USER MOD reduce.3.24.130724 H: found=0, std=0, add=782, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 780 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 87 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 91 HIS : no HD1:sc= -2.48 K(o=-2.5,f=-1.9) USER MOD Set 2.1: A 29 GLN : amide:sc= -0.734 X(o=-0.71,f=-1.1) USER MOD Set 2.2: A 89 TYR OH : rot 6:sc= 0.022 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0.00253 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot 180:sc= -0.246 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 12 SER OG : rot 180:sc=0.000141 USER MOD Single : A 14 ASN : amide:sc= -0.0201 K(o=-0.02,f=-1.8!) USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 19 THR OG1 : rot 180:sc= 0.00436 USER MOD Single : A 20 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0397) USER MOD Single : A 22 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0358) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 THR OG1 : rot 180:sc= 0 USER MOD Single : A 35 CYS SG : rot 180:sc= 0 USER MOD Single : A 38 GLN : amide:sc= -0.742 X(o=-0.74,f=-0.46) USER MOD Single : A 44 MET CE :methyl 176:sc= -3.02 (180deg=-3.33) USER MOD Single : A 46 HIS : no HD1:sc= 0 X(o=0,f=-0.012) USER MOD Single : A 49 ASN : amide:sc= -0.969 K(o=-0.97,f=-5.1!) USER MOD Single : A 61 GLN : amide:sc= -0.32 K(o=-0.32,f=-2.8!) USER MOD Single : A 65 LYS NZ :NH3+ -177:sc= 0.207 (180deg=0.192) USER MOD Single : A 76 LYS NZ :NH3+ -174:sc= 0.306 (180deg=0.294) USER MOD Single : A 77 SER OG : rot 37:sc= 0.424 USER MOD Single : A 78 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 81 SER OG : rot 177:sc= 0.204 USER MOD Single : A 82 GLN : amide:sc= -0.767 K(o=-0.77,f=0) USER MOD Single : A 83 THR OG1 : rot 80:sc= 0.753 USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot 180:sc= -0.301 USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -20.676 4.238 25.156 1.00 0.00 N ATOM 2 CA GLY A 1 -19.545 5.144 25.496 1.00 0.00 C ATOM 3 C GLY A 1 -19.766 6.559 25.002 1.00 0.00 C ATOM 4 O GLY A 1 -20.450 7.351 25.651 1.00 0.00 O ATOM 0 H1 GLY A 1 -20.476 3.283 25.516 1.00 0.00 H new ATOM 0 H2 GLY A 1 -21.550 4.596 25.591 1.00 0.00 H new ATOM 0 H3 GLY A 1 -20.793 4.201 24.123 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -19.407 5.158 26.577 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -18.626 4.751 25.062 1.00 0.00 H new ATOM 10 N SER A 2 -19.187 6.879 23.850 1.00 0.00 N ATOM 11 CA SER A 2 -19.323 8.209 23.267 1.00 0.00 C ATOM 12 C SER A 2 -20.166 8.163 21.997 1.00 0.00 C ATOM 13 O SER A 2 -20.662 7.106 21.607 1.00 0.00 O ATOM 14 CB SER A 2 -17.945 8.796 22.957 1.00 0.00 C ATOM 15 OG SER A 2 -17.061 7.799 22.478 1.00 0.00 O ATOM 0 H SER A 2 -18.618 6.235 23.301 1.00 0.00 H new ATOM 0 HA SER A 2 -19.827 8.847 23.993 1.00 0.00 H new ATOM 0 HB2 SER A 2 -18.042 9.587 22.214 1.00 0.00 H new ATOM 0 HB3 SER A 2 -17.530 9.252 23.856 1.00 0.00 H new ATOM 0 HG SER A 2 -16.188 8.201 22.286 1.00 0.00 H new ATOM 21 N SER A 3 -20.323 9.316 21.354 1.00 0.00 N ATOM 22 CA SER A 3 -21.105 9.406 20.128 1.00 0.00 C ATOM 23 C SER A 3 -20.329 10.143 19.041 1.00 0.00 C ATOM 24 O SER A 3 -19.840 11.252 19.257 1.00 0.00 O ATOM 25 CB SER A 3 -22.432 10.119 20.396 1.00 0.00 C ATOM 26 OG SER A 3 -23.131 9.509 21.467 1.00 0.00 O ATOM 0 H SER A 3 -19.919 10.200 21.662 1.00 0.00 H new ATOM 0 HA SER A 3 -21.308 8.393 19.781 1.00 0.00 H new ATOM 0 HB2 SER A 3 -22.245 11.167 20.630 1.00 0.00 H new ATOM 0 HB3 SER A 3 -23.048 10.098 19.497 1.00 0.00 H new ATOM 0 HG SER A 3 -23.975 9.984 21.620 1.00 0.00 H new ATOM 32 N GLY A 4 -20.220 9.520 17.872 1.00 0.00 N ATOM 33 CA GLY A 4 -19.503 10.131 16.769 1.00 0.00 C ATOM 34 C GLY A 4 -18.357 9.270 16.276 1.00 0.00 C ATOM 35 O GLY A 4 -17.221 9.734 16.178 1.00 0.00 O ATOM 0 H GLY A 4 -20.616 8.602 17.669 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -20.195 10.315 15.947 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -19.116 11.100 17.083 1.00 0.00 H new ATOM 39 N SER A 5 -18.654 8.013 15.964 1.00 0.00 N ATOM 40 CA SER A 5 -17.638 7.085 15.478 1.00 0.00 C ATOM 41 C SER A 5 -17.177 7.471 14.077 1.00 0.00 C ATOM 42 O SER A 5 -17.988 7.828 13.222 1.00 0.00 O ATOM 43 CB SER A 5 -18.184 5.656 15.473 1.00 0.00 C ATOM 44 OG SER A 5 -18.538 5.240 16.781 1.00 0.00 O ATOM 0 H SER A 5 -19.589 7.613 16.039 1.00 0.00 H new ATOM 0 HA SER A 5 -16.781 7.136 16.150 1.00 0.00 H new ATOM 0 HB2 SER A 5 -19.056 5.599 14.822 1.00 0.00 H new ATOM 0 HB3 SER A 5 -17.435 4.979 15.063 1.00 0.00 H new ATOM 0 HG SER A 5 -18.886 4.324 16.750 1.00 0.00 H new ATOM 50 N SER A 6 -15.870 7.396 13.847 1.00 0.00 N ATOM 51 CA SER A 6 -15.301 7.738 12.549 1.00 0.00 C ATOM 52 C SER A 6 -15.602 9.189 12.188 1.00 0.00 C ATOM 53 O SER A 6 -16.717 9.522 11.787 1.00 0.00 O ATOM 54 CB SER A 6 -15.852 6.806 11.467 1.00 0.00 C ATOM 55 OG SER A 6 -15.832 5.456 11.898 1.00 0.00 O ATOM 0 H SER A 6 -15.185 7.101 14.543 1.00 0.00 H new ATOM 0 HA SER A 6 -14.220 7.615 12.610 1.00 0.00 H new ATOM 0 HB2 SER A 6 -16.873 7.096 11.218 1.00 0.00 H new ATOM 0 HB3 SER A 6 -15.260 6.909 10.558 1.00 0.00 H new ATOM 0 HG SER A 6 -16.190 4.881 11.190 1.00 0.00 H new ATOM 61 N GLY A 7 -14.598 10.049 12.332 1.00 0.00 N ATOM 62 CA GLY A 7 -14.776 11.454 12.016 1.00 0.00 C ATOM 63 C GLY A 7 -14.674 11.731 10.529 1.00 0.00 C ATOM 64 O GLY A 7 -15.508 11.274 9.748 1.00 0.00 O ATOM 0 H GLY A 7 -13.666 9.798 12.661 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -15.750 11.784 12.378 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -14.024 12.040 12.544 1.00 0.00 H new ATOM 68 N SER A 8 -13.650 12.482 10.138 1.00 0.00 N ATOM 69 CA SER A 8 -13.441 12.820 8.735 1.00 0.00 C ATOM 70 C SER A 8 -12.001 12.542 8.318 1.00 0.00 C ATOM 71 O SER A 8 -11.752 11.948 7.269 1.00 0.00 O ATOM 72 CB SER A 8 -13.782 14.290 8.488 1.00 0.00 C ATOM 73 OG SER A 8 -12.716 15.135 8.885 1.00 0.00 O ATOM 0 H SER A 8 -12.952 12.868 10.773 1.00 0.00 H new ATOM 0 HA SER A 8 -14.101 12.195 8.133 1.00 0.00 H new ATOM 0 HB2 SER A 8 -13.998 14.444 7.431 1.00 0.00 H new ATOM 0 HB3 SER A 8 -14.684 14.555 9.039 1.00 0.00 H new ATOM 0 HG SER A 8 -12.958 16.069 8.715 1.00 0.00 H new ATOM 79 N SER A 9 -11.055 12.976 9.146 1.00 0.00 N ATOM 80 CA SER A 9 -9.639 12.774 8.864 1.00 0.00 C ATOM 81 C SER A 9 -8.950 12.058 10.021 1.00 0.00 C ATOM 82 O SER A 9 -9.576 11.751 11.036 1.00 0.00 O ATOM 83 CB SER A 9 -8.954 14.114 8.597 1.00 0.00 C ATOM 84 OG SER A 9 -8.708 14.812 9.806 1.00 0.00 O ATOM 0 H SER A 9 -11.245 13.470 10.018 1.00 0.00 H new ATOM 0 HA SER A 9 -9.557 12.149 7.974 1.00 0.00 H new ATOM 0 HB2 SER A 9 -8.013 13.947 8.072 1.00 0.00 H new ATOM 0 HB3 SER A 9 -9.580 14.722 7.944 1.00 0.00 H new ATOM 0 HG SER A 9 -8.268 15.665 9.608 1.00 0.00 H new ATOM 90 N ALA A 10 -7.656 11.796 9.862 1.00 0.00 N ATOM 91 CA ALA A 10 -6.881 11.118 10.893 1.00 0.00 C ATOM 92 C ALA A 10 -5.395 11.426 10.755 1.00 0.00 C ATOM 93 O ALA A 10 -4.753 11.879 11.702 1.00 0.00 O ATOM 94 CB ALA A 10 -7.119 9.617 10.831 1.00 0.00 C ATOM 0 H ALA A 10 -7.123 12.043 9.028 1.00 0.00 H new ATOM 0 HA ALA A 10 -7.213 11.487 11.863 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -6.534 9.123 11.607 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -8.178 9.410 10.988 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -6.817 9.241 9.854 1.00 0.00 H new ATOM 100 N LEU A 11 -4.852 11.178 9.567 1.00 0.00 N ATOM 101 CA LEU A 11 -3.440 11.430 9.304 1.00 0.00 C ATOM 102 C LEU A 11 -3.253 12.748 8.557 1.00 0.00 C ATOM 103 O LEU A 11 -2.688 13.701 9.093 1.00 0.00 O ATOM 104 CB LEU A 11 -2.838 10.279 8.495 1.00 0.00 C ATOM 105 CG LEU A 11 -2.158 9.190 9.327 1.00 0.00 C ATOM 106 CD1 LEU A 11 -3.152 8.098 9.690 1.00 0.00 C ATOM 107 CD2 LEU A 11 -0.973 8.606 8.573 1.00 0.00 C ATOM 0 H LEU A 11 -5.369 10.803 8.772 1.00 0.00 H new ATOM 0 HA LEU A 11 -2.923 11.500 10.261 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -3.628 9.821 7.900 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -2.109 10.689 7.795 1.00 0.00 H new ATOM 0 HG LEU A 11 -1.790 9.640 10.249 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -2.651 7.332 10.282 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -3.969 8.528 10.270 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -3.550 7.651 8.779 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -0.501 7.833 9.179 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -1.317 8.171 7.635 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -0.250 9.395 8.364 1.00 0.00 H new ATOM 119 N SER A 12 -3.733 12.792 7.319 1.00 0.00 N ATOM 120 CA SER A 12 -3.619 13.991 6.498 1.00 0.00 C ATOM 121 C SER A 12 -4.837 14.892 6.678 1.00 0.00 C ATOM 122 O SER A 12 -5.977 14.436 6.584 1.00 0.00 O ATOM 123 CB SER A 12 -3.464 13.612 5.024 1.00 0.00 C ATOM 124 OG SER A 12 -2.974 12.289 4.886 1.00 0.00 O ATOM 0 H SER A 12 -4.205 12.011 6.862 1.00 0.00 H new ATOM 0 HA SER A 12 -2.734 14.539 6.820 1.00 0.00 H new ATOM 0 HB2 SER A 12 -4.426 13.701 4.519 1.00 0.00 H new ATOM 0 HB3 SER A 12 -2.782 14.308 4.536 1.00 0.00 H new ATOM 0 HG SER A 12 -2.885 12.071 3.935 1.00 0.00 H new ATOM 130 N ARG A 13 -4.588 16.171 6.936 1.00 0.00 N ATOM 131 CA ARG A 13 -5.665 17.136 7.129 1.00 0.00 C ATOM 132 C ARG A 13 -6.494 17.287 5.858 1.00 0.00 C ATOM 133 O ARG A 13 -6.043 16.944 4.765 1.00 0.00 O ATOM 134 CB ARG A 13 -5.095 18.493 7.545 1.00 0.00 C ATOM 135 CG ARG A 13 -4.521 18.505 8.952 1.00 0.00 C ATOM 136 CD ARG A 13 -5.563 18.101 9.982 1.00 0.00 C ATOM 137 NE ARG A 13 -5.247 18.619 11.312 1.00 0.00 N ATOM 138 CZ ARG A 13 -5.797 18.161 12.434 1.00 0.00 C ATOM 139 NH1 ARG A 13 -6.687 17.177 12.393 1.00 0.00 N ATOM 140 NH2 ARG A 13 -5.453 18.687 13.602 1.00 0.00 N ATOM 0 H ARG A 13 -3.650 16.564 7.016 1.00 0.00 H new ATOM 0 HA ARG A 13 -6.314 16.765 7.922 1.00 0.00 H new ATOM 0 HB2 ARG A 13 -4.315 18.782 6.841 1.00 0.00 H new ATOM 0 HB3 ARG A 13 -5.881 19.245 7.476 1.00 0.00 H new ATOM 0 HG2 ARG A 13 -3.672 17.824 9.005 1.00 0.00 H new ATOM 0 HG3 ARG A 13 -4.145 19.501 9.184 1.00 0.00 H new ATOM 0 HD2 ARG A 13 -6.541 18.469 9.672 1.00 0.00 H new ATOM 0 HD3 ARG A 13 -5.630 17.014 10.023 1.00 0.00 H new ATOM 0 HE ARG A 13 -4.566 19.375 11.384 1.00 0.00 H new ATOM 0 HH11 ARG A 13 -6.953 16.767 11.498 1.00 0.00 H new ATOM 0 HH12 ARG A 13 -7.105 16.831 13.257 1.00 0.00 H new ATOM 0 HH21 ARG A 13 -4.768 19.442 13.639 1.00 0.00 H new ATOM 0 HH22 ARG A 13 -5.874 18.337 14.463 1.00 0.00 H new ATOM 154 N ASN A 14 -7.710 17.804 6.008 1.00 0.00 N ATOM 155 CA ASN A 14 -8.602 18.002 4.872 1.00 0.00 C ATOM 156 C ASN A 14 -8.909 16.676 4.183 1.00 0.00 C ATOM 157 O ASN A 14 -9.127 16.630 2.973 1.00 0.00 O ATOM 158 CB ASN A 14 -7.980 18.977 3.872 1.00 0.00 C ATOM 159 CG ASN A 14 -7.993 20.407 4.375 1.00 0.00 C ATOM 160 OD1 ASN A 14 -7.920 20.655 5.579 1.00 0.00 O ATOM 161 ND2 ASN A 14 -8.085 21.358 3.453 1.00 0.00 N ATOM 0 H ASN A 14 -8.099 18.093 6.905 1.00 0.00 H new ATOM 0 HA ASN A 14 -9.536 18.422 5.245 1.00 0.00 H new ATOM 0 HB2 ASN A 14 -6.953 18.676 3.666 1.00 0.00 H new ATOM 0 HB3 ASN A 14 -8.523 18.922 2.929 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -8.097 22.339 3.732 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -8.143 21.107 2.466 1.00 0.00 H new ATOM 168 N GLY A 15 -8.924 15.599 4.962 1.00 0.00 N ATOM 169 CA GLY A 15 -9.205 14.287 4.408 1.00 0.00 C ATOM 170 C GLY A 15 -7.954 13.449 4.239 1.00 0.00 C ATOM 171 O GLY A 15 -6.883 13.973 3.932 1.00 0.00 O ATOM 0 H GLY A 15 -8.747 15.611 5.966 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -9.904 13.763 5.060 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -9.695 14.402 3.441 1.00 0.00 H new ATOM 175 N SER A 16 -8.088 12.142 4.443 1.00 0.00 N ATOM 176 CA SER A 16 -6.959 11.227 4.312 1.00 0.00 C ATOM 177 C SER A 16 -7.235 10.171 3.248 1.00 0.00 C ATOM 178 O SER A 16 -8.347 10.072 2.730 1.00 0.00 O ATOM 179 CB SER A 16 -6.665 10.553 5.654 1.00 0.00 C ATOM 180 OG SER A 16 -7.860 10.107 6.274 1.00 0.00 O ATOM 0 H SER A 16 -8.967 11.693 4.700 1.00 0.00 H new ATOM 0 HA SER A 16 -6.088 11.805 4.005 1.00 0.00 H new ATOM 0 HB2 SER A 16 -5.994 9.708 5.501 1.00 0.00 H new ATOM 0 HB3 SER A 16 -6.150 11.254 6.311 1.00 0.00 H new ATOM 0 HG SER A 16 -7.645 9.679 7.129 1.00 0.00 H new ATOM 186 N PHE A 17 -6.214 9.381 2.927 1.00 0.00 N ATOM 187 CA PHE A 17 -6.346 8.331 1.925 1.00 0.00 C ATOM 188 C PHE A 17 -6.596 6.979 2.585 1.00 0.00 C ATOM 189 O PHE A 17 -7.356 6.157 2.072 1.00 0.00 O ATOM 190 CB PHE A 17 -5.087 8.262 1.058 1.00 0.00 C ATOM 191 CG PHE A 17 -4.697 9.582 0.458 1.00 0.00 C ATOM 192 CD1 PHE A 17 -5.576 10.275 -0.358 1.00 0.00 C ATOM 193 CD2 PHE A 17 -3.449 10.130 0.712 1.00 0.00 C ATOM 194 CE1 PHE A 17 -5.218 11.491 -0.911 1.00 0.00 C ATOM 195 CE2 PHE A 17 -3.085 11.344 0.161 1.00 0.00 C ATOM 196 CZ PHE A 17 -3.971 12.026 -0.651 1.00 0.00 C ATOM 0 H PHE A 17 -5.287 9.449 3.347 1.00 0.00 H new ATOM 0 HA PHE A 17 -7.201 8.572 1.293 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -4.260 7.888 1.662 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -5.247 7.541 0.256 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -6.552 9.861 -0.565 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -2.753 9.602 1.348 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -5.912 12.022 -1.545 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -2.109 11.759 0.365 1.00 0.00 H new ATOM 0 HZ PHE A 17 -3.689 12.976 -1.082 1.00 0.00 H new ATOM 206 N ILE A 18 -5.950 6.754 3.725 1.00 0.00 N ATOM 207 CA ILE A 18 -6.101 5.502 4.456 1.00 0.00 C ATOM 208 C ILE A 18 -6.045 5.733 5.962 1.00 0.00 C ATOM 209 O ILE A 18 -5.267 6.557 6.444 1.00 0.00 O ATOM 210 CB ILE A 18 -5.010 4.489 4.062 1.00 0.00 C ATOM 211 CG1 ILE A 18 -4.912 4.377 2.540 1.00 0.00 C ATOM 212 CG2 ILE A 18 -5.300 3.129 4.680 1.00 0.00 C ATOM 213 CD1 ILE A 18 -3.835 3.422 2.072 1.00 0.00 C ATOM 0 H ILE A 18 -5.317 7.423 4.162 1.00 0.00 H new ATOM 0 HA ILE A 18 -7.077 5.096 4.191 1.00 0.00 H new ATOM 0 HB ILE A 18 -4.053 4.843 4.444 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -5.874 4.049 2.145 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -4.716 5.365 2.123 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -4.520 2.425 4.392 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -5.323 3.220 5.766 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -6.265 2.767 4.325 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -3.823 3.393 0.982 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -2.865 3.760 2.437 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -4.040 2.424 2.459 1.00 0.00 H new ATOM 225 N THR A 19 -6.873 5.002 6.700 1.00 0.00 N ATOM 226 CA THR A 19 -6.916 5.128 8.152 1.00 0.00 C ATOM 227 C THR A 19 -6.246 3.932 8.822 1.00 0.00 C ATOM 228 O THR A 19 -5.732 3.039 8.149 1.00 0.00 O ATOM 229 CB THR A 19 -8.362 5.253 8.632 1.00 0.00 C ATOM 230 OG1 THR A 19 -9.207 4.371 7.915 1.00 0.00 O ATOM 231 CG2 THR A 19 -8.924 6.651 8.483 1.00 0.00 C ATOM 0 H THR A 19 -7.523 4.316 6.317 1.00 0.00 H new ATOM 0 HA THR A 19 -6.370 6.030 8.430 1.00 0.00 H new ATOM 0 HB THR A 19 -8.337 5.000 9.692 1.00 0.00 H new ATOM 0 HG1 THR A 19 -10.127 4.465 8.238 1.00 0.00 H new ATOM 0 HG21 THR A 19 -9.953 6.670 8.842 1.00 0.00 H new ATOM 0 HG22 THR A 19 -8.323 7.349 9.067 1.00 0.00 H new ATOM 0 HG23 THR A 19 -8.901 6.942 7.433 1.00 0.00 H new ATOM 239 N LYS A 20 -6.254 3.923 10.150 1.00 0.00 N ATOM 240 CA LYS A 20 -5.648 2.837 10.912 1.00 0.00 C ATOM 241 C LYS A 20 -6.573 1.625 10.966 1.00 0.00 C ATOM 242 O LYS A 20 -6.114 0.486 11.047 1.00 0.00 O ATOM 243 CB LYS A 20 -5.317 3.306 12.331 1.00 0.00 C ATOM 244 CG LYS A 20 -4.319 2.411 13.049 1.00 0.00 C ATOM 245 CD LYS A 20 -3.108 3.196 13.532 1.00 0.00 C ATOM 246 CE LYS A 20 -2.688 2.770 14.929 1.00 0.00 C ATOM 247 NZ LYS A 20 -2.328 1.326 14.985 1.00 0.00 N ATOM 0 H LYS A 20 -6.674 4.656 10.722 1.00 0.00 H new ATOM 0 HA LYS A 20 -4.727 2.544 10.409 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -4.918 4.319 12.286 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -6.237 3.352 12.914 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -4.805 1.932 13.899 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -3.994 1.616 12.378 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -2.278 3.048 12.841 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -3.339 4.261 13.530 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -1.836 3.369 15.250 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -3.500 2.969 15.629 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -1.967 1.095 15.933 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -3.171 0.750 14.785 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -1.594 1.123 14.276 1.00 0.00 H new ATOM 261 N GLU A 21 -7.877 1.878 10.924 1.00 0.00 N ATOM 262 CA GLU A 21 -8.866 0.807 10.971 1.00 0.00 C ATOM 263 C GLU A 21 -8.852 -0.006 9.679 1.00 0.00 C ATOM 264 O GLU A 21 -9.074 -1.216 9.695 1.00 0.00 O ATOM 265 CB GLU A 21 -10.262 1.386 11.206 1.00 0.00 C ATOM 266 CG GLU A 21 -11.324 0.328 11.459 1.00 0.00 C ATOM 267 CD GLU A 21 -12.551 0.887 12.153 1.00 0.00 C ATOM 268 OE1 GLU A 21 -12.435 1.953 12.794 1.00 0.00 O ATOM 269 OE2 GLU A 21 -13.626 0.259 12.054 1.00 0.00 O ATOM 0 H GLU A 21 -8.274 2.815 10.858 1.00 0.00 H new ATOM 0 HA GLU A 21 -8.609 0.145 11.798 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -10.226 2.064 12.058 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -10.551 1.979 10.338 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -11.620 -0.119 10.510 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -10.899 -0.470 12.068 1.00 0.00 H new ATOM 276 N LYS A 22 -8.589 0.667 8.564 1.00 0.00 N ATOM 277 CA LYS A 22 -8.548 0.007 7.265 1.00 0.00 C ATOM 278 C LYS A 22 -7.481 -1.084 7.239 1.00 0.00 C ATOM 279 O LYS A 22 -7.626 -2.091 6.546 1.00 0.00 O ATOM 280 CB LYS A 22 -8.274 1.028 6.159 1.00 0.00 C ATOM 281 CG LYS A 22 -9.535 1.645 5.574 1.00 0.00 C ATOM 282 CD LYS A 22 -9.310 2.126 4.151 1.00 0.00 C ATOM 283 CE LYS A 22 -10.623 2.274 3.399 1.00 0.00 C ATOM 284 NZ LYS A 22 -11.529 3.259 4.051 1.00 0.00 N ATOM 0 H LYS A 22 -8.401 1.669 8.534 1.00 0.00 H new ATOM 0 HA LYS A 22 -9.519 -0.456 7.092 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -7.642 1.822 6.557 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -7.712 0.544 5.360 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -10.341 0.911 5.588 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -9.855 2.481 6.196 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -8.789 3.083 4.167 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -8.666 1.421 3.625 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -10.421 2.589 2.375 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -11.120 1.306 3.343 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -12.368 3.406 3.455 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -11.824 2.897 4.980 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -11.029 4.162 4.174 1.00 0.00 H new ATOM 298 N LYS A 23 -6.412 -0.876 7.999 1.00 0.00 N ATOM 299 CA LYS A 23 -5.320 -1.842 8.063 1.00 0.00 C ATOM 300 C LYS A 23 -5.638 -2.969 9.043 1.00 0.00 C ATOM 301 O LYS A 23 -5.098 -4.069 8.934 1.00 0.00 O ATOM 302 CB LYS A 23 -4.020 -1.146 8.474 1.00 0.00 C ATOM 303 CG LYS A 23 -3.329 -0.421 7.330 1.00 0.00 C ATOM 304 CD LYS A 23 -2.634 0.844 7.808 1.00 0.00 C ATOM 305 CE LYS A 23 -1.138 0.632 7.976 1.00 0.00 C ATOM 306 NZ LYS A 23 -0.650 1.134 9.290 1.00 0.00 N ATOM 0 H LYS A 23 -6.277 -0.048 8.579 1.00 0.00 H new ATOM 0 HA LYS A 23 -5.197 -2.276 7.071 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -4.236 -0.431 9.268 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -3.337 -1.887 8.889 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -2.599 -1.085 6.866 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -4.062 -0.167 6.564 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -2.810 1.648 7.094 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -3.066 1.160 8.757 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -0.909 -0.430 7.886 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -0.607 1.142 7.172 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 0.374 0.971 9.365 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -0.845 2.153 9.367 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -1.138 0.630 10.057 1.00 0.00 H new ATOM 320 N ASP A 24 -6.516 -2.686 10.002 1.00 0.00 N ATOM 321 CA ASP A 24 -6.900 -3.677 11.002 1.00 0.00 C ATOM 322 C ASP A 24 -7.780 -4.763 10.388 1.00 0.00 C ATOM 323 O ASP A 24 -7.770 -5.909 10.837 1.00 0.00 O ATOM 324 CB ASP A 24 -7.637 -2.999 12.161 1.00 0.00 C ATOM 325 CG ASP A 24 -6.884 -3.117 13.473 1.00 0.00 C ATOM 326 OD1 ASP A 24 -5.663 -2.851 13.482 1.00 0.00 O ATOM 327 OD2 ASP A 24 -7.515 -3.476 14.489 1.00 0.00 O ATOM 0 H ASP A 24 -6.974 -1.781 10.107 1.00 0.00 H new ATOM 0 HA ASP A 24 -5.992 -4.146 11.380 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -7.788 -1.946 11.925 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -8.625 -3.446 12.271 1.00 0.00 H new ATOM 332 N THR A 25 -8.542 -4.396 9.364 1.00 0.00 N ATOM 333 CA THR A 25 -9.429 -5.342 8.693 1.00 0.00 C ATOM 334 C THR A 25 -8.671 -6.163 7.654 1.00 0.00 C ATOM 335 O THR A 25 -8.923 -7.356 7.489 1.00 0.00 O ATOM 336 CB THR A 25 -10.588 -4.600 8.026 1.00 0.00 C ATOM 337 OG1 THR A 25 -11.246 -3.759 8.957 1.00 0.00 O ATOM 338 CG2 THR A 25 -11.627 -5.525 7.429 1.00 0.00 C ATOM 0 H THR A 25 -8.564 -3.451 8.980 1.00 0.00 H new ATOM 0 HA THR A 25 -9.826 -6.023 9.446 1.00 0.00 H new ATOM 0 HB THR A 25 -10.135 -4.021 7.221 1.00 0.00 H new ATOM 0 HG1 THR A 25 -11.983 -3.292 8.512 1.00 0.00 H new ATOM 0 HG21 THR A 25 -12.421 -4.934 6.972 1.00 0.00 H new ATOM 0 HG22 THR A 25 -11.161 -6.154 6.671 1.00 0.00 H new ATOM 0 HG23 THR A 25 -12.048 -6.154 8.214 1.00 0.00 H new ATOM 346 N VAL A 26 -7.745 -5.516 6.955 1.00 0.00 N ATOM 347 CA VAL A 26 -6.954 -6.187 5.930 1.00 0.00 C ATOM 348 C VAL A 26 -6.107 -7.305 6.530 1.00 0.00 C ATOM 349 O VAL A 26 -6.283 -8.477 6.198 1.00 0.00 O ATOM 350 CB VAL A 26 -6.030 -5.196 5.195 1.00 0.00 C ATOM 351 CG1 VAL A 26 -5.326 -5.881 4.033 1.00 0.00 C ATOM 352 CG2 VAL A 26 -6.818 -3.987 4.712 1.00 0.00 C ATOM 0 H VAL A 26 -7.524 -4.528 7.079 1.00 0.00 H new ATOM 0 HA VAL A 26 -7.659 -6.613 5.217 1.00 0.00 H new ATOM 0 HB VAL A 26 -5.271 -4.850 5.896 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -4.678 -5.165 3.527 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -4.726 -6.710 4.409 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -6.068 -6.259 3.330 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -6.149 -3.299 4.196 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -7.601 -4.313 4.028 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -7.269 -3.482 5.566 1.00 0.00 H new ATOM 362 N LEU A 27 -5.185 -6.935 7.415 1.00 0.00 N ATOM 363 CA LEU A 27 -4.308 -7.906 8.060 1.00 0.00 C ATOM 364 C LEU A 27 -5.113 -8.964 8.811 1.00 0.00 C ATOM 365 O LEU A 27 -4.644 -10.083 9.014 1.00 0.00 O ATOM 366 CB LEU A 27 -3.353 -7.200 9.024 1.00 0.00 C ATOM 367 CG LEU A 27 -2.605 -6.003 8.434 1.00 0.00 C ATOM 368 CD1 LEU A 27 -1.628 -5.433 9.451 1.00 0.00 C ATOM 369 CD2 LEU A 27 -1.878 -6.405 7.160 1.00 0.00 C ATOM 0 H LEU A 27 -5.026 -5.969 7.701 1.00 0.00 H new ATOM 0 HA LEU A 27 -3.730 -8.404 7.281 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -3.920 -6.863 9.891 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -2.622 -7.925 9.383 1.00 0.00 H new ATOM 0 HG LEU A 27 -3.332 -5.230 8.185 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -1.104 -4.582 9.015 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -2.173 -5.108 10.337 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -0.905 -6.200 9.731 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -1.351 -5.542 6.754 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -1.161 -7.195 7.384 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -2.600 -6.767 6.428 1.00 0.00 H new ATOM 381 N ARG A 28 -6.325 -8.602 9.222 1.00 0.00 N ATOM 382 CA ARG A 28 -7.191 -9.522 9.951 1.00 0.00 C ATOM 383 C ARG A 28 -7.425 -10.803 9.155 1.00 0.00 C ATOM 384 O ARG A 28 -7.147 -11.903 9.633 1.00 0.00 O ATOM 385 CB ARG A 28 -8.529 -8.849 10.270 1.00 0.00 C ATOM 386 CG ARG A 28 -8.864 -8.838 11.752 1.00 0.00 C ATOM 387 CD ARG A 28 -10.354 -9.028 11.989 1.00 0.00 C ATOM 388 NE ARG A 28 -10.666 -10.374 12.462 1.00 0.00 N ATOM 389 CZ ARG A 28 -10.495 -10.777 13.719 1.00 0.00 C ATOM 390 NH1 ARG A 28 -10.017 -9.941 14.632 1.00 0.00 N ATOM 391 NH2 ARG A 28 -10.804 -12.020 14.064 1.00 0.00 N ATOM 0 H ARG A 28 -6.729 -7.679 9.063 1.00 0.00 H new ATOM 0 HA ARG A 28 -6.694 -9.787 10.884 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -8.507 -7.823 9.903 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -9.324 -9.364 9.730 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -8.311 -9.630 12.257 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -8.542 -7.894 12.192 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -10.701 -8.298 12.720 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -10.896 -8.834 11.063 1.00 0.00 H new ATOM 0 HE ARG A 28 -11.037 -11.045 11.789 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -9.779 -8.984 14.372 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -9.888 -10.255 15.594 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -11.172 -12.666 13.366 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -10.673 -12.329 15.027 1.00 0.00 H new ATOM 405 N GLN A 29 -7.938 -10.652 7.939 1.00 0.00 N ATOM 406 CA GLN A 29 -8.211 -11.796 7.077 1.00 0.00 C ATOM 407 C GLN A 29 -6.926 -12.548 6.744 1.00 0.00 C ATOM 408 O GLN A 29 -6.944 -13.758 6.519 1.00 0.00 O ATOM 409 CB GLN A 29 -8.893 -11.336 5.786 1.00 0.00 C ATOM 410 CG GLN A 29 -10.261 -10.712 6.010 1.00 0.00 C ATOM 411 CD GLN A 29 -10.751 -9.937 4.803 1.00 0.00 C ATOM 412 OE1 GLN A 29 -10.784 -8.706 4.813 1.00 0.00 O ATOM 413 NE2 GLN A 29 -11.136 -10.654 3.755 1.00 0.00 N ATOM 0 H GLN A 29 -8.173 -9.749 7.528 1.00 0.00 H new ATOM 0 HA GLN A 29 -8.877 -12.471 7.614 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -8.251 -10.613 5.283 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -8.997 -12.189 5.116 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -10.979 -11.496 6.250 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -10.216 -10.046 6.872 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -11.092 -11.672 3.790 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -11.476 -10.187 2.914 1.00 0.00 H new ATOM 422 N VAL A 30 -5.812 -11.823 6.714 1.00 0.00 N ATOM 423 CA VAL A 30 -4.519 -12.423 6.408 1.00 0.00 C ATOM 424 C VAL A 30 -3.990 -13.227 7.591 1.00 0.00 C ATOM 425 O VAL A 30 -3.444 -14.317 7.421 1.00 0.00 O ATOM 426 CB VAL A 30 -3.478 -11.354 6.022 1.00 0.00 C ATOM 427 CG1 VAL A 30 -2.188 -12.007 5.551 1.00 0.00 C ATOM 428 CG2 VAL A 30 -4.034 -10.425 4.952 1.00 0.00 C ATOM 0 H VAL A 30 -5.779 -10.820 6.898 1.00 0.00 H new ATOM 0 HA VAL A 30 -4.675 -13.090 5.560 1.00 0.00 H new ATOM 0 HB VAL A 30 -3.255 -10.759 6.907 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -1.466 -11.235 5.283 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -1.779 -12.624 6.351 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -2.392 -12.630 4.680 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -3.284 -9.678 4.693 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -4.290 -11.004 4.065 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -4.927 -9.927 5.331 1.00 0.00 H new ATOM 438 N ARG A 31 -4.157 -12.682 8.792 1.00 0.00 N ATOM 439 CA ARG A 31 -3.697 -13.348 10.004 1.00 0.00 C ATOM 440 C ARG A 31 -4.465 -14.646 10.239 1.00 0.00 C ATOM 441 O ARG A 31 -3.929 -15.603 10.795 1.00 0.00 O ATOM 442 CB ARG A 31 -3.855 -12.422 11.211 1.00 0.00 C ATOM 443 CG ARG A 31 -2.666 -11.501 11.430 1.00 0.00 C ATOM 444 CD ARG A 31 -2.893 -10.571 12.610 1.00 0.00 C ATOM 445 NE ARG A 31 -2.141 -9.324 12.478 1.00 0.00 N ATOM 446 CZ ARG A 31 -1.873 -8.508 13.495 1.00 0.00 C ATOM 447 NH1 ARG A 31 -2.294 -8.802 14.719 1.00 0.00 N ATOM 448 NH2 ARG A 31 -1.183 -7.395 13.287 1.00 0.00 N ATOM 0 H ARG A 31 -4.608 -11.781 8.951 1.00 0.00 H new ATOM 0 HA ARG A 31 -2.642 -13.591 9.876 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -4.753 -11.818 11.080 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -4.005 -13.027 12.105 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -1.770 -12.097 11.602 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -2.490 -10.912 10.530 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -3.956 -10.346 12.695 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -2.600 -11.075 13.531 1.00 0.00 H new ATOM 0 HE ARG A 31 -1.802 -9.064 11.552 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -2.826 -9.657 14.884 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -2.086 -8.173 15.495 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -0.858 -7.164 12.348 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -0.977 -6.769 14.066 1.00 0.00 H new ATOM 462 N LEU A 32 -5.723 -14.667 9.812 1.00 0.00 N ATOM 463 CA LEU A 32 -6.566 -15.847 9.977 1.00 0.00 C ATOM 464 C LEU A 32 -6.041 -17.012 9.144 1.00 0.00 C ATOM 465 O LEU A 32 -5.737 -18.080 9.674 1.00 0.00 O ATOM 466 CB LEU A 32 -8.008 -15.530 9.581 1.00 0.00 C ATOM 467 CG LEU A 32 -8.830 -14.809 10.651 1.00 0.00 C ATOM 468 CD1 LEU A 32 -9.931 -13.978 10.010 1.00 0.00 C ATOM 469 CD2 LEU A 32 -9.419 -15.811 11.633 1.00 0.00 C ATOM 0 H LEU A 32 -6.181 -13.882 9.350 1.00 0.00 H new ATOM 0 HA LEU A 32 -6.541 -16.136 11.028 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -7.995 -14.917 8.680 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -8.512 -16.462 9.325 1.00 0.00 H new ATOM 0 HG LEU A 32 -8.169 -14.137 11.199 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -10.505 -13.473 10.787 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -9.487 -13.236 9.346 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -10.591 -14.629 9.437 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -10.001 -15.282 12.388 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -10.065 -16.507 11.099 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -8.613 -16.363 12.117 1.00 0.00 H new ATOM 481 N ASP A 33 -5.938 -16.799 7.836 1.00 0.00 N ATOM 482 CA ASP A 33 -5.452 -17.832 6.929 1.00 0.00 C ATOM 483 C ASP A 33 -4.792 -17.211 5.699 1.00 0.00 C ATOM 484 O ASP A 33 -5.444 -16.996 4.677 1.00 0.00 O ATOM 485 CB ASP A 33 -6.601 -18.747 6.501 1.00 0.00 C ATOM 486 CG ASP A 33 -6.648 -20.032 7.305 1.00 0.00 C ATOM 487 OD1 ASP A 33 -5.567 -20.555 7.649 1.00 0.00 O ATOM 488 OD2 ASP A 33 -7.764 -20.513 7.590 1.00 0.00 O ATOM 0 H ASP A 33 -6.185 -15.920 7.381 1.00 0.00 H new ATOM 0 HA ASP A 33 -4.705 -18.424 7.459 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -7.546 -18.216 6.615 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -6.496 -18.987 5.443 1.00 0.00 H new ATOM 493 N PRO A 34 -3.484 -16.914 5.783 1.00 0.00 N ATOM 494 CA PRO A 34 -2.738 -16.314 4.672 1.00 0.00 C ATOM 495 C PRO A 34 -2.476 -17.308 3.545 1.00 0.00 C ATOM 496 O PRO A 34 -2.173 -18.476 3.792 1.00 0.00 O ATOM 497 CB PRO A 34 -1.422 -15.887 5.323 1.00 0.00 C ATOM 498 CG PRO A 34 -1.246 -16.826 6.465 1.00 0.00 C ATOM 499 CD PRO A 34 -2.630 -17.138 6.966 1.00 0.00 C ATOM 0 HA PRO A 34 -3.287 -15.495 4.206 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -0.591 -15.957 4.621 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -1.465 -14.852 5.663 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -0.733 -17.734 6.148 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -0.640 -16.375 7.251 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -2.705 -18.164 7.326 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -2.913 -16.488 7.794 1.00 0.00 H new ATOM 507 N CYS A 35 -2.593 -16.836 2.309 1.00 0.00 N ATOM 508 CA CYS A 35 -2.367 -17.682 1.142 1.00 0.00 C ATOM 509 C CYS A 35 -1.150 -17.209 0.355 1.00 0.00 C ATOM 510 O CYS A 35 -0.127 -17.892 0.304 1.00 0.00 O ATOM 511 CB CYS A 35 -3.603 -17.684 0.240 1.00 0.00 C ATOM 512 SG CYS A 35 -4.954 -18.725 0.840 1.00 0.00 S ATOM 0 H CYS A 35 -2.843 -15.872 2.089 1.00 0.00 H new ATOM 0 HA CYS A 35 -2.179 -18.697 1.491 1.00 0.00 H new ATOM 0 HB2 CYS A 35 -3.965 -16.661 0.136 1.00 0.00 H new ATOM 0 HB3 CYS A 35 -3.313 -18.022 -0.755 1.00 0.00 H new ATOM 0 HG CYS A 35 -5.954 -18.659 0.012 1.00 0.00 H new ATOM 518 N ASP A 36 -1.267 -16.035 -0.256 1.00 0.00 N ATOM 519 CA ASP A 36 -0.177 -15.469 -1.041 1.00 0.00 C ATOM 520 C ASP A 36 -0.344 -13.960 -1.194 1.00 0.00 C ATOM 521 O ASP A 36 -1.284 -13.492 -1.836 1.00 0.00 O ATOM 522 CB ASP A 36 -0.116 -16.129 -2.419 1.00 0.00 C ATOM 523 CG ASP A 36 1.306 -16.283 -2.924 1.00 0.00 C ATOM 524 OD1 ASP A 36 2.193 -16.611 -2.109 1.00 0.00 O ATOM 525 OD2 ASP A 36 1.531 -16.074 -4.135 1.00 0.00 O ATOM 0 H ASP A 36 -2.107 -15.457 -0.222 1.00 0.00 H new ATOM 0 HA ASP A 36 0.756 -15.662 -0.512 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -0.590 -17.110 -2.370 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -0.689 -15.533 -3.130 1.00 0.00 H new ATOM 530 N LEU A 37 0.573 -13.205 -0.599 1.00 0.00 N ATOM 531 CA LEU A 37 0.527 -11.749 -0.669 1.00 0.00 C ATOM 532 C LEU A 37 1.592 -11.216 -1.623 1.00 0.00 C ATOM 533 O LEU A 37 2.226 -10.196 -1.355 1.00 0.00 O ATOM 534 CB LEU A 37 0.722 -11.144 0.723 1.00 0.00 C ATOM 535 CG LEU A 37 -0.163 -11.740 1.818 1.00 0.00 C ATOM 536 CD1 LEU A 37 0.508 -11.607 3.177 1.00 0.00 C ATOM 537 CD2 LEU A 37 -1.526 -11.063 1.827 1.00 0.00 C ATOM 0 H LEU A 37 1.357 -13.577 -0.063 1.00 0.00 H new ATOM 0 HA LEU A 37 -0.453 -11.459 -1.049 1.00 0.00 H new ATOM 0 HB2 LEU A 37 1.765 -11.268 1.013 1.00 0.00 H new ATOM 0 HB3 LEU A 37 0.532 -10.072 0.666 1.00 0.00 H new ATOM 0 HG LEU A 37 -0.306 -12.800 1.608 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -0.136 -12.036 3.944 1.00 0.00 H new ATOM 0 HD12 LEU A 37 1.461 -12.136 3.166 1.00 0.00 H new ATOM 0 HD13 LEU A 37 0.680 -10.553 3.396 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -2.144 -11.499 2.612 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -1.401 -9.996 2.014 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -2.011 -11.208 0.862 1.00 0.00 H new ATOM 549 N GLN A 38 1.782 -11.914 -2.739 1.00 0.00 N ATOM 550 CA GLN A 38 2.770 -11.510 -3.732 1.00 0.00 C ATOM 551 C GLN A 38 2.159 -10.557 -4.759 1.00 0.00 C ATOM 552 O GLN A 38 2.687 -9.473 -5.000 1.00 0.00 O ATOM 553 CB GLN A 38 3.351 -12.741 -4.436 1.00 0.00 C ATOM 554 CG GLN A 38 4.869 -12.743 -4.502 1.00 0.00 C ATOM 555 CD GLN A 38 5.513 -12.584 -3.138 1.00 0.00 C ATOM 556 OE1 GLN A 38 5.582 -13.533 -2.357 1.00 0.00 O ATOM 557 NE2 GLN A 38 5.985 -11.378 -2.844 1.00 0.00 N ATOM 0 H GLN A 38 1.265 -12.761 -2.977 1.00 0.00 H new ATOM 0 HA GLN A 38 3.573 -10.985 -3.215 1.00 0.00 H new ATOM 0 HB2 GLN A 38 3.017 -13.639 -3.915 1.00 0.00 H new ATOM 0 HB3 GLN A 38 2.951 -12.793 -5.449 1.00 0.00 H new ATOM 0 HG2 GLN A 38 5.208 -13.676 -4.953 1.00 0.00 H new ATOM 0 HG3 GLN A 38 5.202 -11.935 -5.153 1.00 0.00 H new ATOM 0 HE21 GLN A 38 5.906 -10.620 -3.522 1.00 0.00 H new ATOM 0 HE22 GLN A 38 6.426 -11.210 -1.940 1.00 0.00 H new ATOM 566 N PRO A 39 1.033 -10.951 -5.381 1.00 0.00 N ATOM 567 CA PRO A 39 0.356 -10.122 -6.384 1.00 0.00 C ATOM 568 C PRO A 39 0.031 -8.728 -5.859 1.00 0.00 C ATOM 569 O PRO A 39 -0.067 -7.772 -6.628 1.00 0.00 O ATOM 570 CB PRO A 39 -0.933 -10.893 -6.681 1.00 0.00 C ATOM 571 CG PRO A 39 -0.627 -12.304 -6.312 1.00 0.00 C ATOM 572 CD PRO A 39 0.331 -12.229 -5.157 1.00 0.00 C ATOM 0 HA PRO A 39 0.981 -9.959 -7.262 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -1.769 -10.505 -6.099 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -1.210 -10.810 -7.732 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -1.534 -12.840 -6.033 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -0.185 -12.840 -7.152 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -0.191 -12.239 -4.200 1.00 0.00 H new ATOM 0 HD3 PRO A 39 1.022 -13.072 -5.152 1.00 0.00 H new ATOM 580 N ILE A 40 -0.139 -8.621 -4.546 1.00 0.00 N ATOM 581 CA ILE A 40 -0.454 -7.344 -3.917 1.00 0.00 C ATOM 582 C ILE A 40 0.758 -6.419 -3.908 1.00 0.00 C ATOM 583 O ILE A 40 0.619 -5.196 -3.952 1.00 0.00 O ATOM 584 CB ILE A 40 -0.950 -7.537 -2.470 1.00 0.00 C ATOM 585 CG1 ILE A 40 -2.065 -8.582 -2.424 1.00 0.00 C ATOM 586 CG2 ILE A 40 -1.432 -6.215 -1.893 1.00 0.00 C ATOM 587 CD1 ILE A 40 -2.344 -9.108 -1.033 1.00 0.00 C ATOM 0 H ILE A 40 -0.064 -9.404 -3.896 1.00 0.00 H new ATOM 0 HA ILE A 40 -1.249 -6.889 -4.508 1.00 0.00 H new ATOM 0 HB ILE A 40 -0.118 -7.894 -1.863 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -2.978 -8.145 -2.828 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -1.797 -9.416 -3.072 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -1.779 -6.369 -0.871 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -0.612 -5.497 -1.894 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -2.251 -5.830 -2.500 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -3.146 -9.845 -1.077 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -1.444 -9.575 -0.633 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -2.644 -8.284 -0.386 1.00 0.00 H new ATOM 599 N PHE A 41 1.948 -7.009 -3.848 1.00 0.00 N ATOM 600 CA PHE A 41 3.184 -6.236 -3.830 1.00 0.00 C ATOM 601 C PHE A 41 3.700 -5.996 -5.245 1.00 0.00 C ATOM 602 O PHE A 41 4.172 -4.905 -5.568 1.00 0.00 O ATOM 603 CB PHE A 41 4.249 -6.958 -3.003 1.00 0.00 C ATOM 604 CG PHE A 41 4.051 -6.823 -1.521 1.00 0.00 C ATOM 605 CD1 PHE A 41 2.959 -7.405 -0.898 1.00 0.00 C ATOM 606 CD2 PHE A 41 4.958 -6.114 -0.749 1.00 0.00 C ATOM 607 CE1 PHE A 41 2.774 -7.283 0.465 1.00 0.00 C ATOM 608 CE2 PHE A 41 4.778 -5.988 0.615 1.00 0.00 C ATOM 609 CZ PHE A 41 3.685 -6.573 1.223 1.00 0.00 C ATOM 0 H PHE A 41 2.082 -8.020 -3.811 1.00 0.00 H new ATOM 0 HA PHE A 41 2.970 -5.270 -3.373 1.00 0.00 H new ATOM 0 HB2 PHE A 41 4.247 -8.016 -3.267 1.00 0.00 H new ATOM 0 HB3 PHE A 41 5.231 -6.565 -3.267 1.00 0.00 H new ATOM 0 HD1 PHE A 41 2.244 -7.961 -1.486 1.00 0.00 H new ATOM 0 HD2 PHE A 41 5.815 -5.655 -1.219 1.00 0.00 H new ATOM 0 HE1 PHE A 41 1.918 -7.742 0.938 1.00 0.00 H new ATOM 0 HE2 PHE A 41 5.492 -5.432 1.205 1.00 0.00 H new ATOM 0 HZ PHE A 41 3.543 -6.476 2.289 1.00 0.00 H new ATOM 619 N ASP A 42 3.608 -7.020 -6.086 1.00 0.00 N ATOM 620 CA ASP A 42 4.069 -6.921 -7.467 1.00 0.00 C ATOM 621 C ASP A 42 3.326 -5.817 -8.214 1.00 0.00 C ATOM 622 O ASP A 42 3.856 -5.228 -9.157 1.00 0.00 O ATOM 623 CB ASP A 42 3.880 -8.256 -8.186 1.00 0.00 C ATOM 624 CG ASP A 42 4.972 -8.525 -9.203 1.00 0.00 C ATOM 625 OD1 ASP A 42 5.092 -7.741 -10.168 1.00 0.00 O ATOM 626 OD2 ASP A 42 5.709 -9.520 -9.034 1.00 0.00 O ATOM 0 H ASP A 42 3.218 -7.929 -5.836 1.00 0.00 H new ATOM 0 HA ASP A 42 5.130 -6.671 -7.451 1.00 0.00 H new ATOM 0 HB2 ASP A 42 3.864 -9.062 -7.452 1.00 0.00 H new ATOM 0 HB3 ASP A 42 2.912 -8.262 -8.687 1.00 0.00 H new ATOM 631 N ASP A 43 2.096 -5.543 -7.791 1.00 0.00 N ATOM 632 CA ASP A 43 1.282 -4.511 -8.426 1.00 0.00 C ATOM 633 C ASP A 43 1.530 -3.148 -7.788 1.00 0.00 C ATOM 634 O ASP A 43 1.410 -2.114 -8.445 1.00 0.00 O ATOM 635 CB ASP A 43 -0.201 -4.871 -8.327 1.00 0.00 C ATOM 636 CG ASP A 43 -0.970 -4.501 -9.580 1.00 0.00 C ATOM 637 OD1 ASP A 43 -0.456 -4.756 -10.689 1.00 0.00 O ATOM 638 OD2 ASP A 43 -2.086 -3.954 -9.452 1.00 0.00 O ATOM 0 H ASP A 43 1.641 -6.020 -7.013 1.00 0.00 H new ATOM 0 HA ASP A 43 1.567 -4.455 -9.476 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -0.301 -5.941 -8.145 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -0.640 -4.360 -7.470 1.00 0.00 H new ATOM 643 N MET A 44 1.871 -3.152 -6.503 1.00 0.00 N ATOM 644 CA MET A 44 2.131 -1.913 -5.777 1.00 0.00 C ATOM 645 C MET A 44 3.590 -1.483 -5.918 1.00 0.00 C ATOM 646 O MET A 44 3.924 -0.317 -5.714 1.00 0.00 O ATOM 647 CB MET A 44 1.780 -2.082 -4.298 1.00 0.00 C ATOM 648 CG MET A 44 0.306 -2.355 -4.049 1.00 0.00 C ATOM 649 SD MET A 44 -0.608 -0.870 -3.591 1.00 0.00 S ATOM 650 CE MET A 44 0.027 0.302 -4.790 1.00 0.00 C ATOM 0 H MET A 44 1.974 -3.998 -5.943 1.00 0.00 H new ATOM 0 HA MET A 44 1.503 -1.135 -6.210 1.00 0.00 H new ATOM 0 HB2 MET A 44 2.367 -2.902 -3.885 1.00 0.00 H new ATOM 0 HB3 MET A 44 2.070 -1.180 -3.759 1.00 0.00 H new ATOM 0 HG2 MET A 44 -0.136 -2.787 -4.947 1.00 0.00 H new ATOM 0 HG3 MET A 44 0.207 -3.097 -3.257 1.00 0.00 H new ATOM 0 HE1 MET A 44 -0.495 1.252 -4.682 1.00 0.00 H new ATOM 0 HE2 MET A 44 1.093 0.453 -4.622 1.00 0.00 H new ATOM 0 HE3 MET A 44 -0.130 -0.086 -5.796 1.00 0.00 H new ATOM 660 N LEU A 45 4.457 -2.432 -6.265 1.00 0.00 N ATOM 661 CA LEU A 45 5.879 -2.147 -6.428 1.00 0.00 C ATOM 662 C LEU A 45 6.102 -1.010 -7.422 1.00 0.00 C ATOM 663 O LEU A 45 6.886 -0.096 -7.168 1.00 0.00 O ATOM 664 CB LEU A 45 6.621 -3.401 -6.896 1.00 0.00 C ATOM 665 CG LEU A 45 7.114 -4.316 -5.776 1.00 0.00 C ATOM 666 CD1 LEU A 45 7.508 -5.675 -6.332 1.00 0.00 C ATOM 667 CD2 LEU A 45 8.287 -3.678 -5.045 1.00 0.00 C ATOM 0 H LEU A 45 4.199 -3.404 -6.438 1.00 0.00 H new ATOM 0 HA LEU A 45 6.272 -1.838 -5.460 1.00 0.00 H new ATOM 0 HB2 LEU A 45 5.961 -3.973 -7.548 1.00 0.00 H new ATOM 0 HB3 LEU A 45 7.477 -3.095 -7.498 1.00 0.00 H new ATOM 0 HG LEU A 45 6.301 -4.459 -5.065 1.00 0.00 H new ATOM 0 HD11 LEU A 45 7.857 -6.313 -5.520 1.00 0.00 H new ATOM 0 HD12 LEU A 45 6.644 -6.136 -6.811 1.00 0.00 H new ATOM 0 HD13 LEU A 45 8.306 -5.551 -7.064 1.00 0.00 H new ATOM 0 HD21 LEU A 45 8.626 -4.343 -4.251 1.00 0.00 H new ATOM 0 HD22 LEU A 45 9.103 -3.506 -5.747 1.00 0.00 H new ATOM 0 HD23 LEU A 45 7.973 -2.728 -4.613 1.00 0.00 H new ATOM 679 N HIS A 46 5.408 -1.074 -8.554 1.00 0.00 N ATOM 680 CA HIS A 46 5.532 -0.051 -9.585 1.00 0.00 C ATOM 681 C HIS A 46 5.086 1.311 -9.060 1.00 0.00 C ATOM 682 O HIS A 46 5.574 2.348 -9.507 1.00 0.00 O ATOM 683 CB HIS A 46 4.705 -0.432 -10.814 1.00 0.00 C ATOM 684 CG HIS A 46 5.278 0.076 -12.101 1.00 0.00 C ATOM 685 ND1 HIS A 46 5.670 -0.737 -13.141 1.00 0.00 N ATOM 686 CD2 HIS A 46 5.523 1.348 -12.507 1.00 0.00 C ATOM 687 CE1 HIS A 46 6.133 0.047 -14.124 1.00 0.00 C ATOM 688 NE2 HIS A 46 6.064 1.322 -13.789 1.00 0.00 N ATOM 0 H HIS A 46 4.754 -1.824 -8.780 1.00 0.00 H new ATOM 0 HA HIS A 46 6.582 0.016 -9.868 1.00 0.00 H new ATOM 0 HB2 HIS A 46 4.624 -1.518 -10.865 1.00 0.00 H new ATOM 0 HB3 HIS A 46 3.694 -0.042 -10.697 1.00 0.00 H new ATOM 0 HD2 HIS A 46 5.329 2.238 -11.927 1.00 0.00 H new ATOM 0 HE1 HIS A 46 6.513 -0.317 -15.067 1.00 0.00 H new ATOM 0 HE2 HIS A 46 6.348 2.123 -14.353 1.00 0.00 H new ATOM 696 N PHE A 47 4.156 1.298 -8.110 1.00 0.00 N ATOM 697 CA PHE A 47 3.645 2.534 -7.525 1.00 0.00 C ATOM 698 C PHE A 47 4.650 3.131 -6.546 1.00 0.00 C ATOM 699 O PHE A 47 4.723 4.349 -6.381 1.00 0.00 O ATOM 700 CB PHE A 47 2.315 2.275 -6.815 1.00 0.00 C ATOM 701 CG PHE A 47 1.180 1.984 -7.756 1.00 0.00 C ATOM 702 CD1 PHE A 47 1.128 0.786 -8.450 1.00 0.00 C ATOM 703 CD2 PHE A 47 0.163 2.906 -7.942 1.00 0.00 C ATOM 704 CE1 PHE A 47 0.085 0.513 -9.314 1.00 0.00 C ATOM 705 CE2 PHE A 47 -0.884 2.640 -8.805 1.00 0.00 C ATOM 706 CZ PHE A 47 -0.922 1.442 -9.491 1.00 0.00 C ATOM 0 H PHE A 47 3.741 0.447 -7.729 1.00 0.00 H new ATOM 0 HA PHE A 47 3.485 3.249 -8.332 1.00 0.00 H new ATOM 0 HB2 PHE A 47 2.435 1.434 -6.132 1.00 0.00 H new ATOM 0 HB3 PHE A 47 2.060 3.144 -6.209 1.00 0.00 H new ATOM 0 HD1 PHE A 47 1.913 0.056 -8.314 1.00 0.00 H new ATOM 0 HD2 PHE A 47 0.188 3.844 -7.407 1.00 0.00 H new ATOM 0 HE1 PHE A 47 0.057 -0.424 -9.850 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -1.670 3.367 -8.942 1.00 0.00 H new ATOM 0 HZ PHE A 47 -1.739 1.231 -10.166 1.00 0.00 H new ATOM 716 N LEU A 48 5.421 2.267 -5.895 1.00 0.00 N ATOM 717 CA LEU A 48 6.421 2.710 -4.929 1.00 0.00 C ATOM 718 C LEU A 48 7.698 3.158 -5.633 1.00 0.00 C ATOM 719 O LEU A 48 7.902 2.868 -6.811 1.00 0.00 O ATOM 720 CB LEU A 48 6.737 1.586 -3.939 1.00 0.00 C ATOM 721 CG LEU A 48 5.628 1.280 -2.931 1.00 0.00 C ATOM 722 CD1 LEU A 48 5.600 -0.204 -2.601 1.00 0.00 C ATOM 723 CD2 LEU A 48 5.814 2.107 -1.668 1.00 0.00 C ATOM 0 H LEU A 48 5.373 1.256 -6.018 1.00 0.00 H new ATOM 0 HA LEU A 48 6.012 3.561 -4.384 1.00 0.00 H new ATOM 0 HB2 LEU A 48 6.956 0.678 -4.501 1.00 0.00 H new ATOM 0 HB3 LEU A 48 7.642 1.849 -3.392 1.00 0.00 H new ATOM 0 HG LEU A 48 4.671 1.548 -3.379 1.00 0.00 H new ATOM 0 HD11 LEU A 48 4.805 -0.402 -1.882 1.00 0.00 H new ATOM 0 HD12 LEU A 48 5.418 -0.776 -3.511 1.00 0.00 H new ATOM 0 HD13 LEU A 48 6.558 -0.500 -2.173 1.00 0.00 H new ATOM 0 HD21 LEU A 48 5.016 1.877 -0.962 1.00 0.00 H new ATOM 0 HD22 LEU A 48 6.778 1.870 -1.217 1.00 0.00 H new ATOM 0 HD23 LEU A 48 5.781 3.167 -1.919 1.00 0.00 H new ATOM 735 N ASN A 49 8.553 3.866 -4.903 1.00 0.00 N ATOM 736 CA ASN A 49 9.810 4.354 -5.457 1.00 0.00 C ATOM 737 C ASN A 49 10.990 3.535 -4.936 1.00 0.00 C ATOM 738 O ASN A 49 10.883 2.859 -3.913 1.00 0.00 O ATOM 739 CB ASN A 49 10.007 5.830 -5.108 1.00 0.00 C ATOM 740 CG ASN A 49 8.857 6.696 -5.586 1.00 0.00 C ATOM 741 OD1 ASN A 49 7.698 6.284 -5.549 1.00 0.00 O ATOM 742 ND2 ASN A 49 9.174 7.903 -6.040 1.00 0.00 N ATOM 0 H ASN A 49 8.398 4.115 -3.926 1.00 0.00 H new ATOM 0 HA ASN A 49 9.766 4.246 -6.541 1.00 0.00 H new ATOM 0 HB2 ASN A 49 10.112 5.934 -4.028 1.00 0.00 H new ATOM 0 HB3 ASN A 49 10.936 6.185 -5.555 1.00 0.00 H new ATOM 0 HD21 ASN A 49 8.443 8.530 -6.376 1.00 0.00 H new ATOM 0 HD22 ASN A 49 10.149 8.203 -6.052 1.00 0.00 H new ATOM 749 N PRO A 50 12.136 3.588 -5.636 1.00 0.00 N ATOM 750 CA PRO A 50 13.339 2.847 -5.239 1.00 0.00 C ATOM 751 C PRO A 50 13.726 3.107 -3.787 1.00 0.00 C ATOM 752 O PRO A 50 14.138 2.193 -3.072 1.00 0.00 O ATOM 753 CB PRO A 50 14.416 3.384 -6.184 1.00 0.00 C ATOM 754 CG PRO A 50 13.669 3.864 -7.379 1.00 0.00 C ATOM 755 CD PRO A 50 12.350 4.371 -6.868 1.00 0.00 C ATOM 0 HA PRO A 50 13.194 1.769 -5.306 1.00 0.00 H new ATOM 0 HB2 PRO A 50 14.982 4.192 -5.720 1.00 0.00 H new ATOM 0 HB3 PRO A 50 15.132 2.606 -6.451 1.00 0.00 H new ATOM 0 HG2 PRO A 50 14.219 4.654 -7.891 1.00 0.00 H new ATOM 0 HG3 PRO A 50 13.525 3.058 -8.098 1.00 0.00 H new ATOM 0 HD2 PRO A 50 12.383 5.441 -6.663 1.00 0.00 H new ATOM 0 HD3 PRO A 50 11.550 4.209 -7.591 1.00 0.00 H new ATOM 763 N GLU A 51 13.591 4.357 -3.358 1.00 0.00 N ATOM 764 CA GLU A 51 13.928 4.736 -1.991 1.00 0.00 C ATOM 765 C GLU A 51 12.880 4.221 -1.008 1.00 0.00 C ATOM 766 O GLU A 51 13.191 3.922 0.145 1.00 0.00 O ATOM 767 CB GLU A 51 14.050 6.258 -1.877 1.00 0.00 C ATOM 768 CG GLU A 51 15.306 6.714 -1.152 1.00 0.00 C ATOM 769 CD GLU A 51 15.086 6.896 0.337 1.00 0.00 C ATOM 770 OE1 GLU A 51 14.453 7.900 0.727 1.00 0.00 O ATOM 771 OE2 GLU A 51 15.546 6.032 1.115 1.00 0.00 O ATOM 0 H GLU A 51 13.251 5.125 -3.937 1.00 0.00 H new ATOM 0 HA GLU A 51 14.887 4.282 -1.740 1.00 0.00 H new ATOM 0 HB2 GLU A 51 14.040 6.691 -2.877 1.00 0.00 H new ATOM 0 HB3 GLU A 51 13.177 6.646 -1.353 1.00 0.00 H new ATOM 0 HG2 GLU A 51 16.099 5.983 -1.312 1.00 0.00 H new ATOM 0 HG3 GLU A 51 15.648 7.655 -1.583 1.00 0.00 H new ATOM 778 N GLU A 52 11.639 4.121 -1.471 1.00 0.00 N ATOM 779 CA GLU A 52 10.546 3.644 -0.632 1.00 0.00 C ATOM 780 C GLU A 52 10.586 2.125 -0.496 1.00 0.00 C ATOM 781 O GLU A 52 10.281 1.579 0.564 1.00 0.00 O ATOM 782 CB GLU A 52 9.199 4.080 -1.214 1.00 0.00 C ATOM 783 CG GLU A 52 9.082 5.583 -1.412 1.00 0.00 C ATOM 784 CD GLU A 52 7.829 5.974 -2.170 1.00 0.00 C ATOM 785 OE1 GLU A 52 6.829 5.229 -2.090 1.00 0.00 O ATOM 786 OE2 GLU A 52 7.846 7.024 -2.846 1.00 0.00 O ATOM 0 H GLU A 52 11.365 4.364 -2.423 1.00 0.00 H new ATOM 0 HA GLU A 52 10.665 4.083 0.359 1.00 0.00 H new ATOM 0 HB2 GLU A 52 9.048 3.582 -2.172 1.00 0.00 H new ATOM 0 HB3 GLU A 52 8.401 3.745 -0.552 1.00 0.00 H new ATOM 0 HG2 GLU A 52 9.083 6.075 -0.439 1.00 0.00 H new ATOM 0 HG3 GLU A 52 9.957 5.944 -1.953 1.00 0.00 H new ATOM 793 N LEU A 53 10.964 1.451 -1.576 1.00 0.00 N ATOM 794 CA LEU A 53 11.043 -0.005 -1.578 1.00 0.00 C ATOM 795 C LEU A 53 12.123 -0.493 -0.617 1.00 0.00 C ATOM 796 O LEU A 53 11.971 -1.529 0.030 1.00 0.00 O ATOM 797 CB LEU A 53 11.331 -0.520 -2.990 1.00 0.00 C ATOM 798 CG LEU A 53 10.214 -0.283 -4.007 1.00 0.00 C ATOM 799 CD1 LEU A 53 10.581 -0.886 -5.354 1.00 0.00 C ATOM 800 CD2 LEU A 53 8.901 -0.862 -3.501 1.00 0.00 C ATOM 0 H LEU A 53 11.220 1.889 -2.461 1.00 0.00 H new ATOM 0 HA LEU A 53 10.081 -0.396 -1.245 1.00 0.00 H new ATOM 0 HB2 LEU A 53 12.241 -0.044 -3.355 1.00 0.00 H new ATOM 0 HB3 LEU A 53 11.531 -1.590 -2.936 1.00 0.00 H new ATOM 0 HG LEU A 53 10.088 0.792 -4.136 1.00 0.00 H new ATOM 0 HD11 LEU A 53 9.774 -0.707 -6.065 1.00 0.00 H new ATOM 0 HD12 LEU A 53 11.497 -0.424 -5.722 1.00 0.00 H new ATOM 0 HD13 LEU A 53 10.735 -1.959 -5.242 1.00 0.00 H new ATOM 0 HD21 LEU A 53 8.117 -0.684 -4.237 1.00 0.00 H new ATOM 0 HD22 LEU A 53 9.013 -1.935 -3.342 1.00 0.00 H new ATOM 0 HD23 LEU A 53 8.630 -0.383 -2.560 1.00 0.00 H new ATOM 812 N ARG A 54 13.215 0.259 -0.531 1.00 0.00 N ATOM 813 CA ARG A 54 14.321 -0.097 0.350 1.00 0.00 C ATOM 814 C ARG A 54 13.874 -0.117 1.809 1.00 0.00 C ATOM 815 O ARG A 54 14.408 -0.872 2.621 1.00 0.00 O ATOM 816 CB ARG A 54 15.478 0.888 0.174 1.00 0.00 C ATOM 817 CG ARG A 54 16.737 0.490 0.929 1.00 0.00 C ATOM 818 CD ARG A 54 17.993 0.851 0.153 1.00 0.00 C ATOM 819 NE ARG A 54 19.021 1.428 1.014 1.00 0.00 N ATOM 820 CZ ARG A 54 20.144 1.981 0.560 1.00 0.00 C ATOM 821 NH1 ARG A 54 20.387 2.033 -0.743 1.00 0.00 N ATOM 822 NH2 ARG A 54 21.026 2.484 1.413 1.00 0.00 N ATOM 0 H ARG A 54 13.358 1.119 -1.061 1.00 0.00 H new ATOM 0 HA ARG A 54 14.658 -1.097 0.079 1.00 0.00 H new ATOM 0 HB2 ARG A 54 15.713 0.974 -0.887 1.00 0.00 H new ATOM 0 HB3 ARG A 54 15.159 1.874 0.511 1.00 0.00 H new ATOM 0 HG2 ARG A 54 16.753 0.987 1.899 1.00 0.00 H new ATOM 0 HG3 ARG A 54 16.723 -0.583 1.121 1.00 0.00 H new ATOM 0 HD2 ARG A 54 18.387 -0.041 -0.334 1.00 0.00 H new ATOM 0 HD3 ARG A 54 17.741 1.560 -0.636 1.00 0.00 H new ATOM 0 HE ARG A 54 18.870 1.406 2.023 1.00 0.00 H new ATOM 0 HH11 ARG A 54 19.712 1.648 -1.403 1.00 0.00 H new ATOM 0 HH12 ARG A 54 21.249 2.458 -1.084 1.00 0.00 H new ATOM 0 HH21 ARG A 54 20.844 2.447 2.416 1.00 0.00 H new ATOM 0 HH22 ARG A 54 21.887 2.908 1.066 1.00 0.00 H new ATOM 836 N VAL A 55 12.892 0.717 2.133 1.00 0.00 N ATOM 837 CA VAL A 55 12.374 0.796 3.493 1.00 0.00 C ATOM 838 C VAL A 55 11.540 -0.434 3.839 1.00 0.00 C ATOM 839 O VAL A 55 11.498 -0.863 4.991 1.00 0.00 O ATOM 840 CB VAL A 55 11.514 2.058 3.696 1.00 0.00 C ATOM 841 CG1 VAL A 55 11.150 2.228 5.163 1.00 0.00 C ATOM 842 CG2 VAL A 55 12.240 3.287 3.173 1.00 0.00 C ATOM 0 H VAL A 55 12.439 1.348 1.472 1.00 0.00 H new ATOM 0 HA VAL A 55 13.238 0.843 4.156 1.00 0.00 H new ATOM 0 HB VAL A 55 10.590 1.941 3.129 1.00 0.00 H new ATOM 0 HG11 VAL A 55 10.543 3.125 5.286 1.00 0.00 H new ATOM 0 HG12 VAL A 55 10.586 1.359 5.501 1.00 0.00 H new ATOM 0 HG13 VAL A 55 12.060 2.323 5.755 1.00 0.00 H new ATOM 0 HG21 VAL A 55 11.618 4.169 3.325 1.00 0.00 H new ATOM 0 HG22 VAL A 55 13.181 3.410 3.710 1.00 0.00 H new ATOM 0 HG23 VAL A 55 12.443 3.165 2.109 1.00 0.00 H new ATOM 852 N ILE A 56 10.878 -0.996 2.833 1.00 0.00 N ATOM 853 CA ILE A 56 10.045 -2.176 3.031 1.00 0.00 C ATOM 854 C ILE A 56 10.858 -3.456 2.870 1.00 0.00 C ATOM 855 O ILE A 56 10.588 -4.461 3.527 1.00 0.00 O ATOM 856 CB ILE A 56 8.865 -2.203 2.041 1.00 0.00 C ATOM 857 CG1 ILE A 56 8.151 -0.851 2.027 1.00 0.00 C ATOM 858 CG2 ILE A 56 7.895 -3.318 2.405 1.00 0.00 C ATOM 859 CD1 ILE A 56 7.074 -0.747 0.969 1.00 0.00 C ATOM 0 H ILE A 56 10.902 -0.653 1.873 1.00 0.00 H new ATOM 0 HA ILE A 56 9.656 -2.121 4.048 1.00 0.00 H new ATOM 0 HB ILE A 56 9.253 -2.397 1.041 1.00 0.00 H new ATOM 0 HG12 ILE A 56 7.705 -0.674 3.006 1.00 0.00 H new ATOM 0 HG13 ILE A 56 8.886 -0.063 1.864 1.00 0.00 H new ATOM 0 HG21 ILE A 56 7.066 -3.325 1.697 1.00 0.00 H new ATOM 0 HG22 ILE A 56 8.412 -4.277 2.368 1.00 0.00 H new ATOM 0 HG23 ILE A 56 7.511 -3.152 3.411 1.00 0.00 H new ATOM 0 HD11 ILE A 56 6.610 0.238 1.017 1.00 0.00 H new ATOM 0 HD12 ILE A 56 7.517 -0.892 -0.016 1.00 0.00 H new ATOM 0 HD13 ILE A 56 6.318 -1.513 1.143 1.00 0.00 H new ATOM 871 N GLU A 57 11.854 -3.412 1.991 1.00 0.00 N ATOM 872 CA GLU A 57 12.707 -4.569 1.742 1.00 0.00 C ATOM 873 C GLU A 57 13.417 -5.009 3.019 1.00 0.00 C ATOM 874 O GLU A 57 13.721 -6.188 3.197 1.00 0.00 O ATOM 875 CB GLU A 57 13.733 -4.245 0.654 1.00 0.00 C ATOM 876 CG GLU A 57 13.481 -4.975 -0.656 1.00 0.00 C ATOM 877 CD GLU A 57 14.744 -5.155 -1.475 1.00 0.00 C ATOM 878 OE1 GLU A 57 15.674 -4.335 -1.321 1.00 0.00 O ATOM 879 OE2 GLU A 57 14.803 -6.116 -2.272 1.00 0.00 O ATOM 0 H GLU A 57 12.090 -2.587 1.439 1.00 0.00 H new ATOM 0 HA GLU A 57 12.076 -5.390 1.402 1.00 0.00 H new ATOM 0 HB2 GLU A 57 13.727 -3.171 0.469 1.00 0.00 H new ATOM 0 HB3 GLU A 57 14.728 -4.500 1.017 1.00 0.00 H new ATOM 0 HG2 GLU A 57 13.047 -5.952 -0.445 1.00 0.00 H new ATOM 0 HG3 GLU A 57 12.748 -4.420 -1.242 1.00 0.00 H new ATOM 886 N GLU A 58 13.681 -4.053 3.905 1.00 0.00 N ATOM 887 CA GLU A 58 14.357 -4.342 5.164 1.00 0.00 C ATOM 888 C GLU A 58 13.578 -5.370 5.980 1.00 0.00 C ATOM 889 O GLU A 58 14.153 -6.311 6.524 1.00 0.00 O ATOM 890 CB GLU A 58 14.535 -3.058 5.977 1.00 0.00 C ATOM 891 CG GLU A 58 15.552 -2.097 5.380 1.00 0.00 C ATOM 892 CD GLU A 58 16.748 -1.876 6.286 1.00 0.00 C ATOM 893 OE1 GLU A 58 17.621 -2.768 6.345 1.00 0.00 O ATOM 894 OE2 GLU A 58 16.813 -0.810 6.934 1.00 0.00 O ATOM 0 H GLU A 58 13.437 -3.071 3.774 1.00 0.00 H new ATOM 0 HA GLU A 58 15.338 -4.758 4.933 1.00 0.00 H new ATOM 0 HB2 GLU A 58 13.573 -2.552 6.057 1.00 0.00 H new ATOM 0 HB3 GLU A 58 14.844 -3.318 6.989 1.00 0.00 H new ATOM 0 HG2 GLU A 58 15.894 -2.486 4.421 1.00 0.00 H new ATOM 0 HG3 GLU A 58 15.069 -1.140 5.182 1.00 0.00 H new ATOM 901 N ILE A 59 12.264 -5.182 6.060 1.00 0.00 N ATOM 902 CA ILE A 59 11.406 -6.093 6.808 1.00 0.00 C ATOM 903 C ILE A 59 11.482 -7.510 6.240 1.00 0.00 C ATOM 904 O ILE A 59 11.057 -7.754 5.110 1.00 0.00 O ATOM 905 CB ILE A 59 9.938 -5.622 6.790 1.00 0.00 C ATOM 906 CG1 ILE A 59 9.841 -4.157 7.225 1.00 0.00 C ATOM 907 CG2 ILE A 59 9.086 -6.504 7.691 1.00 0.00 C ATOM 908 CD1 ILE A 59 8.870 -3.346 6.396 1.00 0.00 C ATOM 0 H ILE A 59 11.771 -4.407 5.616 1.00 0.00 H new ATOM 0 HA ILE A 59 11.766 -6.097 7.837 1.00 0.00 H new ATOM 0 HB ILE A 59 9.560 -5.704 5.771 1.00 0.00 H new ATOM 0 HG12 ILE A 59 9.537 -4.116 8.271 1.00 0.00 H new ATOM 0 HG13 ILE A 59 10.829 -3.701 7.163 1.00 0.00 H new ATOM 0 HG21 ILE A 59 8.053 -6.158 7.667 1.00 0.00 H new ATOM 0 HG22 ILE A 59 9.132 -7.535 7.340 1.00 0.00 H new ATOM 0 HG23 ILE A 59 9.462 -6.452 8.713 1.00 0.00 H new ATOM 0 HD11 ILE A 59 8.852 -2.318 6.759 1.00 0.00 H new ATOM 0 HD12 ILE A 59 9.185 -3.357 5.353 1.00 0.00 H new ATOM 0 HD13 ILE A 59 7.873 -3.778 6.478 1.00 0.00 H new ATOM 920 N PRO A 60 12.024 -8.468 7.014 1.00 0.00 N ATOM 921 CA PRO A 60 12.147 -9.860 6.572 1.00 0.00 C ATOM 922 C PRO A 60 10.801 -10.574 6.520 1.00 0.00 C ATOM 923 O PRO A 60 10.518 -11.321 5.583 1.00 0.00 O ATOM 924 CB PRO A 60 13.046 -10.492 7.635 1.00 0.00 C ATOM 925 CG PRO A 60 12.815 -9.675 8.858 1.00 0.00 C ATOM 926 CD PRO A 60 12.558 -8.273 8.377 1.00 0.00 C ATOM 0 HA PRO A 60 12.545 -9.932 5.560 1.00 0.00 H new ATOM 0 HB2 PRO A 60 12.787 -11.538 7.802 1.00 0.00 H new ATOM 0 HB3 PRO A 60 14.093 -10.467 7.334 1.00 0.00 H new ATOM 0 HG2 PRO A 60 11.966 -10.054 9.426 1.00 0.00 H new ATOM 0 HG3 PRO A 60 13.681 -9.708 9.519 1.00 0.00 H new ATOM 0 HD2 PRO A 60 11.845 -7.754 9.017 1.00 0.00 H new ATOM 0 HD3 PRO A 60 13.471 -7.678 8.369 1.00 0.00 H new ATOM 934 N GLN A 61 9.974 -10.339 7.533 1.00 0.00 N ATOM 935 CA GLN A 61 8.656 -10.961 7.603 1.00 0.00 C ATOM 936 C GLN A 61 7.785 -10.525 6.429 1.00 0.00 C ATOM 937 O GLN A 61 8.163 -9.644 5.657 1.00 0.00 O ATOM 938 CB GLN A 61 7.970 -10.602 8.923 1.00 0.00 C ATOM 939 CG GLN A 61 8.233 -11.603 10.037 1.00 0.00 C ATOM 940 CD GLN A 61 6.996 -11.895 10.864 1.00 0.00 C ATOM 941 OE1 GLN A 61 5.879 -11.560 10.471 1.00 0.00 O ATOM 942 NE2 GLN A 61 7.191 -12.524 12.017 1.00 0.00 N ATOM 0 H GLN A 61 10.192 -9.723 8.316 1.00 0.00 H new ATOM 0 HA GLN A 61 8.788 -12.042 7.552 1.00 0.00 H new ATOM 0 HB2 GLN A 61 8.310 -9.617 9.243 1.00 0.00 H new ATOM 0 HB3 GLN A 61 6.895 -10.530 8.757 1.00 0.00 H new ATOM 0 HG2 GLN A 61 8.604 -12.532 9.605 1.00 0.00 H new ATOM 0 HG3 GLN A 61 9.018 -11.218 10.688 1.00 0.00 H new ATOM 0 HE21 GLN A 61 8.135 -12.783 12.303 1.00 0.00 H new ATOM 0 HE22 GLN A 61 6.397 -12.748 12.616 1.00 0.00 H new ATOM 951 N ALA A 62 6.618 -11.149 6.302 1.00 0.00 N ATOM 952 CA ALA A 62 5.693 -10.826 5.222 1.00 0.00 C ATOM 953 C ALA A 62 4.490 -10.050 5.745 1.00 0.00 C ATOM 954 O ALA A 62 4.086 -9.044 5.161 1.00 0.00 O ATOM 955 CB ALA A 62 5.238 -12.096 4.520 1.00 0.00 C ATOM 0 H ALA A 62 6.291 -11.880 6.933 1.00 0.00 H new ATOM 0 HA ALA A 62 6.217 -10.195 4.504 1.00 0.00 H new ATOM 0 HB1 ALA A 62 4.548 -11.840 3.716 1.00 0.00 H new ATOM 0 HB2 ALA A 62 6.104 -12.612 4.105 1.00 0.00 H new ATOM 0 HB3 ALA A 62 4.736 -12.747 5.235 1.00 0.00 H new ATOM 961 N GLU A 63 3.921 -10.522 6.849 1.00 0.00 N ATOM 962 CA GLU A 63 2.763 -9.873 7.453 1.00 0.00 C ATOM 963 C GLU A 63 3.084 -8.430 7.832 1.00 0.00 C ATOM 964 O GLU A 63 2.210 -7.562 7.809 1.00 0.00 O ATOM 965 CB GLU A 63 2.303 -10.649 8.690 1.00 0.00 C ATOM 966 CG GLU A 63 0.804 -10.887 8.735 1.00 0.00 C ATOM 967 CD GLU A 63 0.417 -12.265 8.234 1.00 0.00 C ATOM 968 OE1 GLU A 63 0.623 -12.539 7.033 1.00 0.00 O ATOM 969 OE2 GLU A 63 -0.093 -13.069 9.043 1.00 0.00 O ATOM 0 H GLU A 63 4.244 -11.353 7.345 1.00 0.00 H new ATOM 0 HA GLU A 63 1.958 -9.866 6.718 1.00 0.00 H new ATOM 0 HB2 GLU A 63 2.816 -11.610 8.717 1.00 0.00 H new ATOM 0 HB3 GLU A 63 2.603 -10.102 9.584 1.00 0.00 H new ATOM 0 HG2 GLU A 63 0.451 -10.764 9.759 1.00 0.00 H new ATOM 0 HG3 GLU A 63 0.302 -10.131 8.132 1.00 0.00 H new ATOM 976 N ASP A 64 4.343 -8.180 8.177 1.00 0.00 N ATOM 977 CA ASP A 64 4.780 -6.842 8.559 1.00 0.00 C ATOM 978 C ASP A 64 5.102 -6.001 7.328 1.00 0.00 C ATOM 979 O ASP A 64 4.974 -4.777 7.351 1.00 0.00 O ATOM 980 CB ASP A 64 6.006 -6.925 9.471 1.00 0.00 C ATOM 981 CG ASP A 64 6.297 -5.610 10.167 1.00 0.00 C ATOM 982 OD1 ASP A 64 5.654 -5.330 11.201 1.00 0.00 O ATOM 983 OD2 ASP A 64 7.168 -4.859 9.678 1.00 0.00 O ATOM 0 H ASP A 64 5.078 -8.886 8.200 1.00 0.00 H new ATOM 0 HA ASP A 64 3.965 -6.361 9.100 1.00 0.00 H new ATOM 0 HB2 ASP A 64 5.847 -7.702 10.219 1.00 0.00 H new ATOM 0 HB3 ASP A 64 6.874 -7.222 8.882 1.00 0.00 H new ATOM 988 N LYS A 65 5.524 -6.665 6.257 1.00 0.00 N ATOM 989 CA LYS A 65 5.866 -5.976 5.016 1.00 0.00 C ATOM 990 C LYS A 65 4.677 -5.177 4.489 1.00 0.00 C ATOM 991 O LYS A 65 4.828 -4.036 4.054 1.00 0.00 O ATOM 992 CB LYS A 65 6.331 -6.984 3.962 1.00 0.00 C ATOM 993 CG LYS A 65 7.780 -6.797 3.542 1.00 0.00 C ATOM 994 CD LYS A 65 8.435 -8.123 3.186 1.00 0.00 C ATOM 995 CE LYS A 65 8.608 -8.276 1.684 1.00 0.00 C ATOM 996 NZ LYS A 65 7.302 -8.251 0.969 1.00 0.00 N ATOM 0 H LYS A 65 5.638 -7.678 6.222 1.00 0.00 H new ATOM 0 HA LYS A 65 6.679 -5.281 5.227 1.00 0.00 H new ATOM 0 HB2 LYS A 65 6.202 -7.993 4.354 1.00 0.00 H new ATOM 0 HB3 LYS A 65 5.692 -6.899 3.083 1.00 0.00 H new ATOM 0 HG2 LYS A 65 7.827 -6.125 2.685 1.00 0.00 H new ATOM 0 HG3 LYS A 65 8.335 -6.322 4.350 1.00 0.00 H new ATOM 0 HD2 LYS A 65 9.407 -8.192 3.674 1.00 0.00 H new ATOM 0 HD3 LYS A 65 7.828 -8.944 3.568 1.00 0.00 H new ATOM 0 HE2 LYS A 65 9.243 -7.474 1.308 1.00 0.00 H new ATOM 0 HE3 LYS A 65 9.120 -9.214 1.471 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 7.459 -8.409 -0.047 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 6.686 -9.000 1.345 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 6.847 -7.326 1.109 1.00 0.00 H new ATOM 1010 N LEU A 66 3.496 -5.785 4.532 1.00 0.00 N ATOM 1011 CA LEU A 66 2.283 -5.129 4.058 1.00 0.00 C ATOM 1012 C LEU A 66 1.946 -3.919 4.922 1.00 0.00 C ATOM 1013 O LEU A 66 1.383 -2.936 4.439 1.00 0.00 O ATOM 1014 CB LEU A 66 1.112 -6.114 4.060 1.00 0.00 C ATOM 1015 CG LEU A 66 -0.088 -5.694 3.208 1.00 0.00 C ATOM 1016 CD1 LEU A 66 0.237 -5.827 1.729 1.00 0.00 C ATOM 1017 CD2 LEU A 66 -1.311 -6.526 3.564 1.00 0.00 C ATOM 0 H LEU A 66 3.353 -6.730 4.890 1.00 0.00 H new ATOM 0 HA LEU A 66 2.459 -4.787 3.038 1.00 0.00 H new ATOM 0 HB2 LEU A 66 1.469 -7.081 3.706 1.00 0.00 H new ATOM 0 HB3 LEU A 66 0.777 -6.255 5.088 1.00 0.00 H new ATOM 0 HG LEU A 66 -0.311 -4.648 3.418 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -0.627 -5.524 1.138 1.00 0.00 H new ATOM 0 HD12 LEU A 66 1.086 -5.188 1.484 1.00 0.00 H new ATOM 0 HD13 LEU A 66 0.486 -6.864 1.503 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -2.155 -6.214 2.949 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -1.100 -7.580 3.383 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -1.556 -6.381 4.616 1.00 0.00 H new ATOM 1029 N ASP A 67 2.293 -3.997 6.203 1.00 0.00 N ATOM 1030 CA ASP A 67 2.027 -2.907 7.135 1.00 0.00 C ATOM 1031 C ASP A 67 2.730 -1.628 6.692 1.00 0.00 C ATOM 1032 O ASP A 67 2.232 -0.524 6.918 1.00 0.00 O ATOM 1033 CB ASP A 67 2.483 -3.291 8.543 1.00 0.00 C ATOM 1034 CG ASP A 67 1.918 -2.368 9.606 1.00 0.00 C ATOM 1035 OD1 ASP A 67 0.681 -2.198 9.647 1.00 0.00 O ATOM 1036 OD2 ASP A 67 2.712 -1.818 10.397 1.00 0.00 O ATOM 0 H ASP A 67 2.759 -4.803 6.619 1.00 0.00 H new ATOM 0 HA ASP A 67 0.952 -2.725 7.145 1.00 0.00 H new ATOM 0 HB2 ASP A 67 2.176 -4.315 8.755 1.00 0.00 H new ATOM 0 HB3 ASP A 67 3.572 -3.269 8.588 1.00 0.00 H new ATOM 1041 N ARG A 68 3.888 -1.783 6.059 1.00 0.00 N ATOM 1042 CA ARG A 68 4.658 -0.640 5.585 1.00 0.00 C ATOM 1043 C ARG A 68 4.082 -0.095 4.282 1.00 0.00 C ATOM 1044 O ARG A 68 4.170 1.101 4.004 1.00 0.00 O ATOM 1045 CB ARG A 68 6.124 -1.034 5.384 1.00 0.00 C ATOM 1046 CG ARG A 68 7.109 0.022 5.863 1.00 0.00 C ATOM 1047 CD ARG A 68 7.669 -0.316 7.235 1.00 0.00 C ATOM 1048 NE ARG A 68 7.443 0.759 8.198 1.00 0.00 N ATOM 1049 CZ ARG A 68 8.182 1.865 8.263 1.00 0.00 C ATOM 1050 NH1 ARG A 68 9.194 2.045 7.423 1.00 0.00 N ATOM 1051 NH2 ARG A 68 7.908 2.793 9.169 1.00 0.00 N ATOM 0 H ARG A 68 4.313 -2.689 5.863 1.00 0.00 H new ATOM 0 HA ARG A 68 4.599 0.143 6.341 1.00 0.00 H new ATOM 0 HB2 ARG A 68 6.317 -1.966 5.915 1.00 0.00 H new ATOM 0 HB3 ARG A 68 6.298 -1.228 4.326 1.00 0.00 H new ATOM 0 HG2 ARG A 68 7.926 0.109 5.147 1.00 0.00 H new ATOM 0 HG3 ARG A 68 6.613 0.992 5.901 1.00 0.00 H new ATOM 0 HD2 ARG A 68 7.206 -1.233 7.600 1.00 0.00 H new ATOM 0 HD3 ARG A 68 8.738 -0.510 7.152 1.00 0.00 H new ATOM 0 HE ARG A 68 6.674 0.656 8.860 1.00 0.00 H new ATOM 0 HH11 ARG A 68 9.409 1.334 6.723 1.00 0.00 H new ATOM 0 HH12 ARG A 68 9.757 2.894 7.477 1.00 0.00 H new ATOM 0 HH21 ARG A 68 7.131 2.660 9.816 1.00 0.00 H new ATOM 0 HH22 ARG A 68 8.474 3.640 9.219 1.00 0.00 H new ATOM 1065 N LEU A 69 3.492 -0.980 3.485 1.00 0.00 N ATOM 1066 CA LEU A 69 2.902 -0.588 2.210 1.00 0.00 C ATOM 1067 C LEU A 69 1.801 0.448 2.415 1.00 0.00 C ATOM 1068 O LEU A 69 1.608 1.335 1.584 1.00 0.00 O ATOM 1069 CB LEU A 69 2.338 -1.812 1.487 1.00 0.00 C ATOM 1070 CG LEU A 69 2.436 -1.766 -0.039 1.00 0.00 C ATOM 1071 CD1 LEU A 69 3.892 -1.758 -0.480 1.00 0.00 C ATOM 1072 CD2 LEU A 69 1.696 -2.944 -0.656 1.00 0.00 C ATOM 0 H LEU A 69 3.410 -1.974 3.700 1.00 0.00 H new ATOM 0 HA LEU A 69 3.686 -0.142 1.598 1.00 0.00 H new ATOM 0 HB2 LEU A 69 2.863 -2.699 1.843 1.00 0.00 H new ATOM 0 HB3 LEU A 69 1.291 -1.928 1.765 1.00 0.00 H new ATOM 0 HG LEU A 69 1.967 -0.846 -0.387 1.00 0.00 H new ATOM 0 HD11 LEU A 69 3.942 -1.725 -1.568 1.00 0.00 H new ATOM 0 HD12 LEU A 69 4.392 -0.882 -0.067 1.00 0.00 H new ATOM 0 HD13 LEU A 69 4.386 -2.661 -0.121 1.00 0.00 H new ATOM 0 HD21 LEU A 69 1.776 -2.895 -1.742 1.00 0.00 H new ATOM 0 HD22 LEU A 69 2.136 -3.876 -0.301 1.00 0.00 H new ATOM 0 HD23 LEU A 69 0.646 -2.905 -0.368 1.00 0.00 H new ATOM 1084 N PHE A 70 1.081 0.328 3.526 1.00 0.00 N ATOM 1085 CA PHE A 70 -0.001 1.255 3.838 1.00 0.00 C ATOM 1086 C PHE A 70 0.539 2.534 4.472 1.00 0.00 C ATOM 1087 O PHE A 70 -0.057 3.602 4.340 1.00 0.00 O ATOM 1088 CB PHE A 70 -1.011 0.593 4.778 1.00 0.00 C ATOM 1089 CG PHE A 70 -1.940 -0.361 4.084 1.00 0.00 C ATOM 1090 CD1 PHE A 70 -1.442 -1.448 3.384 1.00 0.00 C ATOM 1091 CD2 PHE A 70 -3.312 -0.170 4.133 1.00 0.00 C ATOM 1092 CE1 PHE A 70 -2.296 -2.327 2.745 1.00 0.00 C ATOM 1093 CE2 PHE A 70 -4.170 -1.046 3.496 1.00 0.00 C ATOM 1094 CZ PHE A 70 -3.661 -2.127 2.801 1.00 0.00 C ATOM 0 H PHE A 70 1.227 -0.401 4.224 1.00 0.00 H new ATOM 0 HA PHE A 70 -0.499 1.518 2.905 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -0.471 0.058 5.560 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -1.599 1.368 5.270 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -0.375 -1.610 3.337 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -3.715 0.673 4.675 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -1.896 -3.170 2.202 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -5.237 -0.886 3.541 1.00 0.00 H new ATOM 0 HZ PHE A 70 -4.329 -2.814 2.303 1.00 0.00 H new ATOM 1104 N GLU A 71 1.671 2.416 5.160 1.00 0.00 N ATOM 1105 CA GLU A 71 2.288 3.564 5.814 1.00 0.00 C ATOM 1106 C GLU A 71 2.847 4.544 4.787 1.00 0.00 C ATOM 1107 O GLU A 71 2.839 5.756 5.002 1.00 0.00 O ATOM 1108 CB GLU A 71 3.401 3.100 6.757 1.00 0.00 C ATOM 1109 CG GLU A 71 3.300 3.688 8.155 1.00 0.00 C ATOM 1110 CD GLU A 71 4.211 4.884 8.352 1.00 0.00 C ATOM 1111 OE1 GLU A 71 5.421 4.761 8.070 1.00 0.00 O ATOM 1112 OE2 GLU A 71 3.713 5.943 8.789 1.00 0.00 O ATOM 0 H GLU A 71 2.178 1.539 5.279 1.00 0.00 H new ATOM 0 HA GLU A 71 1.520 4.077 6.393 1.00 0.00 H new ATOM 0 HB2 GLU A 71 3.376 2.013 6.827 1.00 0.00 H new ATOM 0 HB3 GLU A 71 4.366 3.370 6.327 1.00 0.00 H new ATOM 0 HG2 GLU A 71 2.269 3.986 8.346 1.00 0.00 H new ATOM 0 HG3 GLU A 71 3.551 2.920 8.887 1.00 0.00 H new ATOM 1119 N ILE A 72 3.333 4.010 3.671 1.00 0.00 N ATOM 1120 CA ILE A 72 3.897 4.838 2.611 1.00 0.00 C ATOM 1121 C ILE A 72 2.816 5.307 1.644 1.00 0.00 C ATOM 1122 O ILE A 72 2.674 6.502 1.386 1.00 0.00 O ATOM 1123 CB ILE A 72 4.982 4.080 1.822 1.00 0.00 C ATOM 1124 CG1 ILE A 72 5.977 3.426 2.782 1.00 0.00 C ATOM 1125 CG2 ILE A 72 5.699 5.021 0.867 1.00 0.00 C ATOM 1126 CD1 ILE A 72 6.903 2.436 2.110 1.00 0.00 C ATOM 0 H ILE A 72 3.348 3.009 3.477 1.00 0.00 H new ATOM 0 HA ILE A 72 4.348 5.704 3.095 1.00 0.00 H new ATOM 0 HB ILE A 72 4.503 3.296 1.235 1.00 0.00 H new ATOM 0 HG12 ILE A 72 6.574 4.203 3.259 1.00 0.00 H new ATOM 0 HG13 ILE A 72 5.426 2.917 3.573 1.00 0.00 H new ATOM 0 HG21 ILE A 72 6.462 4.470 0.318 1.00 0.00 H new ATOM 0 HG22 ILE A 72 4.980 5.444 0.165 1.00 0.00 H new ATOM 0 HG23 ILE A 72 6.169 5.825 1.433 1.00 0.00 H new ATOM 0 HD11 ILE A 72 7.581 2.011 2.850 1.00 0.00 H new ATOM 0 HD12 ILE A 72 6.315 1.638 1.656 1.00 0.00 H new ATOM 0 HD13 ILE A 72 7.481 2.944 1.338 1.00 0.00 H new ATOM 1138 N ILE A 73 2.054 4.356 1.111 1.00 0.00 N ATOM 1139 CA ILE A 73 0.985 4.670 0.172 1.00 0.00 C ATOM 1140 C ILE A 73 -0.167 5.386 0.871 1.00 0.00 C ATOM 1141 O ILE A 73 -0.878 6.184 0.259 1.00 0.00 O ATOM 1142 CB ILE A 73 0.447 3.399 -0.513 1.00 0.00 C ATOM 1143 CG1 ILE A 73 1.602 2.576 -1.090 1.00 0.00 C ATOM 1144 CG2 ILE A 73 -0.549 3.761 -1.606 1.00 0.00 C ATOM 1145 CD1 ILE A 73 1.158 1.280 -1.735 1.00 0.00 C ATOM 0 H ILE A 73 2.158 3.362 1.314 1.00 0.00 H new ATOM 0 HA ILE A 73 1.412 5.328 -0.585 1.00 0.00 H new ATOM 0 HB ILE A 73 -0.069 2.796 0.234 1.00 0.00 H new ATOM 0 HG12 ILE A 73 2.132 3.177 -1.829 1.00 0.00 H new ATOM 0 HG13 ILE A 73 2.311 2.352 -0.293 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -0.918 2.850 -2.078 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -1.385 4.308 -1.170 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -0.058 4.384 -2.354 1.00 0.00 H new ATOM 0 HD11 ILE A 73 2.028 0.749 -2.122 1.00 0.00 H new ATOM 0 HD12 ILE A 73 0.654 0.659 -0.995 1.00 0.00 H new ATOM 0 HD13 ILE A 73 0.472 1.497 -2.554 1.00 0.00 H new ATOM 1157 N GLY A 74 -0.346 5.096 2.155 1.00 0.00 N ATOM 1158 CA GLY A 74 -1.413 5.719 2.917 1.00 0.00 C ATOM 1159 C GLY A 74 -1.359 7.235 2.867 1.00 0.00 C ATOM 1160 O GLY A 74 -2.380 7.904 3.030 1.00 0.00 O ATOM 0 H GLY A 74 0.230 4.440 2.683 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -2.375 5.381 2.532 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -1.352 5.391 3.955 1.00 0.00 H new ATOM 1164 N VAL A 75 -0.167 7.777 2.641 1.00 0.00 N ATOM 1165 CA VAL A 75 0.014 9.223 2.571 1.00 0.00 C ATOM 1166 C VAL A 75 0.517 9.648 1.195 1.00 0.00 C ATOM 1167 O VAL A 75 1.263 10.619 1.069 1.00 0.00 O ATOM 1168 CB VAL A 75 1.004 9.718 3.642 1.00 0.00 C ATOM 1169 CG1 VAL A 75 0.379 9.636 5.026 1.00 0.00 C ATOM 1170 CG2 VAL A 75 2.297 8.920 3.584 1.00 0.00 C ATOM 0 H VAL A 75 0.688 7.238 2.503 1.00 0.00 H new ATOM 0 HA VAL A 75 -0.962 9.673 2.754 1.00 0.00 H new ATOM 0 HB VAL A 75 1.240 10.762 3.437 1.00 0.00 H new ATOM 0 HG11 VAL A 75 1.093 9.990 5.769 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -0.516 10.257 5.058 1.00 0.00 H new ATOM 0 HG13 VAL A 75 0.111 8.602 5.244 1.00 0.00 H new ATOM 0 HG21 VAL A 75 2.984 9.284 4.348 1.00 0.00 H new ATOM 0 HG22 VAL A 75 2.082 7.866 3.762 1.00 0.00 H new ATOM 0 HG23 VAL A 75 2.753 9.037 2.601 1.00 0.00 H new ATOM 1180 N LYS A 76 0.104 8.915 0.167 1.00 0.00 N ATOM 1181 CA LYS A 76 0.512 9.217 -1.200 1.00 0.00 C ATOM 1182 C LYS A 76 -0.600 9.942 -1.952 1.00 0.00 C ATOM 1183 O LYS A 76 -0.532 11.153 -2.166 1.00 0.00 O ATOM 1184 CB LYS A 76 0.893 7.931 -1.938 1.00 0.00 C ATOM 1185 CG LYS A 76 2.322 7.928 -2.456 1.00 0.00 C ATOM 1186 CD LYS A 76 2.496 6.947 -3.604 1.00 0.00 C ATOM 1187 CE LYS A 76 2.720 5.531 -3.098 1.00 0.00 C ATOM 1188 NZ LYS A 76 2.935 4.570 -4.216 1.00 0.00 N ATOM 0 H LYS A 76 -0.513 8.107 0.254 1.00 0.00 H new ATOM 0 HA LYS A 76 1.382 9.872 -1.157 1.00 0.00 H new ATOM 0 HB2 LYS A 76 0.757 7.083 -1.267 1.00 0.00 H new ATOM 0 HB3 LYS A 76 0.211 7.787 -2.776 1.00 0.00 H new ATOM 0 HG2 LYS A 76 2.592 8.930 -2.788 1.00 0.00 H new ATOM 0 HG3 LYS A 76 3.003 7.667 -1.646 1.00 0.00 H new ATOM 0 HD2 LYS A 76 1.612 6.971 -4.242 1.00 0.00 H new ATOM 0 HD3 LYS A 76 3.342 7.252 -4.220 1.00 0.00 H new ATOM 0 HE2 LYS A 76 3.584 5.515 -2.434 1.00 0.00 H new ATOM 0 HE3 LYS A 76 1.859 5.216 -2.508 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 2.982 3.602 -3.838 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 2.146 4.640 -4.890 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 3.827 4.796 -4.701 1.00 0.00 H new ATOM 1202 N SER A 77 -1.623 9.194 -2.351 1.00 0.00 N ATOM 1203 CA SER A 77 -2.750 9.764 -3.079 1.00 0.00 C ATOM 1204 C SER A 77 -3.976 8.862 -2.975 1.00 0.00 C ATOM 1205 O SER A 77 -3.935 7.815 -2.329 1.00 0.00 O ATOM 1206 CB SER A 77 -2.381 9.976 -4.548 1.00 0.00 C ATOM 1207 OG SER A 77 -1.880 11.283 -4.765 1.00 0.00 O ATOM 0 H SER A 77 -1.695 8.191 -2.182 1.00 0.00 H new ATOM 0 HA SER A 77 -2.991 10.728 -2.630 1.00 0.00 H new ATOM 0 HB2 SER A 77 -1.633 9.242 -4.848 1.00 0.00 H new ATOM 0 HB3 SER A 77 -3.258 9.811 -5.174 1.00 0.00 H new ATOM 0 HG SER A 77 -1.336 11.557 -3.997 1.00 0.00 H new ATOM 1213 N GLN A 78 -5.065 9.276 -3.613 1.00 0.00 N ATOM 1214 CA GLN A 78 -6.304 8.506 -3.592 1.00 0.00 C ATOM 1215 C GLN A 78 -6.254 7.361 -4.598 1.00 0.00 C ATOM 1216 O GLN A 78 -6.919 6.340 -4.422 1.00 0.00 O ATOM 1217 CB GLN A 78 -7.497 9.413 -3.894 1.00 0.00 C ATOM 1218 CG GLN A 78 -8.837 8.698 -3.831 1.00 0.00 C ATOM 1219 CD GLN A 78 -9.720 9.204 -2.707 1.00 0.00 C ATOM 1220 OE1 GLN A 78 -10.492 10.146 -2.886 1.00 0.00 O ATOM 1221 NE2 GLN A 78 -9.609 8.581 -1.541 1.00 0.00 N ATOM 0 H GLN A 78 -5.115 10.141 -4.151 1.00 0.00 H new ATOM 0 HA GLN A 78 -6.420 8.082 -2.594 1.00 0.00 H new ATOM 0 HB2 GLN A 78 -7.502 10.240 -3.184 1.00 0.00 H new ATOM 0 HB3 GLN A 78 -7.372 9.845 -4.887 1.00 0.00 H new ATOM 0 HG2 GLN A 78 -9.357 8.825 -4.781 1.00 0.00 H new ATOM 0 HG3 GLN A 78 -8.668 7.629 -3.701 1.00 0.00 H new ATOM 0 HE21 GLN A 78 -8.956 7.804 -1.438 1.00 0.00 H new ATOM 0 HE22 GLN A 78 -10.177 8.879 -0.748 1.00 0.00 H new ATOM 1230 N GLU A 79 -5.467 7.537 -5.655 1.00 0.00 N ATOM 1231 CA GLU A 79 -5.336 6.517 -6.689 1.00 0.00 C ATOM 1232 C GLU A 79 -4.604 5.290 -6.155 1.00 0.00 C ATOM 1233 O GLU A 79 -5.111 4.171 -6.231 1.00 0.00 O ATOM 1234 CB GLU A 79 -4.596 7.085 -7.903 1.00 0.00 C ATOM 1235 CG GLU A 79 -5.459 7.180 -9.151 1.00 0.00 C ATOM 1236 CD GLU A 79 -6.424 8.348 -9.104 1.00 0.00 C ATOM 1237 OE1 GLU A 79 -7.141 8.486 -8.092 1.00 0.00 O ATOM 1238 OE2 GLU A 79 -6.462 9.126 -10.081 1.00 0.00 O ATOM 0 H GLU A 79 -4.911 8.376 -5.818 1.00 0.00 H new ATOM 0 HA GLU A 79 -6.337 6.212 -6.994 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -4.218 8.077 -7.656 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -3.730 6.458 -8.117 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -4.817 7.279 -10.026 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -6.021 6.254 -9.271 1.00 0.00 H new ATOM 1245 N ALA A 80 -3.407 5.506 -5.619 1.00 0.00 N ATOM 1246 CA ALA A 80 -2.605 4.417 -5.075 1.00 0.00 C ATOM 1247 C ALA A 80 -3.254 3.822 -3.830 1.00 0.00 C ATOM 1248 O ALA A 80 -3.097 2.636 -3.542 1.00 0.00 O ATOM 1249 CB ALA A 80 -1.200 4.905 -4.757 1.00 0.00 C ATOM 0 H ALA A 80 -2.971 6.426 -5.550 1.00 0.00 H new ATOM 0 HA ALA A 80 -2.545 3.633 -5.830 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -0.612 4.082 -4.352 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -0.728 5.274 -5.668 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -1.252 5.710 -4.024 1.00 0.00 H new ATOM 1255 N SER A 81 -3.983 4.654 -3.093 1.00 0.00 N ATOM 1256 CA SER A 81 -4.655 4.209 -1.877 1.00 0.00 C ATOM 1257 C SER A 81 -5.803 3.260 -2.206 1.00 0.00 C ATOM 1258 O SER A 81 -5.976 2.230 -1.553 1.00 0.00 O ATOM 1259 CB SER A 81 -5.180 5.410 -1.090 1.00 0.00 C ATOM 1260 OG SER A 81 -6.125 5.008 -0.114 1.00 0.00 O ATOM 0 H SER A 81 -4.123 5.639 -3.316 1.00 0.00 H new ATOM 0 HA SER A 81 -3.929 3.673 -1.266 1.00 0.00 H new ATOM 0 HB2 SER A 81 -4.349 5.923 -0.606 1.00 0.00 H new ATOM 0 HB3 SER A 81 -5.640 6.123 -1.774 1.00 0.00 H new ATOM 0 HG SER A 81 -6.412 5.788 0.405 1.00 0.00 H new ATOM 1266 N GLN A 82 -6.587 3.614 -3.219 1.00 0.00 N ATOM 1267 CA GLN A 82 -7.719 2.794 -3.631 1.00 0.00 C ATOM 1268 C GLN A 82 -7.251 1.428 -4.126 1.00 0.00 C ATOM 1269 O GLN A 82 -7.872 0.405 -3.837 1.00 0.00 O ATOM 1270 CB GLN A 82 -8.518 3.504 -4.728 1.00 0.00 C ATOM 1271 CG GLN A 82 -9.994 3.657 -4.403 1.00 0.00 C ATOM 1272 CD GLN A 82 -10.842 2.559 -5.014 1.00 0.00 C ATOM 1273 OE1 GLN A 82 -11.288 2.665 -6.156 1.00 0.00 O ATOM 1274 NE2 GLN A 82 -11.071 1.495 -4.252 1.00 0.00 N ATOM 0 H GLN A 82 -6.459 4.463 -3.769 1.00 0.00 H new ATOM 0 HA GLN A 82 -8.362 2.644 -2.764 1.00 0.00 H new ATOM 0 HB2 GLN A 82 -8.088 4.491 -4.898 1.00 0.00 H new ATOM 0 HB3 GLN A 82 -8.415 2.947 -5.659 1.00 0.00 H new ATOM 0 HG2 GLN A 82 -10.126 3.654 -3.321 1.00 0.00 H new ATOM 0 HG3 GLN A 82 -10.343 4.624 -4.764 1.00 0.00 H new ATOM 0 HE21 GLN A 82 -10.681 1.449 -3.310 1.00 0.00 H new ATOM 0 HE22 GLN A 82 -11.636 0.724 -4.609 1.00 0.00 H new ATOM 1283 N THR A 83 -6.153 1.419 -4.874 1.00 0.00 N ATOM 1284 CA THR A 83 -5.601 0.180 -5.410 1.00 0.00 C ATOM 1285 C THR A 83 -5.012 -0.681 -4.297 1.00 0.00 C ATOM 1286 O THR A 83 -5.098 -1.909 -4.336 1.00 0.00 O ATOM 1287 CB THR A 83 -4.529 0.484 -6.456 1.00 0.00 C ATOM 1288 OG1 THR A 83 -4.947 1.533 -7.311 1.00 0.00 O ATOM 1289 CG2 THR A 83 -4.184 -0.706 -7.325 1.00 0.00 C ATOM 0 H THR A 83 -5.627 2.257 -5.123 1.00 0.00 H new ATOM 0 HA THR A 83 -6.412 -0.374 -5.882 1.00 0.00 H new ATOM 0 HB THR A 83 -3.643 0.766 -5.887 1.00 0.00 H new ATOM 0 HG1 THR A 83 -4.808 2.394 -6.864 1.00 0.00 H new ATOM 0 HG21 THR A 83 -3.417 -0.421 -8.045 1.00 0.00 H new ATOM 0 HG22 THR A 83 -3.811 -1.517 -6.700 1.00 0.00 H new ATOM 0 HG23 THR A 83 -5.075 -1.039 -7.857 1.00 0.00 H new ATOM 1297 N LEU A 84 -4.411 -0.030 -3.306 1.00 0.00 N ATOM 1298 CA LEU A 84 -3.806 -0.736 -2.183 1.00 0.00 C ATOM 1299 C LEU A 84 -4.841 -1.581 -1.444 1.00 0.00 C ATOM 1300 O LEU A 84 -4.505 -2.597 -0.836 1.00 0.00 O ATOM 1301 CB LEU A 84 -3.161 0.259 -1.216 1.00 0.00 C ATOM 1302 CG LEU A 84 -2.515 -0.367 0.022 1.00 0.00 C ATOM 1303 CD1 LEU A 84 -1.453 -1.376 -0.384 1.00 0.00 C ATOM 1304 CD2 LEU A 84 -1.918 0.712 0.912 1.00 0.00 C ATOM 0 H LEU A 84 -4.330 0.986 -3.258 1.00 0.00 H new ATOM 0 HA LEU A 84 -3.038 -1.401 -2.579 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -2.403 0.827 -1.755 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -3.920 0.970 -0.891 1.00 0.00 H new ATOM 0 HG LEU A 84 -3.286 -0.891 0.587 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -1.004 -1.811 0.509 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -1.910 -2.165 -0.982 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -0.682 -0.877 -0.971 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -1.463 0.250 1.788 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -1.159 1.263 0.357 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -2.704 1.397 1.230 1.00 0.00 H new ATOM 1316 N LEU A 85 -6.098 -1.153 -1.499 1.00 0.00 N ATOM 1317 CA LEU A 85 -7.179 -1.871 -0.833 1.00 0.00 C ATOM 1318 C LEU A 85 -7.864 -2.840 -1.791 1.00 0.00 C ATOM 1319 O LEU A 85 -8.029 -4.021 -1.483 1.00 0.00 O ATOM 1320 CB LEU A 85 -8.204 -0.884 -0.269 1.00 0.00 C ATOM 1321 CG LEU A 85 -7.663 0.071 0.796 1.00 0.00 C ATOM 1322 CD1 LEU A 85 -8.361 1.420 0.707 1.00 0.00 C ATOM 1323 CD2 LEU A 85 -7.834 -0.528 2.184 1.00 0.00 C ATOM 0 H LEU A 85 -6.393 -0.313 -1.997 1.00 0.00 H new ATOM 0 HA LEU A 85 -6.747 -2.445 -0.013 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -8.610 -0.295 -1.092 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -9.033 -1.448 0.158 1.00 0.00 H new ATOM 0 HG LEU A 85 -6.599 0.222 0.615 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -7.963 2.087 1.472 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -8.189 1.854 -0.278 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -9.432 1.287 0.863 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -7.444 0.165 2.930 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -8.892 -0.708 2.375 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -7.289 -1.470 2.243 1.00 0.00 H new ATOM 1335 N ASP A 86 -8.262 -2.333 -2.953 1.00 0.00 N ATOM 1336 CA ASP A 86 -8.931 -3.154 -3.957 1.00 0.00 C ATOM 1337 C ASP A 86 -8.046 -4.316 -4.394 1.00 0.00 C ATOM 1338 O ASP A 86 -8.521 -5.434 -4.583 1.00 0.00 O ATOM 1339 CB ASP A 86 -9.310 -2.303 -5.170 1.00 0.00 C ATOM 1340 CG ASP A 86 -10.556 -1.474 -4.929 1.00 0.00 C ATOM 1341 OD1 ASP A 86 -10.905 -1.256 -3.750 1.00 0.00 O ATOM 1342 OD2 ASP A 86 -11.183 -1.043 -5.919 1.00 0.00 O ATOM 0 H ASP A 86 -8.133 -1.358 -3.223 1.00 0.00 H new ATOM 0 HA ASP A 86 -9.837 -3.562 -3.509 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -8.480 -1.642 -5.420 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -9.470 -2.953 -6.030 1.00 0.00 H new ATOM 1347 N SER A 87 -6.755 -4.042 -4.556 1.00 0.00 N ATOM 1348 CA SER A 87 -5.802 -5.065 -4.974 1.00 0.00 C ATOM 1349 C SER A 87 -5.767 -6.219 -3.977 1.00 0.00 C ATOM 1350 O SER A 87 -5.591 -7.376 -4.359 1.00 0.00 O ATOM 1351 CB SER A 87 -4.406 -4.459 -5.121 1.00 0.00 C ATOM 1352 OG SER A 87 -3.520 -5.368 -5.753 1.00 0.00 O ATOM 0 H SER A 87 -6.345 -3.121 -4.404 1.00 0.00 H new ATOM 0 HA SER A 87 -6.126 -5.455 -5.939 1.00 0.00 H new ATOM 0 HB2 SER A 87 -4.465 -3.539 -5.703 1.00 0.00 H new ATOM 0 HB3 SER A 87 -4.017 -4.191 -4.139 1.00 0.00 H new ATOM 0 HG SER A 87 -2.634 -4.957 -5.837 1.00 0.00 H new ATOM 1358 N VAL A 88 -5.932 -5.898 -2.699 1.00 0.00 N ATOM 1359 CA VAL A 88 -5.916 -6.910 -1.649 1.00 0.00 C ATOM 1360 C VAL A 88 -7.106 -7.858 -1.775 1.00 0.00 C ATOM 1361 O VAL A 88 -7.043 -9.007 -1.338 1.00 0.00 O ATOM 1362 CB VAL A 88 -5.933 -6.267 -0.248 1.00 0.00 C ATOM 1363 CG1 VAL A 88 -5.785 -7.328 0.832 1.00 0.00 C ATOM 1364 CG2 VAL A 88 -4.835 -5.220 -0.128 1.00 0.00 C ATOM 0 H VAL A 88 -6.078 -4.945 -2.365 1.00 0.00 H new ATOM 0 HA VAL A 88 -4.992 -7.475 -1.772 1.00 0.00 H new ATOM 0 HB VAL A 88 -6.894 -5.773 -0.109 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -5.799 -6.853 1.813 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -6.609 -8.038 0.760 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -4.840 -7.855 0.698 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -4.862 -4.777 0.867 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -3.865 -5.690 -0.290 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -4.990 -4.442 -0.876 1.00 0.00 H new ATOM 1374 N TYR A 89 -8.189 -7.371 -2.373 1.00 0.00 N ATOM 1375 CA TYR A 89 -9.390 -8.179 -2.551 1.00 0.00 C ATOM 1376 C TYR A 89 -9.499 -8.697 -3.983 1.00 0.00 C ATOM 1377 O TYR A 89 -10.136 -9.720 -4.235 1.00 0.00 O ATOM 1378 CB TYR A 89 -10.635 -7.363 -2.197 1.00 0.00 C ATOM 1379 CG TYR A 89 -10.697 -6.950 -0.744 1.00 0.00 C ATOM 1380 CD1 TYR A 89 -10.829 -7.900 0.262 1.00 0.00 C ATOM 1381 CD2 TYR A 89 -10.623 -5.612 -0.379 1.00 0.00 C ATOM 1382 CE1 TYR A 89 -10.885 -7.526 1.592 1.00 0.00 C ATOM 1383 CE2 TYR A 89 -10.679 -5.231 0.948 1.00 0.00 C ATOM 1384 CZ TYR A 89 -10.810 -6.192 1.929 1.00 0.00 C ATOM 1385 OH TYR A 89 -10.868 -5.816 3.252 1.00 0.00 O ATOM 0 H TYR A 89 -8.259 -6.423 -2.742 1.00 0.00 H new ATOM 0 HA TYR A 89 -9.319 -9.036 -1.881 1.00 0.00 H new ATOM 0 HB2 TYR A 89 -10.663 -6.470 -2.821 1.00 0.00 H new ATOM 0 HB3 TYR A 89 -11.523 -7.948 -2.438 1.00 0.00 H new ATOM 0 HD1 TYR A 89 -10.889 -8.946 0.001 1.00 0.00 H new ATOM 0 HD2 TYR A 89 -10.520 -4.857 -1.145 1.00 0.00 H new ATOM 0 HE1 TYR A 89 -10.987 -8.276 2.363 1.00 0.00 H new ATOM 0 HE2 TYR A 89 -10.621 -4.186 1.216 1.00 0.00 H new ATOM 0 HH TYR A 89 -10.866 -6.615 3.820 1.00 0.00 H new ATOM 1395 N SER A 90 -8.880 -7.983 -4.918 1.00 0.00 N ATOM 1396 CA SER A 90 -8.914 -8.373 -6.323 1.00 0.00 C ATOM 1397 C SER A 90 -7.936 -9.510 -6.603 1.00 0.00 C ATOM 1398 O SER A 90 -8.236 -10.423 -7.373 1.00 0.00 O ATOM 1399 CB SER A 90 -8.585 -7.172 -7.213 1.00 0.00 C ATOM 1400 OG SER A 90 -8.712 -7.504 -8.584 1.00 0.00 O ATOM 0 H SER A 90 -8.350 -7.133 -4.728 1.00 0.00 H new ATOM 0 HA SER A 90 -9.921 -8.724 -6.550 1.00 0.00 H new ATOM 0 HB2 SER A 90 -9.252 -6.344 -6.973 1.00 0.00 H new ATOM 0 HB3 SER A 90 -7.569 -6.833 -7.010 1.00 0.00 H new ATOM 0 HG SER A 90 -8.498 -6.720 -9.132 1.00 0.00 H new ATOM 1406 N HIS A 91 -6.765 -9.448 -5.978 1.00 0.00 N ATOM 1407 CA HIS A 91 -5.744 -10.473 -6.167 1.00 0.00 C ATOM 1408 C HIS A 91 -6.002 -11.679 -5.269 1.00 0.00 C ATOM 1409 O HIS A 91 -5.775 -12.821 -5.668 1.00 0.00 O ATOM 1410 CB HIS A 91 -4.356 -9.899 -5.882 1.00 0.00 C ATOM 1411 CG HIS A 91 -3.702 -9.292 -7.084 1.00 0.00 C ATOM 1412 ND1 HIS A 91 -3.852 -9.774 -8.365 1.00 0.00 N ATOM 1413 CD2 HIS A 91 -2.878 -8.217 -7.183 1.00 0.00 C ATOM 1414 CE1 HIS A 91 -3.131 -8.996 -9.185 1.00 0.00 C ATOM 1415 NE2 HIS A 91 -2.522 -8.035 -8.516 1.00 0.00 N ATOM 0 H HIS A 91 -6.499 -8.700 -5.337 1.00 0.00 H new ATOM 0 HA HIS A 91 -5.789 -10.803 -7.205 1.00 0.00 H new ATOM 0 HB2 HIS A 91 -4.438 -9.142 -5.102 1.00 0.00 H new ATOM 0 HB3 HIS A 91 -3.717 -10.691 -5.492 1.00 0.00 H new ATOM 0 HD2 HIS A 91 -2.551 -7.601 -6.358 1.00 0.00 H new ATOM 0 HE1 HIS A 91 -3.058 -9.137 -10.253 1.00 0.00 H new ATOM 0 HE2 HIS A 91 -1.916 -7.309 -8.897 1.00 0.00 H new ATOM 1423 N LEU A 92 -6.475 -11.419 -4.055 1.00 0.00 N ATOM 1424 CA LEU A 92 -6.760 -12.486 -3.102 1.00 0.00 C ATOM 1425 C LEU A 92 -8.264 -12.704 -2.958 1.00 0.00 C ATOM 1426 O LEU A 92 -8.904 -12.115 -2.088 1.00 0.00 O ATOM 1427 CB LEU A 92 -6.147 -12.159 -1.740 1.00 0.00 C ATOM 1428 CG LEU A 92 -4.631 -12.337 -1.651 1.00 0.00 C ATOM 1429 CD1 LEU A 92 -4.101 -11.761 -0.347 1.00 0.00 C ATOM 1430 CD2 LEU A 92 -4.260 -13.807 -1.777 1.00 0.00 C ATOM 0 H LEU A 92 -6.669 -10.480 -3.708 1.00 0.00 H new ATOM 0 HA LEU A 92 -6.314 -13.405 -3.482 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -6.391 -11.127 -1.487 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -6.616 -12.792 -0.986 1.00 0.00 H new ATOM 0 HG LEU A 92 -4.171 -11.794 -2.477 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -3.020 -11.897 -0.302 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -4.335 -10.698 -0.297 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -4.567 -12.275 0.494 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -3.177 -13.916 -1.712 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -4.731 -14.371 -0.972 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -4.606 -14.188 -2.738 1.00 0.00 H new ATOM 1442 N PRO A 93 -8.849 -13.561 -3.814 1.00 0.00 N ATOM 1443 CA PRO A 93 -10.284 -13.856 -3.775 1.00 0.00 C ATOM 1444 C PRO A 93 -10.668 -14.698 -2.563 1.00 0.00 C ATOM 1445 O PRO A 93 -11.794 -14.623 -2.073 1.00 0.00 O ATOM 1446 CB PRO A 93 -10.518 -14.642 -5.067 1.00 0.00 C ATOM 1447 CG PRO A 93 -9.204 -15.274 -5.368 1.00 0.00 C ATOM 1448 CD PRO A 93 -8.158 -14.309 -4.882 1.00 0.00 C ATOM 0 HA PRO A 93 -10.886 -12.951 -3.695 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -11.298 -15.392 -4.938 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -10.837 -13.986 -5.877 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -9.110 -16.237 -4.866 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -9.096 -15.460 -6.437 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -7.278 -14.828 -4.503 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -7.819 -13.648 -5.680 1.00 0.00 H new ATOM 1456 N ASP A 94 -9.723 -15.500 -2.083 1.00 0.00 N ATOM 1457 CA ASP A 94 -9.959 -16.357 -0.928 1.00 0.00 C ATOM 1458 C ASP A 94 -10.313 -15.528 0.303 1.00 0.00 C ATOM 1459 O ASP A 94 -11.033 -15.991 1.188 1.00 0.00 O ATOM 1460 CB ASP A 94 -8.725 -17.214 -0.642 1.00 0.00 C ATOM 1461 CG ASP A 94 -8.304 -18.041 -1.841 1.00 0.00 C ATOM 1462 OD1 ASP A 94 -8.127 -17.458 -2.931 1.00 0.00 O ATOM 1463 OD2 ASP A 94 -8.154 -19.272 -1.691 1.00 0.00 O ATOM 0 H ASP A 94 -8.785 -15.574 -2.477 1.00 0.00 H new ATOM 0 HA ASP A 94 -10.801 -17.010 -1.158 1.00 0.00 H new ATOM 0 HB2 ASP A 94 -7.900 -16.569 -0.342 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -8.933 -17.877 0.198 1.00 0.00 H new ATOM 1468 N LEU A 95 -9.803 -14.301 0.353 1.00 0.00 N ATOM 1469 CA LEU A 95 -10.067 -13.409 1.478 1.00 0.00 C ATOM 1470 C LEU A 95 -11.566 -13.198 1.667 1.00 0.00 C ATOM 1471 O LEU A 95 -12.048 -13.064 2.792 1.00 0.00 O ATOM 1472 CB LEU A 95 -9.375 -12.062 1.261 1.00 0.00 C ATOM 1473 CG LEU A 95 -7.856 -12.078 1.437 1.00 0.00 C ATOM 1474 CD1 LEU A 95 -7.252 -10.757 0.984 1.00 0.00 C ATOM 1475 CD2 LEU A 95 -7.492 -12.365 2.885 1.00 0.00 C ATOM 0 H LEU A 95 -9.206 -13.902 -0.371 1.00 0.00 H new ATOM 0 HA LEU A 95 -9.668 -13.875 2.379 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -9.605 -11.711 0.255 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -9.798 -11.337 1.956 1.00 0.00 H new ATOM 0 HG LEU A 95 -7.445 -12.873 0.815 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -6.171 -10.787 1.117 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -7.484 -10.593 -0.068 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -7.668 -9.944 1.579 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -6.407 -12.373 2.993 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -7.915 -11.592 3.527 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -7.892 -13.336 3.175 1.00 0.00 H new ATOM 1487 N LEU A 96 -12.299 -13.172 0.559 1.00 0.00 N ATOM 1488 CA LEU A 96 -13.742 -12.980 0.601 1.00 0.00 C ATOM 1489 C LEU A 96 -14.446 -13.923 -0.370 1.00 0.00 C ATOM 1490 O LEU A 96 -14.872 -13.514 -1.450 1.00 0.00 O ATOM 1491 CB LEU A 96 -14.096 -11.528 0.268 1.00 0.00 C ATOM 1492 CG LEU A 96 -14.179 -10.589 1.474 1.00 0.00 C ATOM 1493 CD1 LEU A 96 -13.703 -9.194 1.098 1.00 0.00 C ATOM 1494 CD2 LEU A 96 -15.600 -10.543 2.015 1.00 0.00 C ATOM 0 H LEU A 96 -11.916 -13.282 -0.380 1.00 0.00 H new ATOM 0 HA LEU A 96 -14.083 -13.207 1.611 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -13.351 -11.138 -0.426 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -15.054 -11.513 -0.251 1.00 0.00 H new ATOM 0 HG LEU A 96 -13.526 -10.974 2.257 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -13.769 -8.540 1.968 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -12.669 -9.242 0.758 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -14.330 -8.799 0.299 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -15.641 -9.871 2.872 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -16.274 -10.182 1.238 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -15.905 -11.543 2.323 1.00 0.00 H new ATOM 1506 N SER A 97 -14.563 -15.187 0.022 1.00 0.00 N ATOM 1507 CA SER A 97 -15.214 -16.190 -0.813 1.00 0.00 C ATOM 1508 C SER A 97 -16.689 -16.327 -0.447 1.00 0.00 C ATOM 1509 O SER A 97 -17.062 -17.174 0.364 1.00 0.00 O ATOM 1510 CB SER A 97 -14.512 -17.541 -0.664 1.00 0.00 C ATOM 1511 OG SER A 97 -13.103 -17.385 -0.650 1.00 0.00 O ATOM 0 H SER A 97 -14.215 -15.542 0.913 1.00 0.00 H new ATOM 0 HA SER A 97 -15.144 -15.865 -1.851 1.00 0.00 H new ATOM 0 HB2 SER A 97 -14.837 -18.023 0.258 1.00 0.00 H new ATOM 0 HB3 SER A 97 -14.800 -18.197 -1.486 1.00 0.00 H new ATOM 0 HG SER A 97 -12.678 -18.262 -0.552 1.00 0.00 H new ATOM 1517 N GLY A 98 -17.523 -15.488 -1.053 1.00 0.00 N ATOM 1518 CA GLY A 98 -18.947 -15.531 -0.778 1.00 0.00 C ATOM 1519 C GLY A 98 -19.277 -15.125 0.649 1.00 0.00 C ATOM 1520 O GLY A 98 -19.122 -13.959 1.011 1.00 0.00 O ATOM 0 H GLY A 98 -17.238 -14.780 -1.729 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -19.468 -14.869 -1.470 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -19.319 -16.539 -0.961 1.00 0.00 H new ATOM 1524 N PRO A 99 -19.739 -16.069 1.489 1.00 0.00 N ATOM 1525 CA PRO A 99 -20.085 -15.778 2.885 1.00 0.00 C ATOM 1526 C PRO A 99 -18.949 -15.086 3.632 1.00 0.00 C ATOM 1527 O PRO A 99 -17.859 -14.901 3.090 1.00 0.00 O ATOM 1528 CB PRO A 99 -20.353 -17.161 3.483 1.00 0.00 C ATOM 1529 CG PRO A 99 -20.742 -18.008 2.322 1.00 0.00 C ATOM 1530 CD PRO A 99 -19.957 -17.487 1.151 1.00 0.00 C ATOM 0 HA PRO A 99 -20.932 -15.096 2.960 1.00 0.00 H new ATOM 0 HB2 PRO A 99 -19.467 -17.555 3.981 1.00 0.00 H new ATOM 0 HB3 PRO A 99 -21.147 -17.123 4.228 1.00 0.00 H new ATOM 0 HG2 PRO A 99 -20.513 -19.057 2.510 1.00 0.00 H new ATOM 0 HG3 PRO A 99 -21.814 -17.944 2.133 1.00 0.00 H new ATOM 0 HD2 PRO A 99 -19.014 -18.021 1.030 1.00 0.00 H new ATOM 0 HD3 PRO A 99 -20.508 -17.597 0.217 1.00 0.00 H new ATOM 1538 N SER A 100 -19.213 -14.707 4.878 1.00 0.00 N ATOM 1539 CA SER A 100 -18.212 -14.036 5.699 1.00 0.00 C ATOM 1540 C SER A 100 -18.241 -14.563 7.131 1.00 0.00 C ATOM 1541 O SER A 100 -19.238 -15.131 7.574 1.00 0.00 O ATOM 1542 CB SER A 100 -18.449 -12.525 5.696 1.00 0.00 C ATOM 1543 OG SER A 100 -19.825 -12.223 5.843 1.00 0.00 O ATOM 0 H SER A 100 -20.110 -14.853 5.341 1.00 0.00 H new ATOM 0 HA SER A 100 -17.230 -14.244 5.273 1.00 0.00 H new ATOM 0 HB2 SER A 100 -17.884 -12.064 6.506 1.00 0.00 H new ATOM 0 HB3 SER A 100 -18.077 -12.098 4.765 1.00 0.00 H new ATOM 0 HG SER A 100 -19.949 -11.251 5.840 1.00 0.00 H new ATOM 1549 N SER A 101 -17.139 -14.369 7.849 1.00 0.00 N ATOM 1550 CA SER A 101 -17.037 -14.825 9.231 1.00 0.00 C ATOM 1551 C SER A 101 -17.161 -13.653 10.200 1.00 0.00 C ATOM 1552 O SER A 101 -16.324 -12.750 10.208 1.00 0.00 O ATOM 1553 CB SER A 101 -15.709 -15.549 9.455 1.00 0.00 C ATOM 1554 OG SER A 101 -15.597 -16.007 10.791 1.00 0.00 O ATOM 0 H SER A 101 -16.305 -13.899 7.497 1.00 0.00 H new ATOM 0 HA SER A 101 -17.856 -15.519 9.420 1.00 0.00 H new ATOM 0 HB2 SER A 101 -15.632 -16.393 8.770 1.00 0.00 H new ATOM 0 HB3 SER A 101 -14.882 -14.877 9.227 1.00 0.00 H new ATOM 0 HG SER A 101 -14.740 -16.468 10.908 1.00 0.00 H new ATOM 1560 N GLY A 102 -18.209 -13.674 11.016 1.00 0.00 N ATOM 1561 CA GLY A 102 -18.423 -12.608 11.977 1.00 0.00 C ATOM 1562 C GLY A 102 -19.774 -12.703 12.658 1.00 0.00 C ATOM 1563 O GLY A 102 -20.396 -13.784 12.596 1.00 0.00 O ATOM 1564 OXT GLY A 102 -20.210 -11.695 13.253 1.00 0.00 O ATOM 0 H GLY A 102 -18.915 -14.411 11.029 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -17.637 -12.640 12.731 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -18.341 -11.646 11.472 1.00 0.00 H new TER 1568 GLY A 102