USER MOD reduce.3.24.130724 H: found=0, std=0, add=826, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 828 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 21 ASN : amide:sc= -1.93 K(o=-7.1,f=-4.3) USER MOD Set 1.2: B 52 ASN : amide:sc= -5.17! C(o=-7.1!,f=-12!) USER MOD Set 2.1: B 26 GLN : amide:sc= -8.63! K(o=-15!,f=-1.5) USER MOD Set 2.2: B 55 GLN : amide:sc= -5.9! K(o=-15!,f=-1.5) USER MOD Set 3.1: A 28 LYS NZ :NH3+ -122:sc= 1.19 (180deg=0.151) USER MOD Set 3.2: B 24 SER OG : rot -116:sc= 2.08 USER MOD Set 4.1: A 21 ASN : amide:sc= -1.48 X(o=-10,f=-9.9) USER MOD Set 4.2: A 52 ASN : amide:sc= -8.48! C(o=-10!,f=-18!) USER MOD Set 5.1: A 26 GLN : amide:sc= -6.52! K(o=-15!,f=-2.9) USER MOD Set 5.2: A 55 GLN : amide:sc= -8.83! C(o=-15!,f=-2.9!) USER MOD Set 6.1: A 13 THR OG1 : rot -147:sc= -1.9 USER MOD Set 6.2: B 17 MET CE :methyl -132:sc= -12.7! (180deg=-13.1!) USER MOD Single : A 4 LYS NZ :NH3+ -147:sc= 0.734 (180deg=0.317) USER MOD Single : A 6 ASN : amide:sc= -3.44! C(o=-3.4!,f=-12!) USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 ASN : amide:sc= -4.55 K(o=-4.5,f=-2.9) USER MOD Single : A 23 ASN : amide:sc= -0.868 K(o=-0.87,f=-10!) USER MOD Single : A 33 SER OG : rot 75:sc= 0.742 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 40 GLN : amide:sc= -0.57 K(o=-0.57,f=0) USER MOD Single : A 41 SER OG : rot -92:sc= 0.683 USER MOD Single : A 43 ASN : amide:sc= -0.127 K(o=-0.13,f=-1) USER MOD Single : A 49 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.0275) USER MOD Single : A 50 LYS NZ :NH3+ -166:sc= 0.655 (180deg=0.341) USER MOD Single : B 6 ASN : amide:sc= -1.53 K(o=-1.5,f=-0.034) USER MOD Single : B 7 LYS NZ :NH3+ -144:sc= -0.742 (180deg=-2.82!) USER MOD Single : B 23 ASN : amide:sc= -2.99! C(o=-3!,f=-16!) USER MOD Single : B 32 ASN : amide:sc= -0.0109 K(o=-0.011,f=-1.4) USER MOD Single : B 33 SER OG : rot 87:sc= 0.201 USER MOD Single : B 39 SER OG : rot 180:sc= 0 USER MOD Single : B 40 GLN : amide:sc= -1.07 K(o=-1.1,f=-0.057) USER MOD Single : B 41 SER OG : rot -57:sc= -2.01! USER MOD Single : B 43 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 49 LYS NZ :NH3+ 156:sc= -2.27 (180deg=-3.3!) USER MOD Single : B 50 LYS NZ :NH3+ 168:sc= 0.902 (180deg=0.558) USER MOD ----------------------------------------------------------------- ATOM 45 N LYS A 4 5.907 -10.903 6.744 1.00 0.00 N ATOM 46 CA LYS A 4 5.306 -10.000 7.723 1.00 0.00 C ATOM 47 C LYS A 4 5.601 -8.538 7.380 1.00 0.00 C ATOM 48 O LYS A 4 4.701 -7.702 7.414 1.00 0.00 O ATOM 49 CB LYS A 4 5.836 -10.324 9.120 1.00 0.00 C ATOM 50 CG LYS A 4 4.997 -9.585 10.166 1.00 0.00 C ATOM 51 CD LYS A 4 5.533 -9.892 11.566 1.00 0.00 C ATOM 52 CE LYS A 4 6.712 -8.965 11.877 1.00 0.00 C ATOM 53 NZ LYS A 4 6.198 -7.613 12.241 1.00 0.00 N ATOM 0 HA LYS A 4 4.226 -10.142 7.701 1.00 0.00 H new ATOM 0 HB2 LYS A 4 5.794 -11.399 9.297 1.00 0.00 H new ATOM 0 HB3 LYS A 4 6.882 -10.029 9.202 1.00 0.00 H new ATOM 0 HG2 LYS A 4 5.030 -8.511 9.981 1.00 0.00 H new ATOM 0 HG3 LYS A 4 3.953 -9.890 10.091 1.00 0.00 H new ATOM 0 HD2 LYS A 4 4.745 -9.756 12.306 1.00 0.00 H new ATOM 0 HD3 LYS A 4 5.850 -10.933 11.625 1.00 0.00 H new ATOM 0 HE2 LYS A 4 7.304 -9.374 12.696 1.00 0.00 H new ATOM 0 HE3 LYS A 4 7.371 -8.895 11.012 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 6.870 -6.888 11.919 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 5.276 -7.458 11.785 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 6.089 -7.549 13.273 1.00 0.00 H new ATOM 67 N PHE A 5 6.860 -8.239 7.048 1.00 0.00 N ATOM 68 CA PHE A 5 7.245 -6.877 6.701 1.00 0.00 C ATOM 69 C PHE A 5 6.462 -6.408 5.476 1.00 0.00 C ATOM 70 O PHE A 5 6.009 -5.271 5.429 1.00 0.00 O ATOM 71 CB PHE A 5 8.765 -6.782 6.458 1.00 0.00 C ATOM 72 CG PHE A 5 9.113 -7.142 5.025 1.00 0.00 C ATOM 73 CD1 PHE A 5 9.217 -8.487 4.643 1.00 0.00 C ATOM 74 CD2 PHE A 5 9.330 -6.127 4.079 1.00 0.00 C ATOM 75 CE1 PHE A 5 9.537 -8.816 3.321 1.00 0.00 C ATOM 76 CE2 PHE A 5 9.651 -6.460 2.759 1.00 0.00 C ATOM 77 CZ PHE A 5 9.755 -7.804 2.380 1.00 0.00 C ATOM 0 H PHE A 5 7.621 -8.918 7.014 1.00 0.00 H new ATOM 0 HA PHE A 5 7.003 -6.221 7.537 1.00 0.00 H new ATOM 0 HB2 PHE A 5 9.109 -5.771 6.676 1.00 0.00 H new ATOM 0 HB3 PHE A 5 9.288 -7.451 7.142 1.00 0.00 H new ATOM 0 HD1 PHE A 5 9.050 -9.269 5.369 1.00 0.00 H new ATOM 0 HD2 PHE A 5 9.249 -5.090 4.370 1.00 0.00 H new ATOM 0 HE1 PHE A 5 9.616 -9.852 3.027 1.00 0.00 H new ATOM 0 HE2 PHE A 5 9.819 -5.680 2.031 1.00 0.00 H new ATOM 0 HZ PHE A 5 10.004 -8.060 1.361 1.00 0.00 H new ATOM 87 N ASN A 6 6.292 -7.310 4.499 1.00 0.00 N ATOM 88 CA ASN A 6 5.537 -6.996 3.295 1.00 0.00 C ATOM 89 C ASN A 6 4.091 -6.730 3.660 1.00 0.00 C ATOM 90 O ASN A 6 3.477 -5.781 3.180 1.00 0.00 O ATOM 91 CB ASN A 6 5.587 -8.178 2.336 1.00 0.00 C ATOM 92 CG ASN A 6 4.910 -7.842 1.015 1.00 0.00 C ATOM 93 OD1 ASN A 6 4.828 -6.680 0.641 1.00 0.00 O ATOM 94 ND2 ASN A 6 4.402 -8.803 0.297 1.00 0.00 N ATOM 0 H ASN A 6 6.669 -8.257 4.526 1.00 0.00 H new ATOM 0 HA ASN A 6 5.972 -6.115 2.822 1.00 0.00 H new ATOM 0 HB2 ASN A 6 6.624 -8.460 2.155 1.00 0.00 H new ATOM 0 HB3 ASN A 6 5.097 -9.039 2.790 1.00 0.00 H new ATOM 0 HD21 ASN A 6 3.932 -8.589 -0.583 1.00 0.00 H new ATOM 0 HD22 ASN A 6 4.474 -9.770 0.615 1.00 0.00 H new ATOM 101 N LYS A 7 3.566 -7.581 4.538 1.00 0.00 N ATOM 102 CA LYS A 7 2.204 -7.447 4.996 1.00 0.00 C ATOM 103 C LYS A 7 2.067 -6.109 5.686 1.00 0.00 C ATOM 104 O LYS A 7 1.104 -5.395 5.476 1.00 0.00 O ATOM 105 CB LYS A 7 1.865 -8.596 5.956 1.00 0.00 C ATOM 106 CG LYS A 7 0.357 -8.644 6.224 1.00 0.00 C ATOM 107 CD LYS A 7 0.002 -9.944 6.961 1.00 0.00 C ATOM 108 CE LYS A 7 -0.416 -11.006 5.942 1.00 0.00 C ATOM 109 NZ LYS A 7 -0.685 -12.293 6.643 1.00 0.00 N ATOM 0 H LYS A 7 4.072 -8.369 4.942 1.00 0.00 H new ATOM 0 HA LYS A 7 1.510 -7.495 4.157 1.00 0.00 H new ATOM 0 HB2 LYS A 7 2.195 -9.543 5.530 1.00 0.00 H new ATOM 0 HB3 LYS A 7 2.403 -8.464 6.895 1.00 0.00 H new ATOM 0 HG2 LYS A 7 0.057 -7.783 6.821 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -0.191 -8.587 5.284 1.00 0.00 H new ATOM 0 HD2 LYS A 7 0.858 -10.294 7.537 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -0.807 -9.765 7.669 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -1.307 -10.679 5.406 1.00 0.00 H new ATOM 0 HE3 LYS A 7 0.371 -11.142 5.200 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -0.969 -13.014 5.949 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 0.176 -12.607 7.135 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -1.450 -12.158 7.335 1.00 0.00 H new ATOM 123 N GLU A 8 3.073 -5.762 6.483 1.00 0.00 N ATOM 124 CA GLU A 8 3.066 -4.485 7.181 1.00 0.00 C ATOM 125 C GLU A 8 3.293 -3.334 6.207 1.00 0.00 C ATOM 126 O GLU A 8 2.682 -2.282 6.328 1.00 0.00 O ATOM 127 CB GLU A 8 4.121 -4.470 8.293 1.00 0.00 C ATOM 128 CG GLU A 8 3.459 -4.738 9.658 1.00 0.00 C ATOM 129 CD GLU A 8 3.255 -6.238 9.891 1.00 0.00 C ATOM 130 OE1 GLU A 8 2.597 -6.869 9.078 1.00 0.00 O ATOM 131 OE2 GLU A 8 3.750 -6.731 10.891 1.00 0.00 O ATOM 0 H GLU A 8 3.894 -6.341 6.659 1.00 0.00 H new ATOM 0 HA GLU A 8 2.085 -4.354 7.639 1.00 0.00 H new ATOM 0 HB2 GLU A 8 4.880 -5.226 8.094 1.00 0.00 H new ATOM 0 HB3 GLU A 8 4.629 -3.506 8.310 1.00 0.00 H new ATOM 0 HG2 GLU A 8 4.080 -4.325 10.453 1.00 0.00 H new ATOM 0 HG3 GLU A 8 2.498 -4.226 9.706 1.00 0.00 H new ATOM 138 N LEU A 9 4.146 -3.571 5.222 1.00 0.00 N ATOM 139 CA LEU A 9 4.427 -2.583 4.177 1.00 0.00 C ATOM 140 C LEU A 9 3.127 -2.279 3.455 1.00 0.00 C ATOM 141 O LEU A 9 2.804 -1.123 3.186 1.00 0.00 O ATOM 142 CB LEU A 9 5.485 -3.160 3.223 1.00 0.00 C ATOM 143 CG LEU A 9 5.689 -2.254 2.001 1.00 0.00 C ATOM 144 CD1 LEU A 9 6.532 -1.023 2.333 1.00 0.00 C ATOM 145 CD2 LEU A 9 6.405 -3.040 0.921 1.00 0.00 C ATOM 0 H LEU A 9 4.662 -4.445 5.119 1.00 0.00 H new ATOM 0 HA LEU A 9 4.820 -1.656 4.595 1.00 0.00 H new ATOM 0 HB2 LEU A 9 6.430 -3.277 3.753 1.00 0.00 H new ATOM 0 HB3 LEU A 9 5.178 -4.153 2.895 1.00 0.00 H new ATOM 0 HG LEU A 9 4.706 -1.919 1.669 1.00 0.00 H new ATOM 0 HD11 LEU A 9 6.650 -0.411 1.439 1.00 0.00 H new ATOM 0 HD12 LEU A 9 6.035 -0.440 3.109 1.00 0.00 H new ATOM 0 HD13 LEU A 9 7.513 -1.339 2.689 1.00 0.00 H new ATOM 0 HD21 LEU A 9 6.555 -2.405 0.048 1.00 0.00 H new ATOM 0 HD22 LEU A 9 7.372 -3.376 1.296 1.00 0.00 H new ATOM 0 HD23 LEU A 9 5.804 -3.905 0.642 1.00 0.00 H new ATOM 157 N GLY A 10 2.354 -3.323 3.193 1.00 0.00 N ATOM 158 CA GLY A 10 1.079 -3.158 2.564 1.00 0.00 C ATOM 159 C GLY A 10 0.086 -2.616 3.560 1.00 0.00 C ATOM 160 O GLY A 10 -0.717 -1.742 3.254 1.00 0.00 O ATOM 0 H GLY A 10 2.600 -4.289 3.412 1.00 0.00 H new ATOM 0 HA2 GLY A 10 1.166 -2.478 1.717 1.00 0.00 H new ATOM 0 HA3 GLY A 10 0.730 -4.113 2.172 1.00 0.00 H new ATOM 164 N TRP A 11 0.117 -3.163 4.763 1.00 0.00 N ATOM 165 CA TRP A 11 -0.829 -2.734 5.754 1.00 0.00 C ATOM 166 C TRP A 11 -0.659 -1.293 6.121 1.00 0.00 C ATOM 167 O TRP A 11 -1.631 -0.540 6.137 1.00 0.00 O ATOM 168 CB TRP A 11 -0.812 -3.595 7.001 1.00 0.00 C ATOM 169 CG TRP A 11 -2.218 -3.649 7.529 1.00 0.00 C ATOM 170 CD1 TRP A 11 -2.533 -3.664 8.831 1.00 0.00 C ATOM 171 CD2 TRP A 11 -3.506 -3.658 6.795 1.00 0.00 C ATOM 172 NE1 TRP A 11 -3.907 -3.720 8.956 1.00 0.00 N ATOM 173 CE2 TRP A 11 -4.546 -3.701 7.739 1.00 0.00 C ATOM 174 CE3 TRP A 11 -3.875 -3.641 5.422 1.00 0.00 C ATOM 175 CZ2 TRP A 11 -5.885 -3.721 7.355 1.00 0.00 C ATOM 176 CZ3 TRP A 11 -5.212 -3.658 5.034 1.00 0.00 C ATOM 177 CH2 TRP A 11 -6.223 -3.694 5.999 1.00 0.00 C ATOM 0 H TRP A 11 0.772 -3.885 5.063 1.00 0.00 H new ATOM 0 HA TRP A 11 -1.805 -2.853 5.284 1.00 0.00 H new ATOM 0 HB2 TRP A 11 -0.450 -4.597 6.771 1.00 0.00 H new ATOM 0 HB3 TRP A 11 -0.137 -3.176 7.748 1.00 0.00 H new ATOM 0 HD1 TRP A 11 -1.828 -3.637 9.649 1.00 0.00 H new ATOM 0 HE1 TRP A 11 -4.393 -3.770 9.851 1.00 0.00 H new ATOM 0 HE3 TRP A 11 -3.104 -3.614 4.666 1.00 0.00 H new ATOM 0 HZ2 TRP A 11 -6.662 -3.757 8.105 1.00 0.00 H new ATOM 0 HZ3 TRP A 11 -5.469 -3.643 3.985 1.00 0.00 H new ATOM 0 HH2 TRP A 11 -7.260 -3.701 5.698 1.00 0.00 H new ATOM 188 N ALA A 12 0.563 -0.900 6.400 1.00 0.00 N ATOM 189 CA ALA A 12 0.812 0.468 6.743 1.00 0.00 C ATOM 190 C ALA A 12 0.370 1.342 5.576 1.00 0.00 C ATOM 191 O ALA A 12 -0.262 2.371 5.771 1.00 0.00 O ATOM 192 CB ALA A 12 2.290 0.672 7.053 1.00 0.00 C ATOM 0 H ALA A 12 1.385 -1.504 6.395 1.00 0.00 H new ATOM 0 HA ALA A 12 0.249 0.743 7.635 1.00 0.00 H new ATOM 0 HB1 ALA A 12 2.467 1.716 7.312 1.00 0.00 H new ATOM 0 HB2 ALA A 12 2.577 0.036 7.891 1.00 0.00 H new ATOM 0 HB3 ALA A 12 2.885 0.410 6.178 1.00 0.00 H new ATOM 198 N THR A 13 0.646 0.872 4.351 1.00 0.00 N ATOM 199 CA THR A 13 0.220 1.580 3.151 1.00 0.00 C ATOM 200 C THR A 13 -1.282 1.791 3.202 1.00 0.00 C ATOM 201 O THR A 13 -1.762 2.889 2.950 1.00 0.00 O ATOM 202 CB THR A 13 0.600 0.739 1.921 1.00 0.00 C ATOM 203 OG1 THR A 13 1.834 1.206 1.422 1.00 0.00 O ATOM 204 CG2 THR A 13 -0.463 0.842 0.821 1.00 0.00 C ATOM 0 H THR A 13 1.160 0.009 4.173 1.00 0.00 H new ATOM 0 HA THR A 13 0.710 2.552 3.089 1.00 0.00 H new ATOM 0 HB THR A 13 0.673 -0.306 2.221 1.00 0.00 H new ATOM 0 HG1 THR A 13 1.849 1.111 0.447 1.00 0.00 H new ATOM 0 HG21 THR A 13 -0.162 0.236 -0.033 1.00 0.00 H new ATOM 0 HG22 THR A 13 -1.418 0.482 1.203 1.00 0.00 H new ATOM 0 HG23 THR A 13 -0.565 1.882 0.510 1.00 0.00 H new ATOM 212 N TRP A 14 -1.997 0.721 3.529 1.00 0.00 N ATOM 213 CA TRP A 14 -3.451 0.748 3.607 1.00 0.00 C ATOM 214 C TRP A 14 -3.960 1.639 4.724 1.00 0.00 C ATOM 215 O TRP A 14 -4.880 2.420 4.522 1.00 0.00 O ATOM 216 CB TRP A 14 -3.940 -0.661 3.868 1.00 0.00 C ATOM 217 CG TRP A 14 -5.388 -0.768 3.546 1.00 0.00 C ATOM 218 CD1 TRP A 14 -6.387 -0.813 4.456 1.00 0.00 C ATOM 219 CD2 TRP A 14 -6.014 -0.853 2.240 1.00 0.00 C ATOM 220 NE1 TRP A 14 -7.585 -0.953 3.791 1.00 0.00 N ATOM 221 CE2 TRP A 14 -7.407 -0.982 2.426 1.00 0.00 C ATOM 222 CE3 TRP A 14 -5.519 -0.844 0.918 1.00 0.00 C ATOM 223 CZ2 TRP A 14 -8.267 -1.104 1.350 1.00 0.00 C ATOM 224 CZ3 TRP A 14 -6.385 -0.966 -0.151 1.00 0.00 C ATOM 225 CH2 TRP A 14 -7.745 -1.099 0.062 1.00 0.00 C ATOM 0 H TRP A 14 -1.586 -0.187 3.747 1.00 0.00 H new ATOM 0 HA TRP A 14 -3.826 1.147 2.664 1.00 0.00 H new ATOM 0 HB2 TRP A 14 -3.372 -1.369 3.264 1.00 0.00 H new ATOM 0 HB3 TRP A 14 -3.771 -0.925 4.912 1.00 0.00 H new ATOM 0 HD1 TRP A 14 -6.266 -0.750 5.527 1.00 0.00 H new ATOM 0 HE1 TRP A 14 -8.492 -1.026 4.253 1.00 0.00 H new ATOM 0 HE3 TRP A 14 -4.458 -0.741 0.742 1.00 0.00 H new ATOM 0 HZ2 TRP A 14 -9.331 -1.202 1.509 1.00 0.00 H new ATOM 0 HZ3 TRP A 14 -5.998 -0.957 -1.159 1.00 0.00 H new ATOM 0 HH2 TRP A 14 -8.410 -1.200 -0.783 1.00 0.00 H new ATOM 236 N GLU A 15 -3.372 1.505 5.903 1.00 0.00 N ATOM 237 CA GLU A 15 -3.802 2.301 7.042 1.00 0.00 C ATOM 238 C GLU A 15 -3.586 3.783 6.738 1.00 0.00 C ATOM 239 O GLU A 15 -4.426 4.620 7.068 1.00 0.00 O ATOM 240 CB GLU A 15 -3.052 1.844 8.299 1.00 0.00 C ATOM 241 CG GLU A 15 -3.482 0.401 8.664 1.00 0.00 C ATOM 242 CD GLU A 15 -4.999 0.311 8.853 1.00 0.00 C ATOM 243 OE1 GLU A 15 -5.528 1.062 9.659 1.00 0.00 O ATOM 244 OE2 GLU A 15 -5.610 -0.513 8.188 1.00 0.00 O ATOM 0 H GLU A 15 -2.605 0.861 6.095 1.00 0.00 H new ATOM 0 HA GLU A 15 -4.866 2.158 7.228 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -1.976 1.881 8.127 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -3.266 2.519 9.128 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -3.169 -0.285 7.877 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -2.979 0.088 9.579 1.00 0.00 H new ATOM 251 N ILE A 16 -2.490 4.081 6.036 1.00 0.00 N ATOM 252 CA ILE A 16 -2.196 5.451 5.603 1.00 0.00 C ATOM 253 C ILE A 16 -3.210 5.833 4.511 1.00 0.00 C ATOM 254 O ILE A 16 -3.684 6.967 4.440 1.00 0.00 O ATOM 255 CB ILE A 16 -0.754 5.511 5.037 1.00 0.00 C ATOM 256 CG1 ILE A 16 0.266 5.172 6.138 1.00 0.00 C ATOM 257 CG2 ILE A 16 -0.434 6.910 4.489 1.00 0.00 C ATOM 258 CD1 ILE A 16 1.650 4.915 5.519 1.00 0.00 C ATOM 0 H ILE A 16 -1.791 3.393 5.755 1.00 0.00 H new ATOM 0 HA ILE A 16 -2.272 6.145 6.440 1.00 0.00 H new ATOM 0 HB ILE A 16 -0.688 4.783 4.228 1.00 0.00 H new ATOM 0 HG12 ILE A 16 0.326 5.992 6.853 1.00 0.00 H new ATOM 0 HG13 ILE A 16 -0.063 4.291 6.690 1.00 0.00 H new ATOM 0 HG21 ILE A 16 0.584 6.924 4.098 1.00 0.00 H new ATOM 0 HG22 ILE A 16 -1.133 7.156 3.690 1.00 0.00 H new ATOM 0 HG23 ILE A 16 -0.525 7.644 5.290 1.00 0.00 H new ATOM 0 HD11 ILE A 16 2.363 4.676 6.308 1.00 0.00 H new ATOM 0 HD12 ILE A 16 1.587 4.080 4.822 1.00 0.00 H new ATOM 0 HD13 ILE A 16 1.982 5.807 4.988 1.00 0.00 H new ATOM 270 N PHE A 17 -3.535 4.837 3.678 1.00 0.00 N ATOM 271 CA PHE A 17 -4.498 4.977 2.576 1.00 0.00 C ATOM 272 C PHE A 17 -5.899 5.261 3.130 1.00 0.00 C ATOM 273 O PHE A 17 -6.675 6.016 2.543 1.00 0.00 O ATOM 274 CB PHE A 17 -4.534 3.644 1.806 1.00 0.00 C ATOM 275 CG PHE A 17 -4.742 3.827 0.319 1.00 0.00 C ATOM 276 CD1 PHE A 17 -3.649 4.093 -0.522 1.00 0.00 C ATOM 277 CD2 PHE A 17 -6.018 3.660 -0.226 1.00 0.00 C ATOM 278 CE1 PHE A 17 -3.837 4.200 -1.902 1.00 0.00 C ATOM 279 CE2 PHE A 17 -6.207 3.756 -1.605 1.00 0.00 C ATOM 280 CZ PHE A 17 -5.118 4.026 -2.443 1.00 0.00 C ATOM 0 H PHE A 17 -3.134 3.902 3.750 1.00 0.00 H new ATOM 0 HA PHE A 17 -4.198 5.800 1.928 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -3.600 3.108 1.974 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -5.334 3.021 2.206 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -2.662 4.215 -0.101 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -6.859 3.456 0.421 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -2.999 4.416 -2.549 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -7.193 3.622 -2.026 1.00 0.00 H new ATOM 0 HZ PHE A 17 -5.266 4.100 -3.510 1.00 0.00 H new ATOM 290 N ASN A 18 -6.210 4.599 4.248 1.00 0.00 N ATOM 291 CA ASN A 18 -7.516 4.709 4.897 1.00 0.00 C ATOM 292 C ASN A 18 -7.564 5.811 5.961 1.00 0.00 C ATOM 293 O ASN A 18 -8.575 5.937 6.659 1.00 0.00 O ATOM 294 CB ASN A 18 -7.870 3.363 5.556 1.00 0.00 C ATOM 295 CG ASN A 18 -8.155 2.294 4.500 1.00 0.00 C ATOM 296 OD1 ASN A 18 -9.216 1.671 4.519 1.00 0.00 O ATOM 297 ND2 ASN A 18 -7.271 2.038 3.579 1.00 0.00 N ATOM 0 H ASN A 18 -5.563 3.973 4.727 1.00 0.00 H new ATOM 0 HA ASN A 18 -8.237 4.972 4.123 1.00 0.00 H new ATOM 0 HB2 ASN A 18 -7.048 3.039 6.194 1.00 0.00 H new ATOM 0 HB3 ASN A 18 -8.742 3.487 6.198 1.00 0.00 H new ATOM 0 HD21 ASN A 18 -7.459 1.323 2.876 1.00 0.00 H new ATOM 0 HD22 ASN A 18 -6.390 2.552 3.560 1.00 0.00 H new ATOM 304 N LEU A 19 -6.501 6.615 6.100 1.00 0.00 N ATOM 305 CA LEU A 19 -6.522 7.673 7.107 1.00 0.00 C ATOM 306 C LEU A 19 -7.518 8.757 6.689 1.00 0.00 C ATOM 307 O LEU A 19 -7.541 9.158 5.523 1.00 0.00 O ATOM 308 CB LEU A 19 -5.131 8.273 7.319 1.00 0.00 C ATOM 309 CG LEU A 19 -4.455 7.606 8.532 1.00 0.00 C ATOM 310 CD1 LEU A 19 -3.074 8.185 8.699 1.00 0.00 C ATOM 311 CD2 LEU A 19 -5.238 7.878 9.817 1.00 0.00 C ATOM 0 H LEU A 19 -5.646 6.555 5.547 1.00 0.00 H new ATOM 0 HA LEU A 19 -6.836 7.239 8.056 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -4.522 8.128 6.426 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -5.209 9.348 7.480 1.00 0.00 H new ATOM 0 HG LEU A 19 -4.418 6.531 8.355 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -2.586 7.720 9.555 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -2.488 7.994 7.800 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -3.148 9.260 8.863 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -4.738 7.395 10.657 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -5.287 8.953 9.993 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -6.248 7.480 9.719 1.00 0.00 H new ATOM 323 N PRO A 20 -8.367 9.203 7.591 1.00 0.00 N ATOM 324 CA PRO A 20 -9.418 10.216 7.284 1.00 0.00 C ATOM 325 C PRO A 20 -8.949 11.676 7.190 1.00 0.00 C ATOM 326 O PRO A 20 -9.808 12.562 7.159 1.00 0.00 O ATOM 327 CB PRO A 20 -10.427 10.053 8.442 1.00 0.00 C ATOM 328 CG PRO A 20 -9.920 8.956 9.317 1.00 0.00 C ATOM 329 CD PRO A 20 -8.445 8.811 9.006 1.00 0.00 C ATOM 0 HA PRO A 20 -9.816 10.031 6.286 1.00 0.00 H new ATOM 0 HB2 PRO A 20 -10.520 10.982 9.005 1.00 0.00 H new ATOM 0 HB3 PRO A 20 -11.418 9.812 8.058 1.00 0.00 H new ATOM 0 HG2 PRO A 20 -10.074 9.196 10.369 1.00 0.00 H new ATOM 0 HG3 PRO A 20 -10.452 8.025 9.121 1.00 0.00 H new ATOM 0 HD2 PRO A 20 -7.834 9.455 9.638 1.00 0.00 H new ATOM 0 HD3 PRO A 20 -8.098 7.790 9.162 1.00 0.00 H new ATOM 337 N ASN A 21 -7.632 11.968 7.146 1.00 0.00 N ATOM 338 CA ASN A 21 -7.234 13.396 7.064 1.00 0.00 C ATOM 339 C ASN A 21 -5.999 13.646 6.199 1.00 0.00 C ATOM 340 O ASN A 21 -5.612 14.801 6.002 1.00 0.00 O ATOM 341 CB ASN A 21 -6.999 13.980 8.465 1.00 0.00 C ATOM 342 CG ASN A 21 -8.280 13.933 9.296 1.00 0.00 C ATOM 343 OD1 ASN A 21 -9.263 14.596 8.964 1.00 0.00 O ATOM 344 ND2 ASN A 21 -8.326 13.192 10.368 1.00 0.00 N ATOM 0 H ASN A 21 -6.870 11.290 7.164 1.00 0.00 H new ATOM 0 HA ASN A 21 -8.070 13.900 6.580 1.00 0.00 H new ATOM 0 HB2 ASN A 21 -6.212 13.420 8.970 1.00 0.00 H new ATOM 0 HB3 ASN A 21 -6.653 15.010 8.381 1.00 0.00 H new ATOM 0 HD21 ASN A 21 -9.176 13.162 10.931 1.00 0.00 H new ATOM 0 HD22 ASN A 21 -7.512 12.643 10.643 1.00 0.00 H new ATOM 351 N LEU A 22 -5.389 12.591 5.675 1.00 0.00 N ATOM 352 CA LEU A 22 -4.207 12.763 4.825 1.00 0.00 C ATOM 353 C LEU A 22 -4.612 13.124 3.408 1.00 0.00 C ATOM 354 O LEU A 22 -5.660 12.687 2.926 1.00 0.00 O ATOM 355 CB LEU A 22 -3.382 11.482 4.806 1.00 0.00 C ATOM 356 CG LEU A 22 -2.961 11.128 6.230 1.00 0.00 C ATOM 357 CD1 LEU A 22 -2.180 9.830 6.222 1.00 0.00 C ATOM 358 CD2 LEU A 22 -2.070 12.222 6.807 1.00 0.00 C ATOM 0 H LEU A 22 -5.681 11.624 5.816 1.00 0.00 H new ATOM 0 HA LEU A 22 -3.608 13.574 5.238 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -3.964 10.668 4.374 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -2.502 11.613 4.177 1.00 0.00 H new ATOM 0 HG LEU A 22 -3.859 11.027 6.840 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -1.880 9.579 7.240 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -2.805 9.032 5.821 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -1.292 9.943 5.600 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -1.778 11.955 7.823 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -1.178 12.329 6.189 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -2.616 13.165 6.822 1.00 0.00 H new ATOM 370 N ASN A 23 -3.765 13.908 2.733 1.00 0.00 N ATOM 371 CA ASN A 23 -4.049 14.296 1.357 1.00 0.00 C ATOM 372 C ASN A 23 -3.331 13.344 0.412 1.00 0.00 C ATOM 373 O ASN A 23 -2.445 12.593 0.831 1.00 0.00 O ATOM 374 CB ASN A 23 -3.644 15.762 1.097 1.00 0.00 C ATOM 375 CG ASN A 23 -2.126 15.943 1.073 1.00 0.00 C ATOM 376 OD1 ASN A 23 -1.398 15.215 1.734 1.00 0.00 O ATOM 377 ND2 ASN A 23 -1.609 16.890 0.341 1.00 0.00 N ATOM 0 H ASN A 23 -2.894 14.278 3.113 1.00 0.00 H new ATOM 0 HA ASN A 23 -5.122 14.229 1.179 1.00 0.00 H new ATOM 0 HB2 ASN A 23 -4.063 16.090 0.146 1.00 0.00 H new ATOM 0 HB3 ASN A 23 -4.073 16.399 1.871 1.00 0.00 H new ATOM 0 HD21 ASN A 23 -0.598 17.024 0.320 1.00 0.00 H new ATOM 0 HD22 ASN A 23 -2.216 17.497 -0.210 1.00 0.00 H new ATOM 384 N GLY A 24 -3.736 13.360 -0.853 1.00 0.00 N ATOM 385 CA GLY A 24 -3.150 12.474 -1.854 1.00 0.00 C ATOM 386 C GLY A 24 -1.625 12.480 -1.810 1.00 0.00 C ATOM 387 O GLY A 24 -0.999 11.457 -2.060 1.00 0.00 O ATOM 0 H GLY A 24 -4.467 13.976 -1.210 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -3.512 11.458 -1.694 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -3.484 12.779 -2.846 1.00 0.00 H new ATOM 391 N VAL A 25 -1.034 13.634 -1.494 1.00 0.00 N ATOM 392 CA VAL A 25 0.423 13.750 -1.440 1.00 0.00 C ATOM 393 C VAL A 25 1.016 13.090 -0.199 1.00 0.00 C ATOM 394 O VAL A 25 1.967 12.322 -0.319 1.00 0.00 O ATOM 395 CB VAL A 25 0.829 15.222 -1.505 1.00 0.00 C ATOM 396 CG1 VAL A 25 2.352 15.347 -1.357 1.00 0.00 C ATOM 397 CG2 VAL A 25 0.404 15.781 -2.866 1.00 0.00 C ATOM 0 H VAL A 25 -1.537 14.494 -1.274 1.00 0.00 H new ATOM 0 HA VAL A 25 0.825 13.219 -2.303 1.00 0.00 H new ATOM 0 HB VAL A 25 0.347 15.777 -0.700 1.00 0.00 H new ATOM 0 HG11 VAL A 25 2.637 16.398 -1.404 1.00 0.00 H new ATOM 0 HG12 VAL A 25 2.660 14.930 -0.398 1.00 0.00 H new ATOM 0 HG13 VAL A 25 2.842 14.802 -2.164 1.00 0.00 H new ATOM 0 HG21 VAL A 25 0.686 16.832 -2.932 1.00 0.00 H new ATOM 0 HG22 VAL A 25 0.900 15.222 -3.660 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -0.676 15.687 -2.977 1.00 0.00 H new ATOM 407 N GLN A 26 0.478 13.388 0.990 1.00 0.00 N ATOM 408 CA GLN A 26 1.017 12.792 2.204 1.00 0.00 C ATOM 409 C GLN A 26 0.899 11.280 2.157 1.00 0.00 C ATOM 410 O GLN A 26 1.856 10.575 2.467 1.00 0.00 O ATOM 411 CB GLN A 26 0.320 13.352 3.441 1.00 0.00 C ATOM 412 CG GLN A 26 1.129 14.548 3.969 1.00 0.00 C ATOM 413 CD GLN A 26 0.193 15.604 4.519 1.00 0.00 C ATOM 414 OE1 GLN A 26 0.011 16.662 3.916 1.00 0.00 O ATOM 415 NE2 GLN A 26 -0.415 15.368 5.629 1.00 0.00 N ATOM 0 H GLN A 26 -0.309 14.022 1.130 1.00 0.00 H new ATOM 0 HA GLN A 26 2.074 13.049 2.268 1.00 0.00 H new ATOM 0 HB2 GLN A 26 -0.695 13.663 3.194 1.00 0.00 H new ATOM 0 HB3 GLN A 26 0.239 12.583 4.209 1.00 0.00 H new ATOM 0 HG2 GLN A 26 1.816 14.217 4.748 1.00 0.00 H new ATOM 0 HG3 GLN A 26 1.736 14.970 3.167 1.00 0.00 H new ATOM 0 HE21 GLN A 26 -0.257 14.488 6.120 1.00 0.00 H new ATOM 0 HE22 GLN A 26 -1.055 16.061 6.017 1.00 0.00 H new ATOM 424 N VAL A 27 -0.260 10.786 1.727 1.00 0.00 N ATOM 425 CA VAL A 27 -0.455 9.342 1.618 1.00 0.00 C ATOM 426 C VAL A 27 0.543 8.780 0.611 1.00 0.00 C ATOM 427 O VAL A 27 1.209 7.778 0.870 1.00 0.00 O ATOM 428 CB VAL A 27 -1.889 9.017 1.171 1.00 0.00 C ATOM 429 CG1 VAL A 27 -2.065 7.497 1.086 1.00 0.00 C ATOM 430 CG2 VAL A 27 -2.891 9.582 2.184 1.00 0.00 C ATOM 0 H VAL A 27 -1.064 11.351 1.453 1.00 0.00 H new ATOM 0 HA VAL A 27 -0.293 8.887 2.595 1.00 0.00 H new ATOM 0 HB VAL A 27 -2.068 9.466 0.194 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -3.082 7.266 0.769 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -1.358 7.089 0.364 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -1.880 7.054 2.065 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -3.906 9.348 1.861 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -2.710 9.137 3.162 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -2.771 10.663 2.250 1.00 0.00 H new ATOM 440 N LYS A 28 0.652 9.467 -0.524 1.00 0.00 N ATOM 441 CA LYS A 28 1.582 9.081 -1.581 1.00 0.00 C ATOM 442 C LYS A 28 3.019 9.110 -1.059 1.00 0.00 C ATOM 443 O LYS A 28 3.844 8.283 -1.444 1.00 0.00 O ATOM 444 CB LYS A 28 1.422 10.046 -2.777 1.00 0.00 C ATOM 445 CG LYS A 28 2.277 9.591 -3.964 1.00 0.00 C ATOM 446 CD LYS A 28 2.252 10.671 -5.055 1.00 0.00 C ATOM 447 CE LYS A 28 3.156 10.260 -6.222 1.00 0.00 C ATOM 448 NZ LYS A 28 4.583 10.331 -5.796 1.00 0.00 N ATOM 0 H LYS A 28 0.103 10.300 -0.735 1.00 0.00 H new ATOM 0 HA LYS A 28 1.359 8.065 -1.907 1.00 0.00 H new ATOM 0 HB2 LYS A 28 0.374 10.092 -3.075 1.00 0.00 H new ATOM 0 HB3 LYS A 28 1.713 11.053 -2.479 1.00 0.00 H new ATOM 0 HG2 LYS A 28 3.302 9.410 -3.640 1.00 0.00 H new ATOM 0 HG3 LYS A 28 1.897 8.649 -4.360 1.00 0.00 H new ATOM 0 HD2 LYS A 28 1.232 10.818 -5.409 1.00 0.00 H new ATOM 0 HD3 LYS A 28 2.587 11.623 -4.643 1.00 0.00 H new ATOM 0 HE2 LYS A 28 2.912 9.248 -6.546 1.00 0.00 H new ATOM 0 HE3 LYS A 28 2.987 10.917 -7.075 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 5.100 10.983 -6.420 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 4.636 10.675 -4.816 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 5.010 9.385 -5.854 1.00 0.00 H new ATOM 462 N ALA A 29 3.297 10.072 -0.180 1.00 0.00 N ATOM 463 CA ALA A 29 4.620 10.227 0.402 1.00 0.00 C ATOM 464 C ALA A 29 4.922 9.107 1.358 1.00 0.00 C ATOM 465 O ALA A 29 6.018 8.550 1.351 1.00 0.00 O ATOM 466 CB ALA A 29 4.701 11.538 1.160 1.00 0.00 C ATOM 0 H ALA A 29 2.615 10.758 0.143 1.00 0.00 H new ATOM 0 HA ALA A 29 5.345 10.213 -0.411 1.00 0.00 H new ATOM 0 HB1 ALA A 29 5.695 11.647 1.593 1.00 0.00 H new ATOM 0 HB2 ALA A 29 4.510 12.366 0.477 1.00 0.00 H new ATOM 0 HB3 ALA A 29 3.956 11.545 1.956 1.00 0.00 H new ATOM 472 N PHE A 30 3.934 8.774 2.177 1.00 0.00 N ATOM 473 CA PHE A 30 4.092 7.715 3.125 1.00 0.00 C ATOM 474 C PHE A 30 4.302 6.430 2.354 1.00 0.00 C ATOM 475 O PHE A 30 5.148 5.615 2.721 1.00 0.00 O ATOM 476 CB PHE A 30 2.874 7.640 4.047 1.00 0.00 C ATOM 477 CG PHE A 30 2.756 8.922 4.863 1.00 0.00 C ATOM 478 CD1 PHE A 30 3.881 9.443 5.532 1.00 0.00 C ATOM 479 CD2 PHE A 30 1.523 9.601 4.951 1.00 0.00 C ATOM 480 CE1 PHE A 30 3.770 10.619 6.268 1.00 0.00 C ATOM 481 CE2 PHE A 30 1.427 10.775 5.695 1.00 0.00 C ATOM 482 CZ PHE A 30 2.547 11.280 6.350 1.00 0.00 C ATOM 0 H PHE A 30 3.022 9.230 2.193 1.00 0.00 H new ATOM 0 HA PHE A 30 4.956 7.892 3.766 1.00 0.00 H new ATOM 0 HB2 PHE A 30 1.970 7.491 3.457 1.00 0.00 H new ATOM 0 HB3 PHE A 30 2.965 6.782 4.714 1.00 0.00 H new ATOM 0 HD1 PHE A 30 4.830 8.930 5.474 1.00 0.00 H new ATOM 0 HD2 PHE A 30 0.654 9.211 4.442 1.00 0.00 H new ATOM 0 HE1 PHE A 30 4.634 11.020 6.777 1.00 0.00 H new ATOM 0 HE2 PHE A 30 0.482 11.294 5.764 1.00 0.00 H new ATOM 0 HZ PHE A 30 2.467 12.190 6.925 1.00 0.00 H new ATOM 492 N ILE A 31 3.578 6.292 1.233 1.00 0.00 N ATOM 493 CA ILE A 31 3.752 5.133 0.383 1.00 0.00 C ATOM 494 C ILE A 31 5.146 5.166 -0.212 1.00 0.00 C ATOM 495 O ILE A 31 5.834 4.161 -0.223 1.00 0.00 O ATOM 496 CB ILE A 31 2.686 5.078 -0.732 1.00 0.00 C ATOM 497 CG1 ILE A 31 1.324 4.734 -0.101 1.00 0.00 C ATOM 498 CG2 ILE A 31 3.052 4.012 -1.799 1.00 0.00 C ATOM 499 CD1 ILE A 31 0.234 4.739 -1.172 1.00 0.00 C ATOM 0 H ILE A 31 2.881 6.963 0.909 1.00 0.00 H new ATOM 0 HA ILE A 31 3.628 4.234 0.986 1.00 0.00 H new ATOM 0 HB ILE A 31 2.639 6.049 -1.226 1.00 0.00 H new ATOM 0 HG12 ILE A 31 1.372 3.755 0.376 1.00 0.00 H new ATOM 0 HG13 ILE A 31 1.082 5.457 0.678 1.00 0.00 H new ATOM 0 HG21 ILE A 31 2.285 3.994 -2.573 1.00 0.00 H new ATOM 0 HG22 ILE A 31 4.014 4.261 -2.247 1.00 0.00 H new ATOM 0 HG23 ILE A 31 3.115 3.031 -1.327 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -0.725 4.495 -0.716 1.00 0.00 H new ATOM 0 HD12 ILE A 31 0.177 5.727 -1.629 1.00 0.00 H new ATOM 0 HD13 ILE A 31 0.471 3.999 -1.936 1.00 0.00 H new ATOM 511 N ASP A 32 5.554 6.339 -0.683 1.00 0.00 N ATOM 512 CA ASP A 32 6.883 6.495 -1.273 1.00 0.00 C ATOM 513 C ASP A 32 7.960 6.094 -0.277 1.00 0.00 C ATOM 514 O ASP A 32 8.901 5.370 -0.610 1.00 0.00 O ATOM 515 CB ASP A 32 7.107 7.953 -1.713 1.00 0.00 C ATOM 516 CG ASP A 32 6.655 8.162 -3.157 1.00 0.00 C ATOM 517 OD1 ASP A 32 7.213 7.519 -4.031 1.00 0.00 O ATOM 518 OD2 ASP A 32 5.768 8.973 -3.371 1.00 0.00 O ATOM 0 H ASP A 32 4.992 7.190 -0.670 1.00 0.00 H new ATOM 0 HA ASP A 32 6.945 5.844 -2.145 1.00 0.00 H new ATOM 0 HB2 ASP A 32 6.556 8.625 -1.054 1.00 0.00 H new ATOM 0 HB3 ASP A 32 8.162 8.208 -1.618 1.00 0.00 H new ATOM 523 N SER A 33 7.784 6.558 0.944 1.00 0.00 N ATOM 524 CA SER A 33 8.703 6.256 2.034 1.00 0.00 C ATOM 525 C SER A 33 8.674 4.757 2.328 1.00 0.00 C ATOM 526 O SER A 33 9.703 4.139 2.596 1.00 0.00 O ATOM 527 CB SER A 33 8.291 7.056 3.268 1.00 0.00 C ATOM 528 OG SER A 33 8.376 8.444 2.973 1.00 0.00 O ATOM 0 H SER A 33 7.002 7.155 1.213 1.00 0.00 H new ATOM 0 HA SER A 33 9.720 6.533 1.755 1.00 0.00 H new ATOM 0 HB2 SER A 33 7.274 6.796 3.562 1.00 0.00 H new ATOM 0 HB3 SER A 33 8.939 6.810 4.109 1.00 0.00 H new ATOM 0 HG SER A 33 7.626 8.703 2.398 1.00 0.00 H new ATOM 534 N LEU A 34 7.473 4.192 2.235 1.00 0.00 N ATOM 535 CA LEU A 34 7.243 2.762 2.439 1.00 0.00 C ATOM 536 C LEU A 34 8.056 1.957 1.426 1.00 0.00 C ATOM 537 O LEU A 34 8.812 1.061 1.795 1.00 0.00 O ATOM 538 CB LEU A 34 5.750 2.510 2.222 1.00 0.00 C ATOM 539 CG LEU A 34 4.996 2.366 3.540 1.00 0.00 C ATOM 540 CD1 LEU A 34 3.679 3.142 3.494 1.00 0.00 C ATOM 541 CD2 LEU A 34 4.678 0.903 3.747 1.00 0.00 C ATOM 0 H LEU A 34 6.626 4.716 2.015 1.00 0.00 H new ATOM 0 HA LEU A 34 7.547 2.458 3.441 1.00 0.00 H new ATOM 0 HB2 LEU A 34 5.323 3.333 1.649 1.00 0.00 H new ATOM 0 HB3 LEU A 34 5.618 1.606 1.628 1.00 0.00 H new ATOM 0 HG LEU A 34 5.613 2.757 4.349 1.00 0.00 H new ATOM 0 HD11 LEU A 34 3.156 3.027 4.443 1.00 0.00 H new ATOM 0 HD12 LEU A 34 3.885 4.198 3.319 1.00 0.00 H new ATOM 0 HD13 LEU A 34 3.057 2.755 2.687 1.00 0.00 H new ATOM 0 HD21 LEU A 34 4.138 0.777 4.685 1.00 0.00 H new ATOM 0 HD22 LEU A 34 4.061 0.544 2.923 1.00 0.00 H new ATOM 0 HD23 LEU A 34 5.605 0.331 3.782 1.00 0.00 H new ATOM 553 N ARG A 35 7.897 2.302 0.149 1.00 0.00 N ATOM 554 CA ARG A 35 8.638 1.614 -0.929 1.00 0.00 C ATOM 555 C ARG A 35 10.143 1.753 -0.697 1.00 0.00 C ATOM 556 O ARG A 35 10.898 0.787 -0.819 1.00 0.00 O ATOM 557 CB ARG A 35 8.341 2.210 -2.326 1.00 0.00 C ATOM 558 CG ARG A 35 7.025 2.986 -2.341 1.00 0.00 C ATOM 559 CD ARG A 35 6.559 3.271 -3.775 1.00 0.00 C ATOM 560 NE ARG A 35 5.790 2.149 -4.292 1.00 0.00 N ATOM 561 CZ ARG A 35 6.377 1.150 -4.923 1.00 0.00 C ATOM 562 NH1 ARG A 35 6.596 1.222 -6.201 1.00 0.00 N ATOM 563 NH2 ARG A 35 6.741 0.106 -4.257 1.00 0.00 N ATOM 0 H ARG A 35 7.273 3.042 -0.171 1.00 0.00 H new ATOM 0 HA ARG A 35 8.316 0.573 -0.905 1.00 0.00 H new ATOM 0 HB2 ARG A 35 9.156 2.871 -2.621 1.00 0.00 H new ATOM 0 HB3 ARG A 35 8.299 1.408 -3.063 1.00 0.00 H new ATOM 0 HG2 ARG A 35 6.259 2.417 -1.814 1.00 0.00 H new ATOM 0 HG3 ARG A 35 7.149 3.926 -1.804 1.00 0.00 H new ATOM 0 HD2 ARG A 35 5.951 4.176 -3.793 1.00 0.00 H new ATOM 0 HD3 ARG A 35 7.422 3.454 -4.415 1.00 0.00 H new ATOM 0 HE ARG A 35 4.778 2.135 -4.164 1.00 0.00 H new ATOM 0 HH11 ARG A 35 6.314 2.053 -6.721 1.00 0.00 H new ATOM 0 HH12 ARG A 35 7.050 0.447 -6.685 1.00 0.00 H new ATOM 0 HH21 ARG A 35 6.574 0.058 -3.252 1.00 0.00 H new ATOM 0 HH22 ARG A 35 7.196 -0.672 -4.736 1.00 0.00 H new ATOM 577 N ASP A 36 10.556 2.982 -0.370 1.00 0.00 N ATOM 578 CA ASP A 36 11.958 3.301 -0.124 1.00 0.00 C ATOM 579 C ASP A 36 12.482 2.537 1.079 1.00 0.00 C ATOM 580 O ASP A 36 13.633 2.095 1.099 1.00 0.00 O ATOM 581 CB ASP A 36 12.107 4.799 0.115 1.00 0.00 C ATOM 582 CG ASP A 36 13.586 5.183 0.181 1.00 0.00 C ATOM 583 OD1 ASP A 36 14.167 5.411 -0.868 1.00 0.00 O ATOM 584 OD2 ASP A 36 14.115 5.238 1.279 1.00 0.00 O ATOM 0 H ASP A 36 9.927 3.778 -0.270 1.00 0.00 H new ATOM 0 HA ASP A 36 12.539 3.009 -0.999 1.00 0.00 H new ATOM 0 HB2 ASP A 36 11.616 5.352 -0.686 1.00 0.00 H new ATOM 0 HB3 ASP A 36 11.611 5.077 1.045 1.00 0.00 H new ATOM 589 N ASP A 37 11.619 2.390 2.077 1.00 0.00 N ATOM 590 CA ASP A 37 11.979 1.681 3.294 1.00 0.00 C ATOM 591 C ASP A 37 10.750 1.032 3.914 1.00 0.00 C ATOM 592 O ASP A 37 9.991 1.675 4.646 1.00 0.00 O ATOM 593 CB ASP A 37 12.650 2.633 4.298 1.00 0.00 C ATOM 594 CG ASP A 37 13.404 1.837 5.370 1.00 0.00 C ATOM 595 OD1 ASP A 37 12.798 0.970 5.983 1.00 0.00 O ATOM 596 OD2 ASP A 37 14.576 2.109 5.565 1.00 0.00 O ATOM 0 H ASP A 37 10.666 2.753 2.065 1.00 0.00 H new ATOM 0 HA ASP A 37 12.692 0.897 3.037 1.00 0.00 H new ATOM 0 HB2 ASP A 37 13.340 3.295 3.775 1.00 0.00 H new ATOM 0 HB3 ASP A 37 11.897 3.265 4.768 1.00 0.00 H new ATOM 601 N PRO A 38 10.546 -0.229 3.628 1.00 0.00 N ATOM 602 CA PRO A 38 9.390 -0.988 4.158 1.00 0.00 C ATOM 603 C PRO A 38 9.491 -1.245 5.654 1.00 0.00 C ATOM 604 O PRO A 38 8.479 -1.311 6.348 1.00 0.00 O ATOM 605 CB PRO A 38 9.388 -2.295 3.374 1.00 0.00 C ATOM 606 CG PRO A 38 10.524 -2.253 2.404 1.00 0.00 C ATOM 607 CD PRO A 38 11.400 -1.064 2.768 1.00 0.00 C ATOM 0 HA PRO A 38 8.464 -0.425 4.036 1.00 0.00 H new ATOM 0 HB2 PRO A 38 9.494 -3.144 4.049 1.00 0.00 H new ATOM 0 HB3 PRO A 38 8.442 -2.422 2.848 1.00 0.00 H new ATOM 0 HG2 PRO A 38 11.098 -3.178 2.447 1.00 0.00 H new ATOM 0 HG3 PRO A 38 10.152 -2.156 1.384 1.00 0.00 H new ATOM 0 HD2 PRO A 38 12.302 -1.381 3.291 1.00 0.00 H new ATOM 0 HD3 PRO A 38 11.721 -0.520 1.879 1.00 0.00 H new ATOM 615 N SER A 39 10.715 -1.368 6.148 1.00 0.00 N ATOM 616 CA SER A 39 10.932 -1.584 7.573 1.00 0.00 C ATOM 617 C SER A 39 10.388 -0.379 8.331 1.00 0.00 C ATOM 618 O SER A 39 9.963 -0.484 9.484 1.00 0.00 O ATOM 619 CB SER A 39 12.426 -1.757 7.867 1.00 0.00 C ATOM 620 OG SER A 39 12.972 -2.721 6.976 1.00 0.00 O ATOM 0 H SER A 39 11.567 -1.323 5.589 1.00 0.00 H new ATOM 0 HA SER A 39 10.417 -2.491 7.890 1.00 0.00 H new ATOM 0 HB2 SER A 39 12.944 -0.805 7.752 1.00 0.00 H new ATOM 0 HB3 SER A 39 12.571 -2.076 8.899 1.00 0.00 H new ATOM 0 HG SER A 39 13.928 -2.833 7.161 1.00 0.00 H new ATOM 626 N GLN A 40 10.408 0.766 7.645 1.00 0.00 N ATOM 627 CA GLN A 40 9.925 2.020 8.203 1.00 0.00 C ATOM 628 C GLN A 40 8.421 2.195 7.974 1.00 0.00 C ATOM 629 O GLN A 40 7.852 3.185 8.393 1.00 0.00 O ATOM 630 CB GLN A 40 10.672 3.194 7.543 1.00 0.00 C ATOM 631 CG GLN A 40 11.365 4.050 8.609 1.00 0.00 C ATOM 632 CD GLN A 40 12.640 3.360 9.092 1.00 0.00 C ATOM 633 OE1 GLN A 40 12.754 3.022 10.270 1.00 0.00 O ATOM 634 NE2 GLN A 40 13.607 3.127 8.248 1.00 0.00 N ATOM 0 H GLN A 40 10.759 0.845 6.691 1.00 0.00 H new ATOM 0 HA GLN A 40 10.109 2.004 9.277 1.00 0.00 H new ATOM 0 HB2 GLN A 40 11.410 2.813 6.836 1.00 0.00 H new ATOM 0 HB3 GLN A 40 9.972 3.806 6.974 1.00 0.00 H new ATOM 0 HG2 GLN A 40 11.606 5.030 8.198 1.00 0.00 H new ATOM 0 HG3 GLN A 40 10.691 4.214 9.449 1.00 0.00 H new ATOM 0 HE21 GLN A 40 13.511 3.408 7.272 1.00 0.00 H new ATOM 0 HE22 GLN A 40 14.459 2.664 8.564 1.00 0.00 H new ATOM 643 N SER A 41 7.794 1.243 7.293 1.00 0.00 N ATOM 644 CA SER A 41 6.365 1.332 6.970 1.00 0.00 C ATOM 645 C SER A 41 5.504 1.684 8.182 1.00 0.00 C ATOM 646 O SER A 41 4.562 2.470 8.069 1.00 0.00 O ATOM 647 CB SER A 41 5.903 -0.024 6.437 1.00 0.00 C ATOM 648 OG SER A 41 6.009 -1.001 7.465 1.00 0.00 O ATOM 0 H SER A 41 8.249 0.397 6.951 1.00 0.00 H new ATOM 0 HA SER A 41 6.246 2.127 6.234 1.00 0.00 H new ATOM 0 HB2 SER A 41 4.872 0.042 6.089 1.00 0.00 H new ATOM 0 HB3 SER A 41 6.510 -0.316 5.580 1.00 0.00 H new ATOM 0 HG SER A 41 6.883 -1.441 7.410 1.00 0.00 H new ATOM 654 N ALA A 42 5.841 1.122 9.334 1.00 0.00 N ATOM 655 CA ALA A 42 5.103 1.399 10.556 1.00 0.00 C ATOM 656 C ALA A 42 5.295 2.850 10.959 1.00 0.00 C ATOM 657 O ALA A 42 4.393 3.488 11.495 1.00 0.00 O ATOM 658 CB ALA A 42 5.627 0.509 11.672 1.00 0.00 C ATOM 0 H ALA A 42 6.619 0.473 9.447 1.00 0.00 H new ATOM 0 HA ALA A 42 4.044 1.204 10.384 1.00 0.00 H new ATOM 0 HB1 ALA A 42 5.076 0.714 12.590 1.00 0.00 H new ATOM 0 HB2 ALA A 42 5.495 -0.537 11.395 1.00 0.00 H new ATOM 0 HB3 ALA A 42 6.686 0.711 11.832 1.00 0.00 H new ATOM 664 N ASN A 43 6.497 3.343 10.692 1.00 0.00 N ATOM 665 CA ASN A 43 6.879 4.703 11.006 1.00 0.00 C ATOM 666 C ASN A 43 6.134 5.695 10.128 1.00 0.00 C ATOM 667 O ASN A 43 5.800 6.792 10.541 1.00 0.00 O ATOM 668 CB ASN A 43 8.374 4.835 10.750 1.00 0.00 C ATOM 669 CG ASN A 43 8.955 6.076 11.431 1.00 0.00 C ATOM 670 OD1 ASN A 43 8.223 6.901 11.980 1.00 0.00 O ATOM 671 ND2 ASN A 43 10.245 6.254 11.424 1.00 0.00 N ATOM 0 H ASN A 43 7.237 2.801 10.247 1.00 0.00 H new ATOM 0 HA ASN A 43 6.633 4.919 12.046 1.00 0.00 H new ATOM 0 HB2 ASN A 43 8.886 3.945 11.116 1.00 0.00 H new ATOM 0 HB3 ASN A 43 8.557 4.889 9.677 1.00 0.00 H new ATOM 0 HD21 ASN A 43 10.649 7.076 11.873 1.00 0.00 H new ATOM 0 HD22 ASN A 43 10.852 5.571 10.970 1.00 0.00 H new ATOM 678 N LEU A 44 5.911 5.274 8.904 1.00 0.00 N ATOM 679 CA LEU A 44 5.230 6.070 7.893 1.00 0.00 C ATOM 680 C LEU A 44 3.777 6.096 8.214 1.00 0.00 C ATOM 681 O LEU A 44 3.109 7.120 8.117 1.00 0.00 O ATOM 682 CB LEU A 44 5.534 5.428 6.549 1.00 0.00 C ATOM 683 CG LEU A 44 7.059 5.345 6.478 1.00 0.00 C ATOM 684 CD1 LEU A 44 7.521 4.445 5.353 1.00 0.00 C ATOM 685 CD2 LEU A 44 7.606 6.748 6.338 1.00 0.00 C ATOM 0 H LEU A 44 6.200 4.354 8.571 1.00 0.00 H new ATOM 0 HA LEU A 44 5.566 7.107 7.865 1.00 0.00 H new ATOM 0 HB2 LEU A 44 5.082 4.439 6.474 1.00 0.00 H new ATOM 0 HB3 LEU A 44 5.134 6.024 5.729 1.00 0.00 H new ATOM 0 HG LEU A 44 7.442 4.896 7.394 1.00 0.00 H new ATOM 0 HD11 LEU A 44 8.610 4.413 5.337 1.00 0.00 H new ATOM 0 HD12 LEU A 44 7.131 3.439 5.508 1.00 0.00 H new ATOM 0 HD13 LEU A 44 7.155 4.834 4.403 1.00 0.00 H new ATOM 0 HD21 LEU A 44 8.694 6.711 6.286 1.00 0.00 H new ATOM 0 HD22 LEU A 44 7.214 7.202 5.428 1.00 0.00 H new ATOM 0 HD23 LEU A 44 7.304 7.344 7.200 1.00 0.00 H new ATOM 697 N LEU A 45 3.344 4.962 8.694 1.00 0.00 N ATOM 698 CA LEU A 45 1.994 4.807 9.175 1.00 0.00 C ATOM 699 C LEU A 45 1.867 5.683 10.414 1.00 0.00 C ATOM 700 O LEU A 45 0.853 6.330 10.649 1.00 0.00 O ATOM 701 CB LEU A 45 1.735 3.333 9.508 1.00 0.00 C ATOM 702 CG LEU A 45 0.495 3.186 10.397 1.00 0.00 C ATOM 703 CD1 LEU A 45 -0.726 3.801 9.707 1.00 0.00 C ATOM 704 CD2 LEU A 45 0.258 1.699 10.663 1.00 0.00 C ATOM 0 H LEU A 45 3.914 4.119 8.764 1.00 0.00 H new ATOM 0 HA LEU A 45 1.260 5.106 8.427 1.00 0.00 H new ATOM 0 HB2 LEU A 45 1.597 2.766 8.587 1.00 0.00 H new ATOM 0 HB3 LEU A 45 2.603 2.912 10.015 1.00 0.00 H new ATOM 0 HG LEU A 45 0.653 3.709 11.340 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -1.600 3.690 10.348 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -0.544 4.859 9.521 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -0.904 3.291 8.760 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -0.622 1.578 11.295 1.00 0.00 H new ATOM 0 HD22 LEU A 45 0.099 1.181 9.717 1.00 0.00 H new ATOM 0 HD23 LEU A 45 1.127 1.276 11.167 1.00 0.00 H new ATOM 716 N ALA A 46 2.950 5.707 11.180 1.00 0.00 N ATOM 717 CA ALA A 46 3.030 6.509 12.389 1.00 0.00 C ATOM 718 C ALA A 46 2.951 7.978 12.034 1.00 0.00 C ATOM 719 O ALA A 46 2.211 8.754 12.642 1.00 0.00 O ATOM 720 CB ALA A 46 4.366 6.260 13.088 1.00 0.00 C ATOM 0 H ALA A 46 3.795 5.172 10.979 1.00 0.00 H new ATOM 0 HA ALA A 46 2.204 6.234 13.045 1.00 0.00 H new ATOM 0 HB1 ALA A 46 4.421 6.864 13.994 1.00 0.00 H new ATOM 0 HB2 ALA A 46 4.449 5.205 13.349 1.00 0.00 H new ATOM 0 HB3 ALA A 46 5.183 6.533 12.420 1.00 0.00 H new ATOM 726 N GLU A 47 3.723 8.323 11.020 1.00 0.00 N ATOM 727 CA GLU A 47 3.787 9.667 10.511 1.00 0.00 C ATOM 728 C GLU A 47 2.456 10.057 9.930 1.00 0.00 C ATOM 729 O GLU A 47 2.005 11.181 10.068 1.00 0.00 O ATOM 730 CB GLU A 47 4.818 9.707 9.393 1.00 0.00 C ATOM 731 CG GLU A 47 6.240 9.811 9.932 1.00 0.00 C ATOM 732 CD GLU A 47 6.387 11.018 10.863 1.00 0.00 C ATOM 733 OE1 GLU A 47 6.109 12.123 10.423 1.00 0.00 O ATOM 734 OE2 GLU A 47 6.764 10.818 12.007 1.00 0.00 O ATOM 0 H GLU A 47 4.327 7.666 10.526 1.00 0.00 H new ATOM 0 HA GLU A 47 4.052 10.349 11.319 1.00 0.00 H new ATOM 0 HB2 GLU A 47 4.726 8.808 8.783 1.00 0.00 H new ATOM 0 HB3 GLU A 47 4.614 10.557 8.742 1.00 0.00 H new ATOM 0 HG2 GLU A 47 6.496 8.899 10.470 1.00 0.00 H new ATOM 0 HG3 GLU A 47 6.942 9.899 9.103 1.00 0.00 H new ATOM 741 N ALA A 48 1.845 9.098 9.271 1.00 0.00 N ATOM 742 CA ALA A 48 0.577 9.299 8.643 1.00 0.00 C ATOM 743 C ALA A 48 -0.484 9.527 9.692 1.00 0.00 C ATOM 744 O ALA A 48 -1.257 10.474 9.600 1.00 0.00 O ATOM 745 CB ALA A 48 0.284 8.065 7.827 1.00 0.00 C ATOM 0 H ALA A 48 2.222 8.157 9.160 1.00 0.00 H new ATOM 0 HA ALA A 48 0.588 10.177 7.998 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -0.679 8.178 7.329 1.00 0.00 H new ATOM 0 HB2 ALA A 48 1.065 7.929 7.079 1.00 0.00 H new ATOM 0 HB3 ALA A 48 0.254 7.194 8.482 1.00 0.00 H new ATOM 751 N LYS A 49 -0.479 8.681 10.717 1.00 0.00 N ATOM 752 CA LYS A 49 -1.413 8.832 11.816 1.00 0.00 C ATOM 753 C LYS A 49 -1.172 10.181 12.463 1.00 0.00 C ATOM 754 O LYS A 49 -2.101 10.820 12.939 1.00 0.00 O ATOM 755 CB LYS A 49 -1.223 7.707 12.847 1.00 0.00 C ATOM 756 CG LYS A 49 -1.661 6.360 12.247 1.00 0.00 C ATOM 757 CD LYS A 49 -3.186 6.209 12.338 1.00 0.00 C ATOM 758 CE LYS A 49 -3.622 4.939 11.596 1.00 0.00 C ATOM 759 NZ LYS A 49 -5.094 4.759 11.739 1.00 0.00 N ATOM 0 H LYS A 49 0.159 7.890 10.805 1.00 0.00 H new ATOM 0 HA LYS A 49 -2.435 8.772 11.442 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -0.178 7.655 13.152 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -1.806 7.922 13.743 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -1.344 6.297 11.206 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -1.175 5.542 12.778 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -3.495 6.157 13.382 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -3.675 7.082 11.904 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -3.355 5.011 10.542 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -3.098 4.072 11.999 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -5.360 3.807 11.417 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -5.363 4.875 12.737 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -5.588 5.470 11.163 1.00 0.00 H new ATOM 773 N LYS A 50 0.090 10.621 12.443 1.00 0.00 N ATOM 774 CA LYS A 50 0.450 11.900 13.007 1.00 0.00 C ATOM 775 C LYS A 50 -0.029 13.023 12.111 1.00 0.00 C ATOM 776 O LYS A 50 -0.528 14.043 12.587 1.00 0.00 O ATOM 777 CB LYS A 50 1.969 11.962 13.191 1.00 0.00 C ATOM 778 CG LYS A 50 2.368 13.226 13.961 1.00 0.00 C ATOM 779 CD LYS A 50 3.887 13.229 14.174 1.00 0.00 C ATOM 780 CE LYS A 50 4.598 13.660 12.883 1.00 0.00 C ATOM 781 NZ LYS A 50 6.065 13.440 13.028 1.00 0.00 N ATOM 0 H LYS A 50 0.870 10.102 12.040 1.00 0.00 H new ATOM 0 HA LYS A 50 -0.030 12.017 13.978 1.00 0.00 H new ATOM 0 HB2 LYS A 50 2.312 11.078 13.729 1.00 0.00 H new ATOM 0 HB3 LYS A 50 2.459 11.953 12.218 1.00 0.00 H new ATOM 0 HG2 LYS A 50 2.065 14.114 13.407 1.00 0.00 H new ATOM 0 HG3 LYS A 50 1.854 13.258 14.922 1.00 0.00 H new ATOM 0 HD2 LYS A 50 4.147 13.908 14.986 1.00 0.00 H new ATOM 0 HD3 LYS A 50 4.223 12.235 14.469 1.00 0.00 H new ATOM 0 HE2 LYS A 50 4.216 13.090 12.037 1.00 0.00 H new ATOM 0 HE3 LYS A 50 4.395 14.711 12.677 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 6.568 13.941 12.268 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 6.381 13.803 13.950 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 6.271 12.422 12.967 1.00 0.00 H new ATOM 795 N LEU A 51 0.125 12.819 10.812 1.00 0.00 N ATOM 796 CA LEU A 51 -0.293 13.807 9.838 1.00 0.00 C ATOM 797 C LEU A 51 -1.808 13.885 9.805 1.00 0.00 C ATOM 798 O LEU A 51 -2.386 14.968 9.747 1.00 0.00 O ATOM 799 CB LEU A 51 0.248 13.458 8.445 1.00 0.00 C ATOM 800 CG LEU A 51 1.562 14.205 8.161 1.00 0.00 C ATOM 801 CD1 LEU A 51 1.369 15.716 8.352 1.00 0.00 C ATOM 802 CD2 LEU A 51 2.675 13.695 9.089 1.00 0.00 C ATOM 0 H LEU A 51 0.537 11.977 10.411 1.00 0.00 H new ATOM 0 HA LEU A 51 0.111 14.777 10.129 1.00 0.00 H new ATOM 0 HB2 LEU A 51 0.414 12.383 8.374 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -0.492 13.717 7.688 1.00 0.00 H new ATOM 0 HG LEU A 51 1.851 14.016 7.127 1.00 0.00 H new ATOM 0 HD11 LEU A 51 2.307 16.231 8.148 1.00 0.00 H new ATOM 0 HD12 LEU A 51 0.601 16.074 7.666 1.00 0.00 H new ATOM 0 HD13 LEU A 51 1.061 15.917 9.378 1.00 0.00 H new ATOM 0 HD21 LEU A 51 3.600 14.232 8.877 1.00 0.00 H new ATOM 0 HD22 LEU A 51 2.388 13.862 10.127 1.00 0.00 H new ATOM 0 HD23 LEU A 51 2.828 12.629 8.922 1.00 0.00 H new ATOM 814 N ASN A 52 -2.434 12.717 9.868 1.00 0.00 N ATOM 815 CA ASN A 52 -3.878 12.623 9.872 1.00 0.00 C ATOM 816 C ASN A 52 -4.414 13.264 11.134 1.00 0.00 C ATOM 817 O ASN A 52 -5.360 14.045 11.092 1.00 0.00 O ATOM 818 CB ASN A 52 -4.296 11.154 9.818 1.00 0.00 C ATOM 819 CG ASN A 52 -5.746 10.982 10.249 1.00 0.00 C ATOM 820 OD1 ASN A 52 -6.652 11.267 9.481 1.00 0.00 O ATOM 821 ND2 ASN A 52 -6.017 10.524 11.438 1.00 0.00 N ATOM 0 H ASN A 52 -1.955 11.818 9.917 1.00 0.00 H new ATOM 0 HA ASN A 52 -4.283 13.140 9.002 1.00 0.00 H new ATOM 0 HB2 ASN A 52 -4.166 10.773 8.805 1.00 0.00 H new ATOM 0 HB3 ASN A 52 -3.648 10.564 10.466 1.00 0.00 H new ATOM 0 HD21 ASN A 52 -6.987 10.403 11.729 1.00 0.00 H new ATOM 0 HD22 ASN A 52 -5.259 10.287 12.078 1.00 0.00 H new ATOM 828 N ASP A 53 -3.782 12.927 12.255 1.00 0.00 N ATOM 829 CA ASP A 53 -4.187 13.481 13.535 1.00 0.00 C ATOM 830 C ASP A 53 -3.989 14.990 13.530 1.00 0.00 C ATOM 831 O ASP A 53 -4.824 15.743 14.035 1.00 0.00 O ATOM 832 CB ASP A 53 -3.394 12.843 14.684 1.00 0.00 C ATOM 833 CG ASP A 53 -3.807 11.378 14.915 1.00 0.00 C ATOM 834 OD1 ASP A 53 -4.766 10.925 14.301 1.00 0.00 O ATOM 835 OD2 ASP A 53 -3.145 10.724 15.704 1.00 0.00 O ATOM 0 H ASP A 53 -2.995 12.279 12.299 1.00 0.00 H new ATOM 0 HA ASP A 53 -5.243 13.259 13.690 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -2.328 12.890 14.461 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -3.554 13.415 15.598 1.00 0.00 H new ATOM 840 N ALA A 54 -2.881 15.420 12.929 1.00 0.00 N ATOM 841 CA ALA A 54 -2.568 16.833 12.821 1.00 0.00 C ATOM 842 C ALA A 54 -3.600 17.521 11.933 1.00 0.00 C ATOM 843 O ALA A 54 -4.013 18.650 12.200 1.00 0.00 O ATOM 844 CB ALA A 54 -1.171 17.006 12.224 1.00 0.00 C ATOM 0 H ALA A 54 -2.186 14.803 12.510 1.00 0.00 H new ATOM 0 HA ALA A 54 -2.592 17.285 13.813 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -0.938 18.068 12.144 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -0.437 16.521 12.868 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -1.140 16.552 11.233 1.00 0.00 H new ATOM 850 N GLN A 55 -4.013 16.814 10.878 1.00 0.00 N ATOM 851 CA GLN A 55 -5.003 17.335 9.940 1.00 0.00 C ATOM 852 C GLN A 55 -6.428 17.048 10.422 1.00 0.00 C ATOM 853 O GLN A 55 -7.399 17.462 9.784 1.00 0.00 O ATOM 854 CB GLN A 55 -4.775 16.692 8.573 1.00 0.00 C ATOM 855 CG GLN A 55 -3.511 17.278 7.936 1.00 0.00 C ATOM 856 CD GLN A 55 -3.137 16.472 6.704 1.00 0.00 C ATOM 857 OE1 GLN A 55 -3.169 16.982 5.584 1.00 0.00 O ATOM 858 NE2 GLN A 55 -2.785 15.230 6.847 1.00 0.00 N ATOM 0 H GLN A 55 -3.675 15.878 10.654 1.00 0.00 H new ATOM 0 HA GLN A 55 -4.887 18.417 9.870 1.00 0.00 H new ATOM 0 HB2 GLN A 55 -4.674 15.612 8.680 1.00 0.00 H new ATOM 0 HB3 GLN A 55 -5.636 16.869 7.928 1.00 0.00 H new ATOM 0 HG2 GLN A 55 -3.679 18.320 7.663 1.00 0.00 H new ATOM 0 HG3 GLN A 55 -2.691 17.265 8.654 1.00 0.00 H new ATOM 0 HE21 GLN A 55 -2.760 14.811 7.777 1.00 0.00 H new ATOM 0 HE22 GLN A 55 -2.534 14.674 6.030 1.00 0.00 H new ATOM 867 N ALA A 56 -6.545 16.336 11.546 1.00 0.00 N ATOM 868 CA ALA A 56 -7.856 15.999 12.100 1.00 0.00 C ATOM 869 C ALA A 56 -8.519 17.236 12.694 1.00 0.00 C ATOM 870 O ALA A 56 -7.854 18.041 13.345 1.00 0.00 O ATOM 871 CB ALA A 56 -7.720 14.915 13.175 1.00 0.00 C ATOM 0 H ALA A 56 -5.754 15.985 12.086 1.00 0.00 H new ATOM 0 HA ALA A 56 -8.480 15.619 11.291 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -8.704 14.676 13.577 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -7.280 14.020 12.735 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -7.078 15.278 13.978 1.00 0.00 H new ATOM 981 N PHE B 5 -10.478 -11.909 1.715 1.00 0.00 N ATOM 982 CA PHE B 5 -9.113 -11.696 1.260 1.00 0.00 C ATOM 983 C PHE B 5 -8.481 -10.443 1.877 1.00 0.00 C ATOM 984 O PHE B 5 -7.497 -9.951 1.356 1.00 0.00 O ATOM 985 CB PHE B 5 -9.117 -11.571 -0.276 1.00 0.00 C ATOM 986 CG PHE B 5 -9.053 -12.942 -0.910 1.00 0.00 C ATOM 987 CD1 PHE B 5 -9.824 -13.994 -0.396 1.00 0.00 C ATOM 988 CD2 PHE B 5 -8.229 -13.158 -2.021 1.00 0.00 C ATOM 989 CE1 PHE B 5 -9.765 -15.258 -0.990 1.00 0.00 C ATOM 990 CE2 PHE B 5 -8.171 -14.422 -2.614 1.00 0.00 C ATOM 991 CZ PHE B 5 -8.940 -15.473 -2.100 1.00 0.00 C ATOM 0 HA PHE B 5 -8.513 -12.549 1.579 1.00 0.00 H new ATOM 0 HB2 PHE B 5 -10.018 -11.052 -0.604 1.00 0.00 H new ATOM 0 HB3 PHE B 5 -8.267 -10.971 -0.602 1.00 0.00 H new ATOM 0 HD1 PHE B 5 -10.463 -13.828 0.459 1.00 0.00 H new ATOM 0 HD2 PHE B 5 -7.638 -12.347 -2.420 1.00 0.00 H new ATOM 0 HE1 PHE B 5 -10.356 -16.069 -0.592 1.00 0.00 H new ATOM 0 HE2 PHE B 5 -7.533 -14.588 -3.469 1.00 0.00 H new ATOM 0 HZ PHE B 5 -8.897 -16.449 -2.560 1.00 0.00 H new ATOM 1001 N ASN B 6 -9.027 -9.924 2.983 1.00 0.00 N ATOM 1002 CA ASN B 6 -8.439 -8.735 3.615 1.00 0.00 C ATOM 1003 C ASN B 6 -6.992 -9.021 3.996 1.00 0.00 C ATOM 1004 O ASN B 6 -6.103 -8.233 3.685 1.00 0.00 O ATOM 1005 CB ASN B 6 -9.243 -8.321 4.855 1.00 0.00 C ATOM 1006 CG ASN B 6 -8.763 -6.960 5.361 1.00 0.00 C ATOM 1007 OD1 ASN B 6 -8.592 -6.767 6.564 1.00 0.00 O ATOM 1008 ND2 ASN B 6 -8.524 -6.001 4.507 1.00 0.00 N ATOM 0 H ASN B 6 -9.854 -10.296 3.450 1.00 0.00 H new ATOM 0 HA ASN B 6 -8.468 -7.910 2.903 1.00 0.00 H new ATOM 0 HB2 ASN B 6 -10.304 -8.274 4.611 1.00 0.00 H new ATOM 0 HB3 ASN B 6 -9.129 -9.070 5.639 1.00 0.00 H new ATOM 0 HD21 ASN B 6 -8.196 -5.094 4.838 1.00 0.00 H new ATOM 0 HD22 ASN B 6 -8.665 -6.160 3.509 1.00 0.00 H new ATOM 1015 N LYS B 7 -6.761 -10.178 4.618 1.00 0.00 N ATOM 1016 CA LYS B 7 -5.405 -10.587 4.983 1.00 0.00 C ATOM 1017 C LYS B 7 -4.572 -10.714 3.713 1.00 0.00 C ATOM 1018 O LYS B 7 -3.422 -10.271 3.650 1.00 0.00 O ATOM 1019 CB LYS B 7 -5.446 -11.938 5.710 1.00 0.00 C ATOM 1020 CG LYS B 7 -4.022 -12.378 6.087 1.00 0.00 C ATOM 1021 CD LYS B 7 -4.061 -13.703 6.870 1.00 0.00 C ATOM 1022 CE LYS B 7 -4.026 -14.896 5.902 1.00 0.00 C ATOM 1023 NZ LYS B 7 -5.322 -14.998 5.174 1.00 0.00 N ATOM 0 H LYS B 7 -7.489 -10.843 4.878 1.00 0.00 H new ATOM 0 HA LYS B 7 -4.962 -9.843 5.645 1.00 0.00 H new ATOM 0 HB2 LYS B 7 -6.060 -11.859 6.607 1.00 0.00 H new ATOM 0 HB3 LYS B 7 -5.910 -12.690 5.071 1.00 0.00 H new ATOM 0 HG2 LYS B 7 -3.421 -12.498 5.186 1.00 0.00 H new ATOM 0 HG3 LYS B 7 -3.543 -11.606 6.689 1.00 0.00 H new ATOM 0 HD2 LYS B 7 -3.213 -13.755 7.553 1.00 0.00 H new ATOM 0 HD3 LYS B 7 -4.964 -13.747 7.479 1.00 0.00 H new ATOM 0 HE2 LYS B 7 -3.209 -14.775 5.191 1.00 0.00 H new ATOM 0 HE3 LYS B 7 -3.835 -15.817 6.453 1.00 0.00 H new ATOM 0 HZ1 LYS B 7 -5.561 -16.000 5.029 1.00 0.00 H new ATOM 0 HZ2 LYS B 7 -6.071 -14.541 5.733 1.00 0.00 H new ATOM 0 HZ3 LYS B 7 -5.240 -14.524 4.252 1.00 0.00 H new ATOM 1037 N GLU B 8 -5.194 -11.319 2.706 1.00 0.00 N ATOM 1038 CA GLU B 8 -4.571 -11.527 1.407 1.00 0.00 C ATOM 1039 C GLU B 8 -4.333 -10.192 0.704 1.00 0.00 C ATOM 1040 O GLU B 8 -3.359 -10.028 -0.035 1.00 0.00 O ATOM 1041 CB GLU B 8 -5.493 -12.416 0.554 1.00 0.00 C ATOM 1042 CG GLU B 8 -5.647 -13.795 1.219 1.00 0.00 C ATOM 1043 CD GLU B 8 -4.278 -14.435 1.472 1.00 0.00 C ATOM 1044 OE1 GLU B 8 -3.546 -14.628 0.515 1.00 0.00 O ATOM 1045 OE2 GLU B 8 -3.979 -14.709 2.623 1.00 0.00 O ATOM 0 H GLU B 8 -6.146 -11.679 2.770 1.00 0.00 H new ATOM 0 HA GLU B 8 -3.605 -12.014 1.542 1.00 0.00 H new ATOM 0 HB2 GLU B 8 -6.469 -11.944 0.444 1.00 0.00 H new ATOM 0 HB3 GLU B 8 -5.079 -12.529 -0.448 1.00 0.00 H new ATOM 0 HG2 GLU B 8 -6.184 -13.691 2.162 1.00 0.00 H new ATOM 0 HG3 GLU B 8 -6.245 -14.446 0.582 1.00 0.00 H new ATOM 1052 N ARG B 9 -5.236 -9.245 0.950 1.00 0.00 N ATOM 1053 CA ARG B 9 -5.154 -7.929 0.363 1.00 0.00 C ATOM 1054 C ARG B 9 -3.982 -7.168 0.959 1.00 0.00 C ATOM 1055 O ARG B 9 -3.275 -6.474 0.251 1.00 0.00 O ATOM 1056 CB ARG B 9 -6.456 -7.159 0.617 1.00 0.00 C ATOM 1057 CG ARG B 9 -6.356 -5.756 0.006 1.00 0.00 C ATOM 1058 CD ARG B 9 -7.683 -5.021 0.178 1.00 0.00 C ATOM 1059 NE ARG B 9 -7.966 -4.839 1.600 1.00 0.00 N ATOM 1060 CZ ARG B 9 -8.988 -4.103 2.016 1.00 0.00 C ATOM 1061 NH1 ARG B 9 -10.072 -4.018 1.297 1.00 0.00 N ATOM 1062 NH2 ARG B 9 -8.902 -3.464 3.145 1.00 0.00 N ATOM 0 H ARG B 9 -6.041 -9.378 1.563 1.00 0.00 H new ATOM 0 HA ARG B 9 -5.004 -8.031 -0.712 1.00 0.00 H new ATOM 0 HB2 ARG B 9 -7.298 -7.696 0.181 1.00 0.00 H new ATOM 0 HB3 ARG B 9 -6.644 -7.087 1.688 1.00 0.00 H new ATOM 0 HG2 ARG B 9 -5.555 -5.196 0.488 1.00 0.00 H new ATOM 0 HG3 ARG B 9 -6.104 -5.827 -1.052 1.00 0.00 H new ATOM 0 HD2 ARG B 9 -7.640 -4.053 -0.321 1.00 0.00 H new ATOM 0 HD3 ARG B 9 -8.487 -5.587 -0.293 1.00 0.00 H new ATOM 0 HE ARG B 9 -7.363 -5.289 2.289 1.00 0.00 H new ATOM 0 HH11 ARG B 9 -10.137 -4.519 0.411 1.00 0.00 H new ATOM 0 HH12 ARG B 9 -10.856 -3.451 1.621 1.00 0.00 H new ATOM 0 HH21 ARG B 9 -8.052 -3.530 3.705 1.00 0.00 H new ATOM 0 HH22 ARG B 9 -9.684 -2.896 3.471 1.00 0.00 H new ATOM 1076 N VAL B 10 -3.788 -7.318 2.271 1.00 0.00 N ATOM 1077 CA VAL B 10 -2.700 -6.629 2.967 1.00 0.00 C ATOM 1078 C VAL B 10 -1.365 -7.002 2.334 1.00 0.00 C ATOM 1079 O VAL B 10 -0.485 -6.153 2.184 1.00 0.00 O ATOM 1080 CB VAL B 10 -2.698 -6.997 4.459 1.00 0.00 C ATOM 1081 CG1 VAL B 10 -1.629 -6.179 5.189 1.00 0.00 C ATOM 1082 CG2 VAL B 10 -4.094 -6.754 5.080 1.00 0.00 C ATOM 0 H VAL B 10 -4.367 -7.907 2.870 1.00 0.00 H new ATOM 0 HA VAL B 10 -2.851 -5.553 2.877 1.00 0.00 H new ATOM 0 HB VAL B 10 -2.464 -8.056 4.565 1.00 0.00 H new ATOM 0 HG11 VAL B 10 -1.629 -6.442 6.247 1.00 0.00 H new ATOM 0 HG12 VAL B 10 -0.650 -6.396 4.762 1.00 0.00 H new ATOM 0 HG13 VAL B 10 -1.846 -5.116 5.079 1.00 0.00 H new ATOM 0 HG21 VAL B 10 -4.073 -7.020 6.137 1.00 0.00 H new ATOM 0 HG22 VAL B 10 -4.361 -5.702 4.976 1.00 0.00 H new ATOM 0 HG23 VAL B 10 -4.833 -7.368 4.566 1.00 0.00 H new ATOM 1092 N ILE B 11 -1.232 -8.267 1.944 1.00 0.00 N ATOM 1093 CA ILE B 11 -0.009 -8.728 1.303 1.00 0.00 C ATOM 1094 C ILE B 11 0.112 -8.121 -0.094 1.00 0.00 C ATOM 1095 O ILE B 11 1.201 -7.735 -0.498 1.00 0.00 O ATOM 1096 CB ILE B 11 0.030 -10.259 1.245 1.00 0.00 C ATOM 1097 CG1 ILE B 11 -0.153 -10.808 2.682 1.00 0.00 C ATOM 1098 CG2 ILE B 11 1.380 -10.712 0.657 1.00 0.00 C ATOM 1099 CD1 ILE B 11 0.702 -12.069 2.910 1.00 0.00 C ATOM 0 H ILE B 11 -1.949 -8.983 2.060 1.00 0.00 H new ATOM 0 HA ILE B 11 0.844 -8.398 1.896 1.00 0.00 H new ATOM 0 HB ILE B 11 -0.768 -10.641 0.609 1.00 0.00 H new ATOM 0 HG12 ILE B 11 0.125 -10.041 3.405 1.00 0.00 H new ATOM 0 HG13 ILE B 11 -1.204 -11.042 2.854 1.00 0.00 H new ATOM 0 HG21 ILE B 11 1.411 -11.801 0.614 1.00 0.00 H new ATOM 0 HG22 ILE B 11 1.494 -10.306 -0.348 1.00 0.00 H new ATOM 0 HG23 ILE B 11 2.192 -10.350 1.288 1.00 0.00 H new ATOM 0 HD11 ILE B 11 0.552 -12.431 3.927 1.00 0.00 H new ATOM 0 HD12 ILE B 11 0.405 -12.843 2.202 1.00 0.00 H new ATOM 0 HD13 ILE B 11 1.754 -11.827 2.762 1.00 0.00 H new ATOM 1111 N ALA B 12 -1.016 -8.020 -0.814 1.00 0.00 N ATOM 1112 CA ALA B 12 -1.018 -7.428 -2.148 1.00 0.00 C ATOM 1113 C ALA B 12 -0.699 -5.966 -2.046 1.00 0.00 C ATOM 1114 O ALA B 12 0.111 -5.465 -2.812 1.00 0.00 O ATOM 1115 CB ALA B 12 -2.384 -7.594 -2.800 1.00 0.00 C ATOM 0 H ALA B 12 -1.929 -8.340 -0.492 1.00 0.00 H new ATOM 0 HA ALA B 12 -0.268 -7.933 -2.756 1.00 0.00 H new ATOM 0 HB1 ALA B 12 -2.369 -7.147 -3.794 1.00 0.00 H new ATOM 0 HB2 ALA B 12 -2.621 -8.655 -2.882 1.00 0.00 H new ATOM 0 HB3 ALA B 12 -3.140 -7.099 -2.191 1.00 0.00 H new ATOM 1121 N ILE B 13 -1.301 -5.306 -1.057 1.00 0.00 N ATOM 1122 CA ILE B 13 -1.042 -3.898 -0.827 1.00 0.00 C ATOM 1123 C ILE B 13 0.452 -3.769 -0.617 1.00 0.00 C ATOM 1124 O ILE B 13 1.077 -2.856 -1.120 1.00 0.00 O ATOM 1125 CB ILE B 13 -1.801 -3.411 0.428 1.00 0.00 C ATOM 1126 CG1 ILE B 13 -3.319 -3.519 0.237 1.00 0.00 C ATOM 1127 CG2 ILE B 13 -1.482 -1.946 0.701 1.00 0.00 C ATOM 1128 CD1 ILE B 13 -4.007 -3.522 1.590 1.00 0.00 C ATOM 0 H ILE B 13 -1.967 -5.727 -0.409 1.00 0.00 H new ATOM 0 HA ILE B 13 -1.379 -3.292 -1.668 1.00 0.00 H new ATOM 0 HB ILE B 13 -1.484 -4.042 1.258 1.00 0.00 H new ATOM 0 HG12 ILE B 13 -3.680 -2.684 -0.363 1.00 0.00 H new ATOM 0 HG13 ILE B 13 -3.563 -4.431 -0.307 1.00 0.00 H new ATOM 0 HG21 ILE B 13 -2.023 -1.615 1.588 1.00 0.00 H new ATOM 0 HG22 ILE B 13 -0.411 -1.831 0.866 1.00 0.00 H new ATOM 0 HG23 ILE B 13 -1.784 -1.342 -0.155 1.00 0.00 H new ATOM 0 HD11 ILE B 13 -5.085 -3.599 1.450 1.00 0.00 H new ATOM 0 HD12 ILE B 13 -3.656 -4.372 2.175 1.00 0.00 H new ATOM 0 HD13 ILE B 13 -3.775 -2.597 2.118 1.00 0.00 H new ATOM 1140 N GLY B 14 1.004 -4.740 0.103 1.00 0.00 N ATOM 1141 CA GLY B 14 2.435 -4.794 0.371 1.00 0.00 C ATOM 1142 C GLY B 14 3.232 -5.135 -0.876 1.00 0.00 C ATOM 1143 O GLY B 14 4.321 -4.612 -1.081 1.00 0.00 O ATOM 0 H GLY B 14 0.474 -5.508 0.515 1.00 0.00 H new ATOM 0 HA2 GLY B 14 2.768 -3.833 0.763 1.00 0.00 H new ATOM 0 HA3 GLY B 14 2.632 -5.538 1.143 1.00 0.00 H new ATOM 1147 N GLU B 15 2.692 -6.032 -1.693 1.00 0.00 N ATOM 1148 CA GLU B 15 3.372 -6.468 -2.893 1.00 0.00 C ATOM 1149 C GLU B 15 3.534 -5.306 -3.834 1.00 0.00 C ATOM 1150 O GLU B 15 4.595 -5.141 -4.428 1.00 0.00 O ATOM 1151 CB GLU B 15 2.584 -7.595 -3.546 1.00 0.00 C ATOM 1152 CG GLU B 15 3.472 -8.360 -4.559 1.00 0.00 C ATOM 1153 CD GLU B 15 4.656 -9.033 -3.851 1.00 0.00 C ATOM 1154 OE1 GLU B 15 4.472 -9.524 -2.745 1.00 0.00 O ATOM 1155 OE2 GLU B 15 5.733 -9.039 -4.422 1.00 0.00 O ATOM 0 H GLU B 15 1.783 -6.469 -1.540 1.00 0.00 H new ATOM 0 HA GLU B 15 4.363 -6.844 -2.639 1.00 0.00 H new ATOM 0 HB2 GLU B 15 2.219 -8.282 -2.782 1.00 0.00 H new ATOM 0 HB3 GLU B 15 1.709 -7.189 -4.054 1.00 0.00 H new ATOM 0 HG2 GLU B 15 2.876 -9.113 -5.075 1.00 0.00 H new ATOM 0 HG3 GLU B 15 3.841 -7.670 -5.318 1.00 0.00 H new ATOM 1162 N ILE B 16 2.497 -4.474 -3.945 1.00 0.00 N ATOM 1163 CA ILE B 16 2.632 -3.300 -4.827 1.00 0.00 C ATOM 1164 C ILE B 16 3.829 -2.479 -4.334 1.00 0.00 C ATOM 1165 O ILE B 16 4.703 -2.079 -5.105 1.00 0.00 O ATOM 1166 CB ILE B 16 1.418 -2.331 -4.788 1.00 0.00 C ATOM 1167 CG1 ILE B 16 0.069 -3.049 -4.716 1.00 0.00 C ATOM 1168 CG2 ILE B 16 1.434 -1.455 -6.043 1.00 0.00 C ATOM 1169 CD1 ILE B 16 -0.159 -3.865 -5.974 1.00 0.00 C ATOM 0 H ILE B 16 1.601 -4.574 -3.468 1.00 0.00 H new ATOM 0 HA ILE B 16 2.731 -3.689 -5.840 1.00 0.00 H new ATOM 0 HB ILE B 16 1.521 -1.738 -3.879 1.00 0.00 H new ATOM 0 HG12 ILE B 16 0.042 -3.700 -3.842 1.00 0.00 H new ATOM 0 HG13 ILE B 16 -0.733 -2.320 -4.596 1.00 0.00 H new ATOM 0 HG21 ILE B 16 0.584 -0.773 -6.021 1.00 0.00 H new ATOM 0 HG22 ILE B 16 2.360 -0.881 -6.074 1.00 0.00 H new ATOM 0 HG23 ILE B 16 1.369 -2.087 -6.929 1.00 0.00 H new ATOM 0 HD11 ILE B 16 -1.122 -4.371 -5.910 1.00 0.00 H new ATOM 0 HD12 ILE B 16 -0.153 -3.205 -6.842 1.00 0.00 H new ATOM 0 HD13 ILE B 16 0.634 -4.606 -6.076 1.00 0.00 H new ATOM 1181 N MET B 17 3.826 -2.248 -3.026 1.00 0.00 N ATOM 1182 CA MET B 17 4.864 -1.487 -2.338 1.00 0.00 C ATOM 1183 C MET B 17 6.228 -2.189 -2.446 1.00 0.00 C ATOM 1184 O MET B 17 7.271 -1.533 -2.413 1.00 0.00 O ATOM 1185 CB MET B 17 4.444 -1.301 -0.886 1.00 0.00 C ATOM 1186 CG MET B 17 3.023 -0.728 -0.845 1.00 0.00 C ATOM 1187 SD MET B 17 3.035 0.966 -1.436 1.00 0.00 S ATOM 1188 CE MET B 17 4.031 1.624 -0.097 1.00 0.00 C ATOM 0 H MET B 17 3.092 -2.589 -2.404 1.00 0.00 H new ATOM 0 HA MET B 17 4.978 -0.510 -2.808 1.00 0.00 H new ATOM 0 HB2 MET B 17 4.480 -2.254 -0.359 1.00 0.00 H new ATOM 0 HB3 MET B 17 5.135 -0.629 -0.378 1.00 0.00 H new ATOM 0 HG2 MET B 17 2.359 -1.333 -1.462 1.00 0.00 H new ATOM 0 HG3 MET B 17 2.635 -0.765 0.173 1.00 0.00 H new ATOM 0 HE1 MET B 17 3.564 2.528 0.294 1.00 0.00 H new ATOM 0 HE2 MET B 17 4.108 0.882 0.698 1.00 0.00 H new ATOM 0 HE3 MET B 17 5.028 1.862 -0.468 1.00 0.00 H new ATOM 1198 N ARG B 18 6.218 -3.520 -2.597 1.00 0.00 N ATOM 1199 CA ARG B 18 7.464 -4.277 -2.748 1.00 0.00 C ATOM 1200 C ARG B 18 8.090 -3.981 -4.105 1.00 0.00 C ATOM 1201 O ARG B 18 9.313 -3.909 -4.233 1.00 0.00 O ATOM 1202 CB ARG B 18 7.206 -5.778 -2.645 1.00 0.00 C ATOM 1203 CG ARG B 18 6.882 -6.174 -1.203 1.00 0.00 C ATOM 1204 CD ARG B 18 8.152 -6.616 -0.466 1.00 0.00 C ATOM 1205 NE ARG B 18 8.600 -7.923 -0.949 1.00 0.00 N ATOM 1206 CZ ARG B 18 7.849 -9.010 -0.805 1.00 0.00 C ATOM 1207 NH1 ARG B 18 7.854 -9.666 0.320 1.00 0.00 N ATOM 1208 NH2 ARG B 18 7.107 -9.419 -1.792 1.00 0.00 N ATOM 0 H ARG B 18 5.371 -4.088 -2.618 1.00 0.00 H new ATOM 0 HA ARG B 18 8.140 -3.974 -1.948 1.00 0.00 H new ATOM 0 HB2 ARG B 18 6.379 -6.055 -3.298 1.00 0.00 H new ATOM 0 HB3 ARG B 18 8.082 -6.327 -2.990 1.00 0.00 H new ATOM 0 HG2 ARG B 18 6.428 -5.331 -0.682 1.00 0.00 H new ATOM 0 HG3 ARG B 18 6.152 -6.983 -1.198 1.00 0.00 H new ATOM 0 HD2 ARG B 18 8.940 -5.878 -0.614 1.00 0.00 H new ATOM 0 HD3 ARG B 18 7.959 -6.665 0.606 1.00 0.00 H new ATOM 0 HE ARG B 18 9.508 -8.001 -1.406 1.00 0.00 H new ATOM 0 HH11 ARG B 18 8.436 -9.346 1.094 1.00 0.00 H new ATOM 0 HH12 ARG B 18 7.276 -10.500 0.427 1.00 0.00 H new ATOM 0 HH21 ARG B 18 7.103 -8.906 -2.673 1.00 0.00 H new ATOM 0 HH22 ARG B 18 6.530 -10.253 -1.684 1.00 0.00 H new ATOM 1222 N LEU B 19 7.228 -3.820 -5.117 1.00 0.00 N ATOM 1223 CA LEU B 19 7.675 -3.544 -6.481 1.00 0.00 C ATOM 1224 C LEU B 19 8.420 -2.215 -6.552 1.00 0.00 C ATOM 1225 O LEU B 19 7.820 -1.156 -6.378 1.00 0.00 O ATOM 1226 CB LEU B 19 6.474 -3.487 -7.431 1.00 0.00 C ATOM 1227 CG LEU B 19 5.696 -4.806 -7.441 1.00 0.00 C ATOM 1228 CD1 LEU B 19 4.401 -4.623 -8.225 1.00 0.00 C ATOM 1229 CD2 LEU B 19 6.515 -5.894 -8.110 1.00 0.00 C ATOM 0 H LEU B 19 6.215 -3.877 -5.012 1.00 0.00 H new ATOM 0 HA LEU B 19 8.347 -4.349 -6.779 1.00 0.00 H new ATOM 0 HB2 LEU B 19 5.811 -2.676 -7.131 1.00 0.00 H new ATOM 0 HB3 LEU B 19 6.819 -3.260 -8.440 1.00 0.00 H new ATOM 0 HG LEU B 19 5.481 -5.093 -6.412 1.00 0.00 H new ATOM 0 HD11 LEU B 19 3.845 -5.561 -8.234 1.00 0.00 H new ATOM 0 HD12 LEU B 19 3.797 -3.848 -7.754 1.00 0.00 H new ATOM 0 HD13 LEU B 19 4.634 -4.330 -9.249 1.00 0.00 H new ATOM 0 HD21 LEU B 19 5.950 -6.826 -8.110 1.00 0.00 H new ATOM 0 HD22 LEU B 19 6.736 -5.603 -9.137 1.00 0.00 H new ATOM 0 HD23 LEU B 19 7.448 -6.035 -7.564 1.00 0.00 H new ATOM 1241 N PRO B 20 9.709 -2.246 -6.807 1.00 0.00 N ATOM 1242 CA PRO B 20 10.537 -1.015 -6.900 1.00 0.00 C ATOM 1243 C PRO B 20 10.388 -0.280 -8.237 1.00 0.00 C ATOM 1244 O PRO B 20 10.842 0.859 -8.366 1.00 0.00 O ATOM 1245 CB PRO B 20 11.977 -1.528 -6.721 1.00 0.00 C ATOM 1246 CG PRO B 20 11.900 -3.006 -6.529 1.00 0.00 C ATOM 1247 CD PRO B 20 10.539 -3.440 -7.036 1.00 0.00 C ATOM 0 HA PRO B 20 10.234 -0.281 -6.154 1.00 0.00 H new ATOM 0 HB2 PRO B 20 12.583 -1.285 -7.594 1.00 0.00 H new ATOM 0 HB3 PRO B 20 12.450 -1.053 -5.862 1.00 0.00 H new ATOM 0 HG2 PRO B 20 12.696 -3.510 -7.077 1.00 0.00 H new ATOM 0 HG3 PRO B 20 12.023 -3.267 -5.478 1.00 0.00 H new ATOM 0 HD2 PRO B 20 10.569 -3.715 -8.090 1.00 0.00 H new ATOM 0 HD3 PRO B 20 10.162 -4.305 -6.491 1.00 0.00 H new ATOM 1255 N ASN B 21 9.776 -0.932 -9.235 1.00 0.00 N ATOM 1256 CA ASN B 21 9.616 -0.312 -10.551 1.00 0.00 C ATOM 1257 C ASN B 21 8.310 0.478 -10.649 1.00 0.00 C ATOM 1258 O ASN B 21 8.182 1.351 -11.510 1.00 0.00 O ATOM 1259 CB ASN B 21 9.664 -1.377 -11.649 1.00 0.00 C ATOM 1260 CG ASN B 21 10.953 -2.193 -11.550 1.00 0.00 C ATOM 1261 OD1 ASN B 21 12.012 -1.658 -11.222 1.00 0.00 O ATOM 1262 ND2 ASN B 21 10.924 -3.464 -11.828 1.00 0.00 N ATOM 0 H ASN B 21 9.390 -1.873 -9.156 1.00 0.00 H new ATOM 0 HA ASN B 21 10.442 0.386 -10.687 1.00 0.00 H new ATOM 0 HB2 ASN B 21 8.801 -2.037 -11.561 1.00 0.00 H new ATOM 0 HB3 ASN B 21 9.602 -0.901 -12.628 1.00 0.00 H new ATOM 0 HD21 ASN B 21 11.779 -4.017 -11.774 1.00 0.00 H new ATOM 0 HD22 ASN B 21 10.046 -3.907 -12.100 1.00 0.00 H new ATOM 1269 N LEU B 22 7.337 0.175 -9.776 1.00 0.00 N ATOM 1270 CA LEU B 22 6.059 0.889 -9.814 1.00 0.00 C ATOM 1271 C LEU B 22 6.190 2.316 -9.307 1.00 0.00 C ATOM 1272 O LEU B 22 6.999 2.615 -8.427 1.00 0.00 O ATOM 1273 CB LEU B 22 4.985 0.198 -8.954 1.00 0.00 C ATOM 1274 CG LEU B 22 4.689 -1.223 -9.425 1.00 0.00 C ATOM 1275 CD1 LEU B 22 3.371 -1.701 -8.805 1.00 0.00 C ATOM 1276 CD2 LEU B 22 4.558 -1.235 -10.927 1.00 0.00 C ATOM 0 H LEU B 22 7.409 -0.541 -9.054 1.00 0.00 H new ATOM 0 HA LEU B 22 5.761 0.886 -10.862 1.00 0.00 H new ATOM 0 HB2 LEU B 22 5.316 0.172 -7.916 1.00 0.00 H new ATOM 0 HB3 LEU B 22 4.067 0.786 -8.982 1.00 0.00 H new ATOM 0 HG LEU B 22 5.501 -1.883 -9.120 1.00 0.00 H new ATOM 0 HD11 LEU B 22 3.158 -2.716 -9.141 1.00 0.00 H new ATOM 0 HD12 LEU B 22 3.454 -1.688 -7.718 1.00 0.00 H new ATOM 0 HD13 LEU B 22 2.562 -1.039 -9.115 1.00 0.00 H new ATOM 0 HD21 LEU B 22 4.347 -2.249 -11.266 1.00 0.00 H new ATOM 0 HD22 LEU B 22 3.744 -0.575 -11.226 1.00 0.00 H new ATOM 0 HD23 LEU B 22 5.489 -0.889 -11.376 1.00 0.00 H new ATOM 1288 N ASN B 23 5.336 3.175 -9.850 1.00 0.00 N ATOM 1289 CA ASN B 23 5.272 4.567 -9.452 1.00 0.00 C ATOM 1290 C ASN B 23 4.465 4.638 -8.156 1.00 0.00 C ATOM 1291 O ASN B 23 3.634 3.768 -7.910 1.00 0.00 O ATOM 1292 CB ASN B 23 4.557 5.327 -10.581 1.00 0.00 C ATOM 1293 CG ASN B 23 4.356 6.788 -10.265 1.00 0.00 C ATOM 1294 OD1 ASN B 23 3.716 7.130 -9.288 1.00 0.00 O ATOM 1295 ND2 ASN B 23 4.827 7.664 -11.081 1.00 0.00 N ATOM 0 H ASN B 23 4.669 2.921 -10.579 1.00 0.00 H new ATOM 0 HA ASN B 23 6.257 5.003 -9.285 1.00 0.00 H new ATOM 0 HB2 ASN B 23 5.137 5.235 -11.499 1.00 0.00 H new ATOM 0 HB3 ASN B 23 3.588 4.864 -10.768 1.00 0.00 H new ATOM 0 HD21 ASN B 23 4.665 8.657 -10.912 1.00 0.00 H new ATOM 0 HD22 ASN B 23 5.362 7.366 -11.897 1.00 0.00 H new ATOM 1302 N SER B 24 4.674 5.673 -7.345 1.00 0.00 N ATOM 1303 CA SER B 24 3.911 5.806 -6.101 1.00 0.00 C ATOM 1304 C SER B 24 2.427 5.906 -6.440 1.00 0.00 C ATOM 1305 O SER B 24 1.583 5.269 -5.812 1.00 0.00 O ATOM 1306 CB SER B 24 4.359 7.042 -5.317 1.00 0.00 C ATOM 1307 OG SER B 24 5.344 7.753 -6.059 1.00 0.00 O ATOM 0 H SER B 24 5.349 6.418 -7.519 1.00 0.00 H new ATOM 0 HA SER B 24 4.089 4.931 -5.476 1.00 0.00 H new ATOM 0 HB2 SER B 24 3.504 7.688 -5.119 1.00 0.00 H new ATOM 0 HB3 SER B 24 4.764 6.744 -4.350 1.00 0.00 H new ATOM 0 HG SER B 24 6.190 7.751 -5.565 1.00 0.00 H new ATOM 1313 N LEU B 25 2.142 6.689 -7.474 1.00 0.00 N ATOM 1314 CA LEU B 25 0.789 6.868 -7.969 1.00 0.00 C ATOM 1315 C LEU B 25 0.285 5.585 -8.608 1.00 0.00 C ATOM 1316 O LEU B 25 -0.876 5.217 -8.432 1.00 0.00 O ATOM 1317 CB LEU B 25 0.741 8.012 -8.990 1.00 0.00 C ATOM 1318 CG LEU B 25 0.231 9.268 -8.325 1.00 0.00 C ATOM 1319 CD1 LEU B 25 0.342 10.455 -9.292 1.00 0.00 C ATOM 1320 CD2 LEU B 25 -1.220 9.026 -7.925 1.00 0.00 C ATOM 0 H LEU B 25 2.846 7.217 -7.991 1.00 0.00 H new ATOM 0 HA LEU B 25 0.145 7.119 -7.126 1.00 0.00 H new ATOM 0 HB2 LEU B 25 1.735 8.186 -9.403 1.00 0.00 H new ATOM 0 HB3 LEU B 25 0.093 7.741 -9.823 1.00 0.00 H new ATOM 0 HG LEU B 25 0.823 9.506 -7.441 1.00 0.00 H new ATOM 0 HD11 LEU B 25 -0.028 11.357 -8.805 1.00 0.00 H new ATOM 0 HD12 LEU B 25 1.385 10.597 -9.575 1.00 0.00 H new ATOM 0 HD13 LEU B 25 -0.252 10.255 -10.184 1.00 0.00 H new ATOM 0 HD21 LEU B 25 -1.618 9.918 -7.441 1.00 0.00 H new ATOM 0 HD22 LEU B 25 -1.810 8.802 -8.814 1.00 0.00 H new ATOM 0 HD23 LEU B 25 -1.271 8.185 -7.234 1.00 0.00 H new ATOM 1332 N GLN B 26 1.175 4.889 -9.320 1.00 0.00 N ATOM 1333 CA GLN B 26 0.798 3.617 -9.941 1.00 0.00 C ATOM 1334 C GLN B 26 0.447 2.634 -8.843 1.00 0.00 C ATOM 1335 O GLN B 26 -0.479 1.836 -8.961 1.00 0.00 O ATOM 1336 CB GLN B 26 1.959 3.018 -10.735 1.00 0.00 C ATOM 1337 CG GLN B 26 1.980 3.516 -12.185 1.00 0.00 C ATOM 1338 CD GLN B 26 3.204 2.947 -12.894 1.00 0.00 C ATOM 1339 OE1 GLN B 26 3.428 3.226 -14.071 1.00 0.00 O ATOM 1340 NE2 GLN B 26 4.011 2.148 -12.245 1.00 0.00 N ATOM 0 H GLN B 26 2.141 5.176 -9.479 1.00 0.00 H new ATOM 0 HA GLN B 26 -0.040 3.801 -10.613 1.00 0.00 H new ATOM 0 HB2 GLN B 26 2.901 3.275 -10.250 1.00 0.00 H new ATOM 0 HB3 GLN B 26 1.882 1.931 -10.726 1.00 0.00 H new ATOM 0 HG2 GLN B 26 1.070 3.208 -12.701 1.00 0.00 H new ATOM 0 HG3 GLN B 26 2.006 4.605 -12.207 1.00 0.00 H new ATOM 0 HE21 GLN B 26 3.824 1.917 -11.269 1.00 0.00 H new ATOM 0 HE22 GLN B 26 4.827 1.756 -12.715 1.00 0.00 H new ATOM 1349 N VAL B 27 1.216 2.726 -7.770 1.00 0.00 N ATOM 1350 CA VAL B 27 1.031 1.876 -6.617 1.00 0.00 C ATOM 1351 C VAL B 27 -0.306 2.177 -5.987 1.00 0.00 C ATOM 1352 O VAL B 27 -1.081 1.269 -5.715 1.00 0.00 O ATOM 1353 CB VAL B 27 2.213 2.072 -5.660 1.00 0.00 C ATOM 1354 CG1 VAL B 27 1.926 1.465 -4.282 1.00 0.00 C ATOM 1355 CG2 VAL B 27 3.430 1.380 -6.286 1.00 0.00 C ATOM 0 H VAL B 27 1.983 3.392 -7.679 1.00 0.00 H new ATOM 0 HA VAL B 27 1.017 0.823 -6.897 1.00 0.00 H new ATOM 0 HB VAL B 27 2.393 3.137 -5.514 1.00 0.00 H new ATOM 0 HG11 VAL B 27 2.785 1.622 -3.629 1.00 0.00 H new ATOM 0 HG12 VAL B 27 1.048 1.945 -3.849 1.00 0.00 H new ATOM 0 HG13 VAL B 27 1.741 0.396 -4.387 1.00 0.00 H new ATOM 0 HG21 VAL B 27 4.293 1.499 -5.631 1.00 0.00 H new ATOM 0 HG22 VAL B 27 3.218 0.319 -6.417 1.00 0.00 H new ATOM 0 HG23 VAL B 27 3.646 1.830 -7.255 1.00 0.00 H new ATOM 1365 N VAL B 28 -0.599 3.460 -5.832 1.00 0.00 N ATOM 1366 CA VAL B 28 -1.876 3.880 -5.314 1.00 0.00 C ATOM 1367 C VAL B 28 -2.969 3.376 -6.262 1.00 0.00 C ATOM 1368 O VAL B 28 -4.056 3.022 -5.829 1.00 0.00 O ATOM 1369 CB VAL B 28 -1.924 5.409 -5.199 1.00 0.00 C ATOM 1370 CG1 VAL B 28 -3.301 5.831 -4.680 1.00 0.00 C ATOM 1371 CG2 VAL B 28 -0.827 5.896 -4.231 1.00 0.00 C ATOM 0 H VAL B 28 0.037 4.224 -6.061 1.00 0.00 H new ATOM 0 HA VAL B 28 -2.032 3.465 -4.318 1.00 0.00 H new ATOM 0 HB VAL B 28 -1.752 5.854 -6.179 1.00 0.00 H new ATOM 0 HG11 VAL B 28 -3.341 6.917 -4.596 1.00 0.00 H new ATOM 0 HG12 VAL B 28 -4.071 5.492 -5.373 1.00 0.00 H new ATOM 0 HG13 VAL B 28 -3.473 5.385 -3.700 1.00 0.00 H new ATOM 0 HG21 VAL B 28 -0.866 6.983 -4.154 1.00 0.00 H new ATOM 0 HG22 VAL B 28 -0.989 5.456 -3.247 1.00 0.00 H new ATOM 0 HG23 VAL B 28 0.150 5.594 -4.607 1.00 0.00 H new ATOM 1381 N ALA B 29 -2.652 3.335 -7.561 1.00 0.00 N ATOM 1382 CA ALA B 29 -3.592 2.860 -8.569 1.00 0.00 C ATOM 1383 C ALA B 29 -4.003 1.432 -8.246 1.00 0.00 C ATOM 1384 O ALA B 29 -5.186 1.086 -8.291 1.00 0.00 O ATOM 1385 CB ALA B 29 -2.934 2.901 -9.957 1.00 0.00 C ATOM 0 H ALA B 29 -1.749 3.627 -7.934 1.00 0.00 H new ATOM 0 HA ALA B 29 -4.472 3.503 -8.570 1.00 0.00 H new ATOM 0 HB1 ALA B 29 -3.642 2.545 -10.706 1.00 0.00 H new ATOM 0 HB2 ALA B 29 -2.642 3.925 -10.191 1.00 0.00 H new ATOM 0 HB3 ALA B 29 -2.051 2.262 -9.960 1.00 0.00 H new ATOM 1391 N PHE B 30 -3.010 0.615 -7.898 1.00 0.00 N ATOM 1392 CA PHE B 30 -3.242 -0.749 -7.551 1.00 0.00 C ATOM 1393 C PHE B 30 -3.872 -0.840 -6.169 1.00 0.00 C ATOM 1394 O PHE B 30 -4.850 -1.551 -6.001 1.00 0.00 O ATOM 1395 CB PHE B 30 -1.902 -1.496 -7.632 1.00 0.00 C ATOM 1396 CG PHE B 30 -1.398 -1.462 -9.069 1.00 0.00 C ATOM 1397 CD1 PHE B 30 -2.210 -1.928 -10.123 1.00 0.00 C ATOM 1398 CD2 PHE B 30 -0.130 -0.924 -9.360 1.00 0.00 C ATOM 1399 CE1 PHE B 30 -1.753 -1.849 -11.437 1.00 0.00 C ATOM 1400 CE2 PHE B 30 0.314 -0.859 -10.675 1.00 0.00 C ATOM 1401 CZ PHE B 30 -0.497 -1.318 -11.714 1.00 0.00 C ATOM 0 H PHE B 30 -2.031 0.898 -7.855 1.00 0.00 H new ATOM 0 HA PHE B 30 -3.944 -1.213 -8.244 1.00 0.00 H new ATOM 0 HB2 PHE B 30 -1.173 -1.033 -6.967 1.00 0.00 H new ATOM 0 HB3 PHE B 30 -2.026 -2.527 -7.301 1.00 0.00 H new ATOM 0 HD1 PHE B 30 -3.184 -2.345 -9.913 1.00 0.00 H new ATOM 0 HD2 PHE B 30 0.498 -0.561 -8.560 1.00 0.00 H new ATOM 0 HE1 PHE B 30 -2.377 -2.202 -12.245 1.00 0.00 H new ATOM 0 HE2 PHE B 30 1.290 -0.452 -10.894 1.00 0.00 H new ATOM 0 HZ PHE B 30 -0.149 -1.261 -12.735 1.00 0.00 H new ATOM 1411 N ILE B 31 -3.352 -0.080 -5.193 1.00 0.00 N ATOM 1412 CA ILE B 31 -3.921 -0.104 -3.839 1.00 0.00 C ATOM 1413 C ILE B 31 -5.394 0.282 -3.901 1.00 0.00 C ATOM 1414 O ILE B 31 -6.250 -0.396 -3.338 1.00 0.00 O ATOM 1415 CB ILE B 31 -3.168 0.868 -2.911 1.00 0.00 C ATOM 1416 CG1 ILE B 31 -1.690 0.453 -2.777 1.00 0.00 C ATOM 1417 CG2 ILE B 31 -3.809 0.848 -1.515 1.00 0.00 C ATOM 1418 CD1 ILE B 31 -0.893 1.620 -2.182 1.00 0.00 C ATOM 0 H ILE B 31 -2.555 0.546 -5.312 1.00 0.00 H new ATOM 0 HA ILE B 31 -3.820 -1.112 -3.436 1.00 0.00 H new ATOM 0 HB ILE B 31 -3.226 1.868 -3.341 1.00 0.00 H new ATOM 0 HG12 ILE B 31 -1.603 -0.426 -2.139 1.00 0.00 H new ATOM 0 HG13 ILE B 31 -1.286 0.180 -3.752 1.00 0.00 H new ATOM 0 HG21 ILE B 31 -3.275 1.536 -0.860 1.00 0.00 H new ATOM 0 HG22 ILE B 31 -4.853 1.154 -1.589 1.00 0.00 H new ATOM 0 HG23 ILE B 31 -3.755 -0.160 -1.104 1.00 0.00 H new ATOM 0 HD11 ILE B 31 0.154 1.333 -2.084 1.00 0.00 H new ATOM 0 HD12 ILE B 31 -0.972 2.487 -2.838 1.00 0.00 H new ATOM 0 HD13 ILE B 31 -1.294 1.871 -1.200 1.00 0.00 H new ATOM 1430 N ASN B 32 -5.677 1.355 -4.618 1.00 0.00 N ATOM 1431 CA ASN B 32 -7.042 1.815 -4.792 1.00 0.00 C ATOM 1432 C ASN B 32 -7.881 0.727 -5.466 1.00 0.00 C ATOM 1433 O ASN B 32 -9.080 0.630 -5.223 1.00 0.00 O ATOM 1434 CB ASN B 32 -7.051 3.082 -5.651 1.00 0.00 C ATOM 1435 CG ASN B 32 -8.404 3.786 -5.590 1.00 0.00 C ATOM 1436 OD1 ASN B 32 -9.312 3.366 -4.870 1.00 0.00 O ATOM 1437 ND2 ASN B 32 -8.583 4.850 -6.313 1.00 0.00 N ATOM 0 H ASN B 32 -4.976 1.926 -5.091 1.00 0.00 H new ATOM 0 HA ASN B 32 -7.471 2.037 -3.815 1.00 0.00 H new ATOM 0 HB2 ASN B 32 -6.270 3.761 -5.309 1.00 0.00 H new ATOM 0 HB3 ASN B 32 -6.819 2.825 -6.684 1.00 0.00 H new ATOM 0 HD21 ASN B 32 -9.477 5.341 -6.286 1.00 0.00 H new ATOM 0 HD22 ASN B 32 -7.830 5.195 -6.908 1.00 0.00 H new ATOM 1444 N SER B 33 -7.235 -0.104 -6.299 1.00 0.00 N ATOM 1445 CA SER B 33 -7.924 -1.178 -6.972 1.00 0.00 C ATOM 1446 C SER B 33 -8.122 -2.335 -5.994 1.00 0.00 C ATOM 1447 O SER B 33 -9.117 -3.051 -6.076 1.00 0.00 O ATOM 1448 CB SER B 33 -7.188 -1.569 -8.249 1.00 0.00 C ATOM 1449 OG SER B 33 -7.498 -0.632 -9.271 1.00 0.00 O ATOM 0 H SER B 33 -6.239 -0.040 -6.512 1.00 0.00 H new ATOM 0 HA SER B 33 -8.915 -0.857 -7.293 1.00 0.00 H new ATOM 0 HB2 SER B 33 -6.113 -1.590 -8.072 1.00 0.00 H new ATOM 0 HB3 SER B 33 -7.479 -2.573 -8.558 1.00 0.00 H new ATOM 0 HG SER B 33 -6.883 0.129 -9.214 1.00 0.00 H new ATOM 1455 N LEU B 34 -7.206 -2.462 -5.009 1.00 0.00 N ATOM 1456 CA LEU B 34 -7.366 -3.479 -3.960 1.00 0.00 C ATOM 1457 C LEU B 34 -8.651 -3.101 -3.236 1.00 0.00 C ATOM 1458 O LEU B 34 -9.505 -3.933 -2.931 1.00 0.00 O ATOM 1459 CB LEU B 34 -6.175 -3.454 -2.967 1.00 0.00 C ATOM 1460 CG LEU B 34 -4.849 -3.687 -3.713 1.00 0.00 C ATOM 1461 CD1 LEU B 34 -3.651 -3.581 -2.784 1.00 0.00 C ATOM 1462 CD2 LEU B 34 -4.854 -5.067 -4.303 1.00 0.00 C ATOM 0 H LEU B 34 -6.369 -1.886 -4.923 1.00 0.00 H new ATOM 0 HA LEU B 34 -7.401 -4.483 -4.382 1.00 0.00 H new ATOM 0 HB2 LEU B 34 -6.145 -2.495 -2.450 1.00 0.00 H new ATOM 0 HB3 LEU B 34 -6.311 -4.223 -2.206 1.00 0.00 H new ATOM 0 HG LEU B 34 -4.765 -2.921 -4.484 1.00 0.00 H new ATOM 0 HD11 LEU B 34 -2.735 -3.752 -3.350 1.00 0.00 H new ATOM 0 HD12 LEU B 34 -3.622 -2.586 -2.339 1.00 0.00 H new ATOM 0 HD13 LEU B 34 -3.735 -4.329 -1.995 1.00 0.00 H new ATOM 0 HD21 LEU B 34 -3.917 -5.239 -4.833 1.00 0.00 H new ATOM 0 HD22 LEU B 34 -4.961 -5.803 -3.506 1.00 0.00 H new ATOM 0 HD23 LEU B 34 -5.688 -5.162 -4.999 1.00 0.00 H new ATOM 1474 N ARG B 35 -8.768 -1.791 -3.044 1.00 0.00 N ATOM 1475 CA ARG B 35 -9.948 -1.157 -2.435 1.00 0.00 C ATOM 1476 C ARG B 35 -11.184 -1.418 -3.292 1.00 0.00 C ATOM 1477 O ARG B 35 -12.237 -1.813 -2.788 1.00 0.00 O ATOM 1478 CB ARG B 35 -9.697 0.366 -2.380 1.00 0.00 C ATOM 1479 CG ARG B 35 -9.978 0.944 -0.985 1.00 0.00 C ATOM 1480 CD ARG B 35 -8.853 1.911 -0.596 1.00 0.00 C ATOM 1481 NE ARG B 35 -8.655 1.907 0.847 1.00 0.00 N ATOM 1482 CZ ARG B 35 -9.429 2.629 1.647 1.00 0.00 C ATOM 1483 NH1 ARG B 35 -10.562 2.146 2.065 1.00 0.00 N ATOM 1484 NH2 ARG B 35 -9.054 3.822 2.013 1.00 0.00 N ATOM 0 H ARG B 35 -8.041 -1.126 -3.308 1.00 0.00 H new ATOM 0 HA ARG B 35 -10.112 -1.565 -1.438 1.00 0.00 H new ATOM 0 HB2 ARG B 35 -8.664 0.574 -2.657 1.00 0.00 H new ATOM 0 HB3 ARG B 35 -10.330 0.865 -3.114 1.00 0.00 H new ATOM 0 HG2 ARG B 35 -10.936 1.464 -0.981 1.00 0.00 H new ATOM 0 HG3 ARG B 35 -10.049 0.139 -0.254 1.00 0.00 H new ATOM 0 HD2 ARG B 35 -7.929 1.624 -1.097 1.00 0.00 H new ATOM 0 HD3 ARG B 35 -9.098 2.918 -0.933 1.00 0.00 H new ATOM 0 HE ARG B 35 -7.909 1.340 1.249 1.00 0.00 H new ATOM 0 HH11 ARG B 35 -10.855 1.212 1.778 1.00 0.00 H new ATOM 0 HH12 ARG B 35 -11.157 2.701 2.680 1.00 0.00 H new ATOM 0 HH21 ARG B 35 -8.166 4.201 1.684 1.00 0.00 H new ATOM 0 HH22 ARG B 35 -9.649 4.377 2.628 1.00 0.00 H new ATOM 1498 N ASP B 36 -11.027 -1.181 -4.592 1.00 0.00 N ATOM 1499 CA ASP B 36 -12.104 -1.369 -5.557 1.00 0.00 C ATOM 1500 C ASP B 36 -12.537 -2.830 -5.615 1.00 0.00 C ATOM 1501 O ASP B 36 -13.724 -3.132 -5.762 1.00 0.00 O ATOM 1502 CB ASP B 36 -11.616 -0.923 -6.944 1.00 0.00 C ATOM 1503 CG ASP B 36 -11.299 0.583 -6.970 1.00 0.00 C ATOM 1504 OD1 ASP B 36 -11.837 1.315 -6.152 1.00 0.00 O ATOM 1505 OD2 ASP B 36 -10.517 0.983 -7.818 1.00 0.00 O ATOM 0 H ASP B 36 -10.153 -0.855 -5.004 1.00 0.00 H new ATOM 0 HA ASP B 36 -12.961 -0.771 -5.247 1.00 0.00 H new ATOM 0 HB2 ASP B 36 -10.725 -1.489 -7.217 1.00 0.00 H new ATOM 0 HB3 ASP B 36 -12.378 -1.149 -7.690 1.00 0.00 H new ATOM 1510 N ASP B 37 -11.559 -3.727 -5.507 1.00 0.00 N ATOM 1511 CA ASP B 37 -11.821 -5.159 -5.558 1.00 0.00 C ATOM 1512 C ASP B 37 -10.858 -5.920 -4.663 1.00 0.00 C ATOM 1513 O ASP B 37 -9.779 -6.339 -5.099 1.00 0.00 O ATOM 1514 CB ASP B 37 -11.696 -5.658 -7.003 1.00 0.00 C ATOM 1515 CG ASP B 37 -13.055 -5.612 -7.699 1.00 0.00 C ATOM 1516 OD1 ASP B 37 -13.778 -6.591 -7.610 1.00 0.00 O ATOM 1517 OD2 ASP B 37 -13.351 -4.600 -8.312 1.00 0.00 O ATOM 0 H ASP B 37 -10.576 -3.484 -5.383 1.00 0.00 H new ATOM 0 HA ASP B 37 -12.834 -5.336 -5.198 1.00 0.00 H new ATOM 0 HB2 ASP B 37 -10.980 -5.042 -7.547 1.00 0.00 H new ATOM 0 HB3 ASP B 37 -11.310 -6.677 -7.011 1.00 0.00 H new ATOM 1522 N PRO B 38 -11.240 -6.130 -3.429 1.00 0.00 N ATOM 1523 CA PRO B 38 -10.410 -6.887 -2.468 1.00 0.00 C ATOM 1524 C PRO B 38 -10.300 -8.354 -2.868 1.00 0.00 C ATOM 1525 O PRO B 38 -9.302 -9.017 -2.576 1.00 0.00 O ATOM 1526 CB PRO B 38 -11.111 -6.732 -1.125 1.00 0.00 C ATOM 1527 CG PRO B 38 -12.308 -5.857 -1.330 1.00 0.00 C ATOM 1528 CD PRO B 38 -12.503 -5.669 -2.830 1.00 0.00 C ATOM 0 HA PRO B 38 -9.387 -6.512 -2.435 1.00 0.00 H new ATOM 0 HB2 PRO B 38 -11.412 -7.705 -0.737 1.00 0.00 H new ATOM 0 HB3 PRO B 38 -10.437 -6.291 -0.391 1.00 0.00 H new ATOM 0 HG2 PRO B 38 -13.193 -6.312 -0.885 1.00 0.00 H new ATOM 0 HG3 PRO B 38 -12.164 -4.894 -0.841 1.00 0.00 H new ATOM 0 HD2 PRO B 38 -13.350 -6.249 -3.195 1.00 0.00 H new ATOM 0 HD3 PRO B 38 -12.701 -4.626 -3.076 1.00 0.00 H new ATOM 1536 N SER B 39 -11.328 -8.838 -3.568 1.00 0.00 N ATOM 1537 CA SER B 39 -11.344 -10.212 -4.044 1.00 0.00 C ATOM 1538 C SER B 39 -10.276 -10.369 -5.111 1.00 0.00 C ATOM 1539 O SER B 39 -9.564 -11.373 -5.157 1.00 0.00 O ATOM 1540 CB SER B 39 -12.719 -10.556 -4.623 1.00 0.00 C ATOM 1541 OG SER B 39 -12.754 -11.935 -4.974 1.00 0.00 O ATOM 0 H SER B 39 -12.156 -8.296 -3.815 1.00 0.00 H new ATOM 0 HA SER B 39 -11.142 -10.890 -3.215 1.00 0.00 H new ATOM 0 HB2 SER B 39 -13.498 -10.335 -3.893 1.00 0.00 H new ATOM 0 HB3 SER B 39 -12.920 -9.941 -5.500 1.00 0.00 H new ATOM 0 HG SER B 39 -13.634 -12.156 -5.343 1.00 0.00 H new ATOM 1547 N GLN B 40 -10.170 -9.341 -5.959 1.00 0.00 N ATOM 1548 CA GLN B 40 -9.189 -9.327 -7.025 1.00 0.00 C ATOM 1549 C GLN B 40 -7.975 -8.514 -6.618 1.00 0.00 C ATOM 1550 O GLN B 40 -7.264 -7.997 -7.475 1.00 0.00 O ATOM 1551 CB GLN B 40 -9.778 -8.787 -8.337 1.00 0.00 C ATOM 1552 CG GLN B 40 -11.309 -8.964 -8.374 1.00 0.00 C ATOM 1553 CD GLN B 40 -11.885 -8.255 -9.597 1.00 0.00 C ATOM 1554 OE1 GLN B 40 -12.710 -8.819 -10.314 1.00 0.00 O ATOM 1555 NE2 GLN B 40 -11.493 -7.046 -9.875 1.00 0.00 N ATOM 0 H GLN B 40 -10.759 -8.509 -5.919 1.00 0.00 H new ATOM 0 HA GLN B 40 -8.883 -10.358 -7.201 1.00 0.00 H new ATOM 0 HB2 GLN B 40 -9.528 -7.731 -8.444 1.00 0.00 H new ATOM 0 HB3 GLN B 40 -9.328 -9.308 -9.182 1.00 0.00 H new ATOM 0 HG2 GLN B 40 -11.561 -10.024 -8.406 1.00 0.00 H new ATOM 0 HG3 GLN B 40 -11.753 -8.558 -7.465 1.00 0.00 H new ATOM 0 HE21 GLN B 40 -10.809 -6.582 -9.278 1.00 0.00 H new ATOM 0 HE22 GLN B 40 -11.870 -6.562 -10.690 1.00 0.00 H new ATOM 1564 N SER B 41 -7.710 -8.421 -5.307 1.00 0.00 N ATOM 1565 CA SER B 41 -6.542 -7.692 -4.847 1.00 0.00 C ATOM 1566 C SER B 41 -5.303 -8.241 -5.540 1.00 0.00 C ATOM 1567 O SER B 41 -4.349 -7.520 -5.815 1.00 0.00 O ATOM 1568 CB SER B 41 -6.394 -7.860 -3.335 1.00 0.00 C ATOM 1569 OG SER B 41 -7.299 -6.993 -2.675 1.00 0.00 O ATOM 0 H SER B 41 -8.280 -8.834 -4.569 1.00 0.00 H new ATOM 0 HA SER B 41 -6.658 -6.634 -5.083 1.00 0.00 H new ATOM 0 HB2 SER B 41 -6.591 -8.894 -3.052 1.00 0.00 H new ATOM 0 HB3 SER B 41 -5.371 -7.636 -3.031 1.00 0.00 H new ATOM 0 HG SER B 41 -7.132 -6.070 -2.957 1.00 0.00 H new ATOM 1575 N ALA B 42 -5.361 -9.531 -5.828 1.00 0.00 N ATOM 1576 CA ALA B 42 -4.291 -10.233 -6.509 1.00 0.00 C ATOM 1577 C ALA B 42 -4.240 -9.859 -7.993 1.00 0.00 C ATOM 1578 O ALA B 42 -3.196 -9.979 -8.627 1.00 0.00 O ATOM 1579 CB ALA B 42 -4.547 -11.731 -6.386 1.00 0.00 C ATOM 0 H ALA B 42 -6.158 -10.122 -5.593 1.00 0.00 H new ATOM 0 HA ALA B 42 -3.340 -9.956 -6.053 1.00 0.00 H new ATOM 0 HB1 ALA B 42 -3.752 -12.279 -6.892 1.00 0.00 H new ATOM 0 HB2 ALA B 42 -4.567 -12.011 -5.333 1.00 0.00 H new ATOM 0 HB3 ALA B 42 -5.505 -11.975 -6.845 1.00 0.00 H new ATOM 1585 N ASN B 43 -5.395 -9.454 -8.535 1.00 0.00 N ATOM 1586 CA ASN B 43 -5.531 -9.110 -9.947 1.00 0.00 C ATOM 1587 C ASN B 43 -4.835 -7.818 -10.314 1.00 0.00 C ATOM 1588 O ASN B 43 -4.016 -7.788 -11.226 1.00 0.00 O ATOM 1589 CB ASN B 43 -6.996 -8.955 -10.254 1.00 0.00 C ATOM 1590 CG ASN B 43 -7.224 -8.847 -11.760 1.00 0.00 C ATOM 1591 OD1 ASN B 43 -7.480 -7.759 -12.273 1.00 0.00 O ATOM 1592 ND2 ASN B 43 -7.144 -9.917 -12.502 1.00 0.00 N ATOM 0 H ASN B 43 -6.260 -9.357 -8.003 1.00 0.00 H new ATOM 0 HA ASN B 43 -5.065 -9.909 -10.524 1.00 0.00 H new ATOM 0 HB2 ASN B 43 -7.548 -9.808 -9.858 1.00 0.00 H new ATOM 0 HB3 ASN B 43 -7.384 -8.066 -9.758 1.00 0.00 H new ATOM 0 HD21 ASN B 43 -7.294 -9.852 -13.509 1.00 0.00 H new ATOM 0 HD22 ASN B 43 -6.932 -10.819 -12.075 1.00 0.00 H new ATOM 1599 N LEU B 44 -5.164 -6.749 -9.598 1.00 0.00 N ATOM 1600 CA LEU B 44 -4.550 -5.478 -9.865 1.00 0.00 C ATOM 1601 C LEU B 44 -3.119 -5.551 -9.362 1.00 0.00 C ATOM 1602 O LEU B 44 -2.222 -4.913 -9.893 1.00 0.00 O ATOM 1603 CB LEU B 44 -5.391 -4.286 -9.327 1.00 0.00 C ATOM 1604 CG LEU B 44 -5.464 -4.191 -7.806 1.00 0.00 C ATOM 1605 CD1 LEU B 44 -6.346 -5.288 -7.266 1.00 0.00 C ATOM 1606 CD2 LEU B 44 -4.086 -4.205 -7.182 1.00 0.00 C ATOM 0 H LEU B 44 -5.846 -6.748 -8.839 1.00 0.00 H new ATOM 0 HA LEU B 44 -4.518 -5.272 -10.935 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -4.971 -3.358 -9.715 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -6.404 -4.367 -9.721 1.00 0.00 H new ATOM 0 HG LEU B 44 -5.911 -3.235 -7.535 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -6.394 -5.215 -6.180 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -7.349 -5.186 -7.681 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -5.934 -6.257 -7.546 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -4.177 -4.136 -6.098 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -3.577 -5.132 -7.445 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -3.510 -3.357 -7.553 1.00 0.00 H new ATOM 1618 N LEU B 45 -2.911 -6.408 -8.361 1.00 0.00 N ATOM 1619 CA LEU B 45 -1.584 -6.648 -7.848 1.00 0.00 C ATOM 1620 C LEU B 45 -0.833 -7.319 -8.971 1.00 0.00 C ATOM 1621 O LEU B 45 0.340 -7.066 -9.215 1.00 0.00 O ATOM 1622 CB LEU B 45 -1.643 -7.576 -6.628 1.00 0.00 C ATOM 1623 CG LEU B 45 -0.286 -8.261 -6.417 1.00 0.00 C ATOM 1624 CD1 LEU B 45 0.800 -7.201 -6.252 1.00 0.00 C ATOM 1625 CD2 LEU B 45 -0.348 -9.161 -5.174 1.00 0.00 C ATOM 0 H LEU B 45 -3.648 -6.940 -7.899 1.00 0.00 H new ATOM 0 HA LEU B 45 -1.102 -5.724 -7.529 1.00 0.00 H new ATOM 0 HB2 LEU B 45 -1.912 -7.004 -5.740 1.00 0.00 H new ATOM 0 HB3 LEU B 45 -2.420 -8.327 -6.771 1.00 0.00 H new ATOM 0 HG LEU B 45 -0.049 -8.878 -7.284 1.00 0.00 H new ATOM 0 HD11 LEU B 45 1.764 -7.688 -6.102 1.00 0.00 H new ATOM 0 HD12 LEU B 45 0.842 -6.581 -7.147 1.00 0.00 H new ATOM 0 HD13 LEU B 45 0.571 -6.577 -5.389 1.00 0.00 H new ATOM 0 HD21 LEU B 45 0.617 -9.646 -5.027 1.00 0.00 H new ATOM 0 HD22 LEU B 45 -0.587 -8.557 -4.299 1.00 0.00 H new ATOM 0 HD23 LEU B 45 -1.118 -9.920 -5.312 1.00 0.00 H new ATOM 1637 N ALA B 46 -1.575 -8.154 -9.676 1.00 0.00 N ATOM 1638 CA ALA B 46 -1.037 -8.851 -10.818 1.00 0.00 C ATOM 1639 C ALA B 46 -0.656 -7.797 -11.843 1.00 0.00 C ATOM 1640 O ALA B 46 0.431 -7.826 -12.413 1.00 0.00 O ATOM 1641 CB ALA B 46 -2.088 -9.810 -11.400 1.00 0.00 C ATOM 0 H ALA B 46 -2.553 -8.363 -9.473 1.00 0.00 H new ATOM 0 HA ALA B 46 -0.169 -9.447 -10.536 1.00 0.00 H new ATOM 0 HB1 ALA B 46 -1.669 -10.330 -12.262 1.00 0.00 H new ATOM 0 HB2 ALA B 46 -2.376 -10.538 -10.642 1.00 0.00 H new ATOM 0 HB3 ALA B 46 -2.966 -9.243 -11.710 1.00 0.00 H new ATOM 1647 N GLU B 47 -1.564 -6.831 -12.009 1.00 0.00 N ATOM 1648 CA GLU B 47 -1.352 -5.709 -12.905 1.00 0.00 C ATOM 1649 C GLU B 47 -0.138 -4.917 -12.448 1.00 0.00 C ATOM 1650 O GLU B 47 0.585 -4.346 -13.256 1.00 0.00 O ATOM 1651 CB GLU B 47 -2.573 -4.770 -12.893 1.00 0.00 C ATOM 1652 CG GLU B 47 -3.819 -5.458 -13.442 1.00 0.00 C ATOM 1653 CD GLU B 47 -3.531 -6.155 -14.776 1.00 0.00 C ATOM 1654 OE1 GLU B 47 -3.109 -5.482 -15.703 1.00 0.00 O ATOM 1655 OE2 GLU B 47 -3.735 -7.357 -14.847 1.00 0.00 O ATOM 0 H GLU B 47 -2.461 -6.812 -11.524 1.00 0.00 H new ATOM 0 HA GLU B 47 -1.200 -6.098 -13.912 1.00 0.00 H new ATOM 0 HB2 GLU B 47 -2.763 -4.433 -11.874 1.00 0.00 H new ATOM 0 HB3 GLU B 47 -2.356 -3.883 -13.487 1.00 0.00 H new ATOM 0 HG2 GLU B 47 -4.181 -6.189 -12.719 1.00 0.00 H new ATOM 0 HG3 GLU B 47 -4.612 -4.723 -13.578 1.00 0.00 H new ATOM 1662 N ALA B 48 0.048 -4.876 -11.132 1.00 0.00 N ATOM 1663 CA ALA B 48 1.141 -4.145 -10.530 1.00 0.00 C ATOM 1664 C ALA B 48 2.456 -4.838 -10.753 1.00 0.00 C ATOM 1665 O ALA B 48 3.419 -4.228 -11.180 1.00 0.00 O ATOM 1666 CB ALA B 48 0.899 -4.094 -9.036 1.00 0.00 C ATOM 0 H ALA B 48 -0.557 -5.349 -10.461 1.00 0.00 H new ATOM 0 HA ALA B 48 1.184 -3.153 -10.979 1.00 0.00 H new ATOM 0 HB1 ALA B 48 1.710 -3.547 -8.555 1.00 0.00 H new ATOM 0 HB2 ALA B 48 -0.047 -3.590 -8.838 1.00 0.00 H new ATOM 0 HB3 ALA B 48 0.860 -5.108 -8.639 1.00 0.00 H new ATOM 1672 N LYS B 49 2.472 -6.125 -10.480 1.00 0.00 N ATOM 1673 CA LYS B 49 3.662 -6.914 -10.669 1.00 0.00 C ATOM 1674 C LYS B 49 3.998 -6.896 -12.152 1.00 0.00 C ATOM 1675 O LYS B 49 5.159 -6.826 -12.536 1.00 0.00 O ATOM 1676 CB LYS B 49 3.423 -8.318 -10.107 1.00 0.00 C ATOM 1677 CG LYS B 49 3.477 -8.278 -8.576 1.00 0.00 C ATOM 1678 CD LYS B 49 3.471 -9.710 -8.021 1.00 0.00 C ATOM 1679 CE LYS B 49 2.098 -10.363 -8.241 1.00 0.00 C ATOM 1680 NZ LYS B 49 1.574 -10.866 -6.939 1.00 0.00 N ATOM 0 H LYS B 49 1.669 -6.645 -10.125 1.00 0.00 H new ATOM 0 HA LYS B 49 4.520 -6.511 -10.131 1.00 0.00 H new ATOM 0 HB2 LYS B 49 2.454 -8.692 -10.437 1.00 0.00 H new ATOM 0 HB3 LYS B 49 4.177 -9.006 -10.489 1.00 0.00 H new ATOM 0 HG2 LYS B 49 4.375 -7.754 -8.248 1.00 0.00 H new ATOM 0 HG3 LYS B 49 2.623 -7.723 -8.187 1.00 0.00 H new ATOM 0 HD2 LYS B 49 4.245 -10.300 -8.512 1.00 0.00 H new ATOM 0 HD3 LYS B 49 3.708 -9.696 -6.957 1.00 0.00 H new ATOM 0 HE2 LYS B 49 1.404 -9.640 -8.670 1.00 0.00 H new ATOM 0 HE3 LYS B 49 2.183 -11.184 -8.953 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 0.537 -10.929 -6.983 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 1.970 -11.808 -6.746 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 1.849 -10.212 -6.178 1.00 0.00 H new ATOM 1694 N LYS B 50 2.941 -6.862 -12.966 1.00 0.00 N ATOM 1695 CA LYS B 50 3.069 -6.752 -14.413 1.00 0.00 C ATOM 1696 C LYS B 50 3.606 -5.379 -14.783 1.00 0.00 C ATOM 1697 O LYS B 50 4.430 -5.253 -15.678 1.00 0.00 O ATOM 1698 CB LYS B 50 1.711 -6.934 -15.079 1.00 0.00 C ATOM 1699 CG LYS B 50 1.328 -8.422 -15.132 1.00 0.00 C ATOM 1700 CD LYS B 50 -0.185 -8.573 -15.379 1.00 0.00 C ATOM 1701 CE LYS B 50 -0.583 -7.886 -16.692 1.00 0.00 C ATOM 1702 NZ LYS B 50 -2.012 -8.184 -16.994 1.00 0.00 N ATOM 0 H LYS B 50 1.976 -6.910 -12.638 1.00 0.00 H new ATOM 0 HA LYS B 50 3.754 -7.527 -14.755 1.00 0.00 H new ATOM 0 HB2 LYS B 50 0.953 -6.377 -14.528 1.00 0.00 H new ATOM 0 HB3 LYS B 50 1.737 -6.524 -16.089 1.00 0.00 H new ATOM 0 HG2 LYS B 50 1.885 -8.920 -15.925 1.00 0.00 H new ATOM 0 HG3 LYS B 50 1.602 -8.909 -14.196 1.00 0.00 H new ATOM 0 HD2 LYS B 50 -0.450 -9.630 -15.419 1.00 0.00 H new ATOM 0 HD3 LYS B 50 -0.741 -8.136 -14.549 1.00 0.00 H new ATOM 0 HE2 LYS B 50 -0.434 -6.809 -16.611 1.00 0.00 H new ATOM 0 HE3 LYS B 50 0.053 -8.236 -17.505 1.00 0.00 H new ATOM 0 HZ1 LYS B 50 -2.341 -7.565 -17.762 1.00 0.00 H new ATOM 0 HZ2 LYS B 50 -2.105 -9.178 -17.287 1.00 0.00 H new ATOM 0 HZ3 LYS B 50 -2.588 -8.018 -16.144 1.00 0.00 H new ATOM 1716 N LEU B 51 3.122 -4.348 -14.084 1.00 0.00 N ATOM 1717 CA LEU B 51 3.571 -2.983 -14.350 1.00 0.00 C ATOM 1718 C LEU B 51 5.005 -2.834 -13.925 1.00 0.00 C ATOM 1719 O LEU B 51 5.822 -2.241 -14.626 1.00 0.00 O ATOM 1720 CB LEU B 51 2.701 -1.966 -13.601 1.00 0.00 C ATOM 1721 CG LEU B 51 1.836 -1.205 -14.601 1.00 0.00 C ATOM 1722 CD1 LEU B 51 2.727 -0.250 -15.406 1.00 0.00 C ATOM 1723 CD2 LEU B 51 1.125 -2.205 -15.534 1.00 0.00 C ATOM 0 H LEU B 51 2.429 -4.432 -13.340 1.00 0.00 H new ATOM 0 HA LEU B 51 3.482 -2.790 -15.419 1.00 0.00 H new ATOM 0 HB2 LEU B 51 2.071 -2.477 -12.873 1.00 0.00 H new ATOM 0 HB3 LEU B 51 3.331 -1.271 -13.046 1.00 0.00 H new ATOM 0 HG LEU B 51 1.077 -0.624 -14.076 1.00 0.00 H new ATOM 0 HD11 LEU B 51 2.117 0.299 -16.124 1.00 0.00 H new ATOM 0 HD12 LEU B 51 3.211 0.454 -14.729 1.00 0.00 H new ATOM 0 HD13 LEU B 51 3.487 -0.823 -15.938 1.00 0.00 H new ATOM 0 HD21 LEU B 51 0.507 -1.660 -16.248 1.00 0.00 H new ATOM 0 HD22 LEU B 51 1.869 -2.793 -16.072 1.00 0.00 H new ATOM 0 HD23 LEU B 51 0.495 -2.870 -14.943 1.00 0.00 H new ATOM 1735 N ASN B 52 5.302 -3.426 -12.788 1.00 0.00 N ATOM 1736 CA ASN B 52 6.653 -3.420 -12.277 1.00 0.00 C ATOM 1737 C ASN B 52 7.507 -4.137 -13.289 1.00 0.00 C ATOM 1738 O ASN B 52 8.618 -3.718 -13.600 1.00 0.00 O ATOM 1739 CB ASN B 52 6.711 -4.127 -10.930 1.00 0.00 C ATOM 1740 CG ASN B 52 8.156 -4.292 -10.477 1.00 0.00 C ATOM 1741 OD1 ASN B 52 8.667 -3.500 -9.688 1.00 0.00 O ATOM 1742 ND2 ASN B 52 8.849 -5.283 -10.947 1.00 0.00 N ATOM 0 H ASN B 52 4.626 -3.916 -12.202 1.00 0.00 H new ATOM 0 HA ASN B 52 7.009 -2.401 -12.125 1.00 0.00 H new ATOM 0 HB2 ASN B 52 6.154 -3.555 -10.188 1.00 0.00 H new ATOM 0 HB3 ASN B 52 6.233 -5.104 -11.004 1.00 0.00 H new ATOM 0 HD21 ASN B 52 9.821 -5.406 -10.662 1.00 0.00 H new ATOM 0 HD22 ASN B 52 8.422 -5.939 -11.602 1.00 0.00 H new ATOM 1749 N ASP B 53 6.927 -5.203 -13.830 1.00 0.00 N ATOM 1750 CA ASP B 53 7.594 -5.980 -14.868 1.00 0.00 C ATOM 1751 C ASP B 53 7.711 -5.136 -16.135 1.00 0.00 C ATOM 1752 O ASP B 53 8.698 -5.218 -16.869 1.00 0.00 O ATOM 1753 CB ASP B 53 6.812 -7.269 -15.170 1.00 0.00 C ATOM 1754 CG ASP B 53 6.888 -8.267 -14.004 1.00 0.00 C ATOM 1755 OD1 ASP B 53 7.753 -8.118 -13.151 1.00 0.00 O ATOM 1756 OD2 ASP B 53 6.067 -9.169 -13.979 1.00 0.00 O ATOM 0 H ASP B 53 6.003 -5.547 -13.569 1.00 0.00 H new ATOM 0 HA ASP B 53 8.588 -6.256 -14.517 1.00 0.00 H new ATOM 0 HB2 ASP B 53 5.769 -7.023 -15.371 1.00 0.00 H new ATOM 0 HB3 ASP B 53 7.210 -7.733 -16.072 1.00 0.00 H new ATOM 1761 N ALA B 54 6.681 -4.321 -16.369 1.00 0.00 N ATOM 1762 CA ALA B 54 6.628 -3.444 -17.530 1.00 0.00 C ATOM 1763 C ALA B 54 7.715 -2.377 -17.447 1.00 0.00 C ATOM 1764 O ALA B 54 8.331 -2.024 -18.454 1.00 0.00 O ATOM 1765 CB ALA B 54 5.251 -2.783 -17.594 1.00 0.00 C ATOM 0 H ALA B 54 5.866 -4.253 -15.760 1.00 0.00 H new ATOM 0 HA ALA B 54 6.797 -4.033 -18.431 1.00 0.00 H new ATOM 0 HB1 ALA B 54 5.204 -2.124 -18.461 1.00 0.00 H new ATOM 0 HB2 ALA B 54 4.482 -3.551 -17.679 1.00 0.00 H new ATOM 0 HB3 ALA B 54 5.084 -2.202 -16.687 1.00 0.00 H new ATOM 1771 N GLN B 55 7.940 -1.873 -16.233 1.00 0.00 N ATOM 1772 CA GLN B 55 8.949 -0.847 -15.996 1.00 0.00 C ATOM 1773 C GLN B 55 10.294 -1.469 -15.625 1.00 0.00 C ATOM 1774 O GLN B 55 11.310 -0.773 -15.557 1.00 0.00 O ATOM 1775 CB GLN B 55 8.474 0.048 -14.871 1.00 0.00 C ATOM 1776 CG GLN B 55 7.234 0.825 -15.311 1.00 0.00 C ATOM 1777 CD GLN B 55 6.405 1.184 -14.091 1.00 0.00 C ATOM 1778 OE1 GLN B 55 6.213 2.360 -13.788 1.00 0.00 O ATOM 1779 NE2 GLN B 55 5.907 0.224 -13.362 1.00 0.00 N ATOM 0 H GLN B 55 7.433 -2.162 -15.397 1.00 0.00 H new ATOM 0 HA GLN B 55 9.088 -0.270 -16.910 1.00 0.00 H new ATOM 0 HB2 GLN B 55 8.244 -0.552 -13.990 1.00 0.00 H new ATOM 0 HB3 GLN B 55 9.266 0.741 -14.587 1.00 0.00 H new ATOM 0 HG2 GLN B 55 7.528 1.729 -15.844 1.00 0.00 H new ATOM 0 HG3 GLN B 55 6.642 0.226 -16.003 1.00 0.00 H new ATOM 0 HE21 GLN B 55 6.070 -0.749 -13.620 1.00 0.00 H new ATOM 0 HE22 GLN B 55 5.354 0.447 -12.534 1.00 0.00 H new ATOM 1788 N ALA B 56 10.288 -2.780 -15.382 1.00 0.00 N ATOM 1789 CA ALA B 56 11.513 -3.495 -15.012 1.00 0.00 C ATOM 1790 C ALA B 56 12.516 -3.476 -16.149 1.00 0.00 C ATOM 1791 O ALA B 56 12.174 -3.151 -17.289 1.00 0.00 O ATOM 1792 CB ALA B 56 11.201 -4.949 -14.650 1.00 0.00 C ATOM 0 H ALA B 56 9.455 -3.367 -15.434 1.00 0.00 H new ATOM 0 HA ALA B 56 11.940 -2.987 -14.147 1.00 0.00 H new ATOM 0 HB1 ALA B 56 12.123 -5.462 -14.378 1.00 0.00 H new ATOM 0 HB2 ALA B 56 10.510 -4.974 -13.807 1.00 0.00 H new ATOM 0 HB3 ALA B 56 10.747 -5.448 -15.506 1.00 0.00 H new