 0 HB3 LEU B 69 3.418 2.470 3.863 1.00 0.00 H new ATOM 0 HG LEU B 69 2.618 3.574 1.161 1.00 0.00 H new ATOM 0 HD11 LEU B 69 2.152 5.693 2.346 1.00 0.00 H new ATOM 0 HD12 LEU B 69 1.055 4.393 2.871 1.00 0.00 H new ATOM 0 HD13 LEU B 69 2.422 4.875 3.903 1.00 0.00 H new ATOM 0 HD21 LEU B 69 4.435 5.171 1.606 1.00 0.00 H new ATOM 0 HD22 LEU B 69 4.780 4.343 3.143 1.00 0.00 H new ATOM 0 HD23 LEU B 69 5.020 3.490 1.600 1.00 0.00 H new ATOM 1506 N VAL B 70 5.585 1.620 1.043 1.00 0.00 N ATOM 1507 CA VAL B 70 7.036 1.704 0.924 1.00 0.00 C ATOM 1508 C VAL B 70 7.454 3.086 0.434 1.00 0.00 C ATOM 1509 O VAL B 70 6.993 3.548 -0.610 1.00 0.00 O ATOM 1510 CB VAL B 70 7.589 0.646 -0.054 1.00 0.00 C ATOM 1511 CG1 VAL B 70 9.110 0.610 -0.006 1.00 0.00 C ATOM 1512 CG2 VAL B 70 7.007 -0.727 0.242 1.00 0.00 C ATOM 0 H VAL B 70 5.076 1.899 0.204 1.00 0.00 H new ATOM 0 HA VAL B 70 7.448 1.519 1.916 1.00 0.00 H new ATOM 0 HB VAL B 70 7.286 0.929 -1.062 1.00 0.00 H new ATOM 0 HG11 VAL B 70 9.478 -0.143 -0.703 1.00 0.00 H new ATOM 0 HG12 VAL B 70 9.506 1.587 -0.284 1.00 0.00 H new ATOM 0 HG13 VAL B 70 9.436 0.360 1.004 1.00 0.00 H new ATOM 0 HG21 VAL B 70 7.413 -1.454 -0.462 1.00 0.00 H new ATOM 0 HG22 VAL B 70 7.268 -1.021 1.259 1.00 0.00 H new ATOM 0 HG23 VAL B 70 5.922 -0.692 0.141 1.00 0.00 H new ATOM 1522 N LEU B 71 8.329 3.741 1.190 1.00 0.00 N ATOM 1523 CA LEU B 71 8.805 5.069 0.822 1.00 0.00 C ATOM 1524 C LEU B 71 9.962 4.981 -0.167 1.00 0.00 C ATOM 1525 O LEU B 71 10.977 4.339 0.105 1.00 0.00 O ATOM 1526 CB LEU B 71 9.236 5.847 2.068 1.00 0.00 C ATOM 1527 CG LEU B 71 8.119 6.128 3.076 1.00 0.00 C ATOM 1528 CD1 LEU B 71 8.664 6.862 4.291 1.00 0.00 C ATOM 1529 CD2 LEU B 71 7.003 6.932 2.424 1.00 0.00 C ATOM 0 H LEU B 71 8.721 3.376 2.058 1.00 0.00 H new ATOM 0 HA LEU B 71 7.983 5.599 0.341 1.00 0.00 H new ATOM 0 HB2 LEU B 71 10.026 5.289 2.571 1.00 0.00 H new ATOM 0 HB3 LEU B 71 9.668 6.797 1.753 1.00 0.00 H new ATOM 0 HG LEU B 71 7.710 5.174 3.408 1.00 0.00 H new ATOM 0 HD11 LEU B 71 7.854 7.052 4.995 1.00 0.00 H new ATOM 0 HD12 LEU B 71 9.428 6.251 4.773 1.00 0.00 H new ATOM 0 HD13 LEU B 71 9.102 7.810 3.977 1.00 0.00 H new ATOM 0 HD21 LEU B 71 6.217 7.123 3.155 1.00 0.00 H new ATOM 0 HD22 LEU B 71 7.401 7.880 2.063 1.00 0.00 H new ATOM 0 HD23 LEU B 71 6.591 6.369 1.586 1.00 0.00 H new ATOM 1541 N ARG B 72 9.800 5.634 -1.313 1.00 0.00 N ATOM 1542 CA ARG B 72 10.831 5.637 -2.347 1.00 0.00 C ATOM 1543 C ARG B 72 12.149 6.185 -1.809 1.00 0.00 C ATOM 1544 O ARG B 72 12.166 7.147 -1.040 1.00 0.00 O ATOM 1545 CB ARG B 72 10.379 6.471 -3.547 1.00 0.00 C ATOM 1546 CG ARG B 72 9.148 5.920 -4.246 1.00 0.00 C ATOM 1547 CD ARG B 72 8.755 6.782 -5.435 1.00 0.00 C ATOM 1548 NE ARG B 72 9.837 6.898 -6.407 1.00 0.00 N ATOM 1549 CZ ARG B 72 9.757 7.625 -7.517 1.00 0.00 C ATOM 1550 NH1 ARG B 72 8.649 8.299 -7.796 1.00 0.00 N ATOM 1551 NH2 ARG B 72 10.788 7.681 -8.349 1.00 0.00 N ATOM 0 H ARG B 72 8.964 6.169 -1.550 1.00 0.00 H new ATOM 0 HA ARG B 72 10.988 4.606 -2.663 1.00 0.00 H new ATOM 0 HB2 ARG B 72 10.172 7.488 -3.214 1.00 0.00 H new ATOM 0 HB3 ARG B 72 11.197 6.531 -4.265 1.00 0.00 H new ATOM 0 HG2 ARG B 72 9.343 4.901 -4.581 1.00 0.00 H new ATOM 0 HG3 ARG B 72 8.319 5.870 -3.541 1.00 0.00 H new ATOM 0 HD2 ARG B 72 7.877 6.354 -5.919 1.00 0.00 H new ATOM 0 HD3 ARG B 72 8.474 7.775 -5.085 1.00 0.00 H new ATOM 0 HE ARG B 72 10.704 6.393 -6.224 1.00 0.00 H new ATOM 0 HH11 ARG B 72 7.854 8.261 -7.158 1.00 0.00 H new ATOM 0 HH12 ARG B 72 8.592 8.856 -8.649 1.00 0.00 H new ATOM 0 HH21 ARG B 72 11.643 7.166 -8.137 1.00 0.00 H new ATOM 0 HH22 ARG B 72 10.726 8.239 -9.201 1.00 0.00 H new ATOM 1565 N LEU B 73 13.253 5.569 -2.221 1.00 0.00 N ATOM 1566 CA LEU B 73 14.576 6.000 -1.783 1.00 0.00 C ATOM 1567 C LEU B 73 14.833 7.445 -2.197 1.00 0.00 C ATOM 1568 O LEU B 73 14.590 7.823 -3.344 1.00 0.00 O ATOM 1569 CB LEU B 73 15.655 5.089 -2.375 1.00 0.00 C ATOM 1570 CG LEU B 73 17.084 5.395 -1.921 1.00 0.00 C ATOM 1571 CD1 LEU B 73 17.230 5.174 -0.423 1.00 0.00 C ATOM 1572 CD2 LEU B 73 18.080 4.538 -2.689 1.00 0.00 C ATOM 0 H LEU B 73 13.258 4.771 -2.856 1.00 0.00 H new ATOM 0 HA LEU B 73 14.614 5.935 -0.696 1.00 0.00 H new ATOM 0 HB2 LEU B 73 15.421 4.057 -2.114 1.00 0.00 H new ATOM 0 HB3 LEU B 73 15.613 5.160 -3.462 1.00 0.00 H new ATOM 0 HG LEU B 73 17.296 6.443 -2.133 1.00 0.00 H new ATOM 0 HD11 LEU B 73 18.253 5.397 -0.120 1.00 0.00 H new ATOM 0 HD12 LEU B 73 16.543 5.831 0.110 1.00 0.00 H new ATOM 0 HD13 LEU B 73 16.999 4.136 -0.184 1.00 0.00 H new ATOM 0 HD21 LEU B 73 19.092 4.768 -2.354 1.00 0.00 H new ATOM 0 HD22 LEU B 73 17.869 3.484 -2.508 1.00 0.00 H new ATOM 0 HD23 LEU B 73 17.994 4.748 -3.755 1.00 0.00 H new ATOM 1584 N ARG B 74 15.324 8.248 -1.258 1.00 0.00 N ATOM 1585 CA ARG B 74 15.611 9.654 -1.526 1.00 0.00 C ATOM 1586 C ARG B 74 16.320 10.297 -0.339 1.00 0.00 C ATOM 1587 O ARG B 74 17.290 11.037 -0.509 1.00 0.00 O ATOM 1588 CB ARG B 74 14.317 10.413 -1.828 1.00 0.00 C ATOM 1589 CG ARG B 74 14.538 11.872 -2.194 1.00 0.00 C ATOM 1590 CD ARG B 74 13.221 12.594 -2.423 1.00 0.00 C ATOM 1591 NE ARG B 74 13.419 13.996 -2.783 1.00 0.00 N ATOM 1592 CZ ARG B 74 13.975 14.897 -1.978 1.00 0.00 C ATOM 1593 NH1 ARG B 74 14.367 14.555 -0.757 1.00 0.00 N ATOM 1594 NH2 ARG B 74 14.132 16.147 -2.392 1.00 0.00 N ATOM 0 H ARG B 74 15.532 7.950 -0.305 1.00 0.00 H new ATOM 0 HA ARG B 74 16.267 9.706 -2.395 1.00 0.00 H new ATOM 0 HB2 ARG B 74 13.797 9.916 -2.647 1.00 0.00 H new ATOM 0 HB3 ARG B 74 13.663 10.361 -0.957 1.00 0.00 H new ATOM 0 HG2 ARG B 74 15.092 12.368 -1.397 1.00 0.00 H new ATOM 0 HG3 ARG B 74 15.149 11.934 -3.094 1.00 0.00 H new ATOM 0 HD2 ARG B 74 12.665 12.092 -3.215 1.00 0.00 H new ATOM 0 HD3 ARG B 74 12.613 12.534 -1.520 1.00 0.00 H new ATOM 0 HE ARG B 74 13.113 14.302 -3.707 1.00 0.00 H new ATOM 0 HH11 ARG B 74 14.243 13.596 -0.431 1.00 0.00 H new ATOM 0 HH12 ARG B 74 14.793 15.251 -0.144 1.00 0.00 H new ATOM 0 HH21 ARG B 74 13.826 16.417 -3.327 1.00 0.00 H new ATOM 0 HH22 ARG B 74 14.558 16.839 -1.775 1.00 0.00 H new ATOM 1608 N GLY B 75 15.823 10.012 0.862 1.00 0.00 N ATOM 1609 CA GLY B 75 16.413 10.568 2.066 1.00 0.00 C ATOM 1610 C GLY B 75 17.807 10.036 2.336 1.00 0.00 C ATOM 1611 O GLY B 75 18.648 9.990 1.438 1.00 0.00 O ATOM 0 H GLY B 75 15.020 9.404 1.022 1.00 0.00 H new ATOM 0 HA2 GLY B 75 16.454 11.654 1.977 1.00 0.00 H new ATOM 0 HA3 GLY B 75 15.771 10.342 2.918 1.00 0.00 H new ATOM 1615 N GLY B 76 18.052 9.636 3.580 1.00 0.00 N ATOM 1616 CA GLY B 76 19.354 9.111 3.952 1.00 0.00 C ATOM 1617 C GLY B 76 19.652 7.770 3.308 1.00 0.00 C ATOM 1618 O GLY B 76 20.399 6.975 3.915 1.00 0.00 O ATOM 1619 OXT GLY B 76 19.138 7.514 2.199 1.00 0.00 O ATOM 0 H GLY B 76 17.371 9.666 4.339 1.00 0.00 H new ATOM 0 HA2 GLY B 76 20.125 9.826 3.665 1.00 0.00 H new ATOM 0 HA3 GLY B 76 19.403 9.007 5.036 1.00 0.00 H new TER 1623 GLY B 76