USER MOD reduce.3.24.130724 H: found=0, std=0, add=783, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 783 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 36 ASN : amide:sc= -1.6! X(o=-1.6!,f=-1.9) USER MOD Set 1.2: A 93 ASN : amide:sc= 0 X(o=-1.6,f=-1.6) USER MOD Set 2.1: A 62 ASN : amide:sc= -0.0408 K(o=-0.015,f=-1.6!) USER MOD Set 2.2: A 65 SER OG : rot 180:sc= 0.0255 USER MOD Single : A 1 SER N :NH3+ -120:sc= 0.72 (180deg=0) USER MOD Single : A 1 SER OG : rot 180:sc= 0.234 USER MOD Single : A 5 SER OG : rot 5:sc= 0.324 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 ASN : amide:sc= 0.151 X(o=0.15,f=0) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 THR OG1 : rot 180:sc= -0.0573 USER MOD Single : A 15 SER OG : rot 81:sc= -1.69! USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 GLN : amide:sc= -2.13 X(o=-2.1,f=-2.3!) USER MOD Single : A 25 THR OG1 : rot 130:sc= -1.48 USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 ASN : amide:sc= 0.474 K(o=0.47,f=-5.3!) USER MOD Single : A 31 SER OG : rot 180:sc= -0.328 USER MOD Single : A 37 SER OG : rot 180:sc= 0.151 USER MOD Single : A 41 THR OG1 : rot 180:sc= 0.0441 USER MOD Single : A 42 ASN : amide:sc= -0.182 X(o=-0.18,f=0) USER MOD Single : A 43 ASN : amide:sc= 0.758 K(o=0.76,f=0) USER MOD Single : A 45 SER OG : rot 180:sc= 0.125 USER MOD Single : A 48 SER OG : rot 180:sc= 0.204 USER MOD Single : A 57 ASN : amide:sc= 0.957 K(o=0.96,f=-6.9!) USER MOD Single : A 60 SER OG : rot 170:sc= -0.149 USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 LYS NZ :NH3+ -111:sc= -0.0311 (180deg=-2.68!) USER MOD Single : A 71 SER OG : rot 95:sc= 1.25 USER MOD Single : A 75 GLN : amide:sc= -1.09! K(o=-1.1!,f=-0.068) USER MOD Single : A 84 HIS : no HE2:sc= 0.172 K(o=0.17,f=-0.74) USER MOD Single : A 85 THR OG1 : rot 178:sc= 0.944 USER MOD Single : A 92 LYS NZ :NH3+ -128:sc= 2.34 (180deg=-1.25) USER MOD Single : A 102 THR OG1 : rot 180:sc= -0.165 USER MOD Single : A 103 THR OG1 : rot 180:sc= -0.0748 USER MOD Single : A 104 ASN : amide:sc= -3.32! C(o=-3.3!,f=-2.6!) USER MOD Single : A 110 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 115 THR OG1 : rot 174:sc= 1.25 USER MOD Single : A 116 LYS NZ :NH3+ 168:sc= 1.26 (180deg=1.22) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 8.301 10.644 17.055 1.00 0.00 N ATOM 2 CA SER A 1 8.365 9.393 17.837 1.00 0.00 C ATOM 3 C SER A 1 9.803 9.100 18.257 1.00 0.00 C ATOM 4 O SER A 1 10.743 9.728 17.760 1.00 0.00 O ATOM 5 CB SER A 1 7.824 8.244 16.985 1.00 0.00 C ATOM 6 OG SER A 1 7.488 8.700 15.684 1.00 0.00 O ATOM 0 H1 SER A 1 7.682 11.325 17.540 1.00 0.00 H new ATOM 0 H2 SER A 1 9.256 11.047 16.965 1.00 0.00 H new ATOM 0 H3 SER A 1 7.920 10.443 16.108 1.00 0.00 H new ATOM 0 HA SER A 1 7.760 9.500 18.738 1.00 0.00 H new ATOM 0 HB2 SER A 1 8.570 7.452 16.917 1.00 0.00 H new ATOM 0 HB3 SER A 1 6.945 7.813 17.463 1.00 0.00 H new ATOM 0 HG SER A 1 7.145 7.951 15.153 1.00 0.00 H new ATOM 14 N LEU A 2 9.971 8.165 19.181 1.00 0.00 N ATOM 15 CA LEU A 2 11.297 7.733 19.597 1.00 0.00 C ATOM 16 C LEU A 2 11.490 6.261 19.251 1.00 0.00 C ATOM 17 O LEU A 2 10.735 5.408 19.716 1.00 0.00 O ATOM 18 CB LEU A 2 11.486 7.958 21.100 1.00 0.00 C ATOM 19 CG LEU A 2 12.479 9.060 21.472 1.00 0.00 C ATOM 20 CD1 LEU A 2 12.203 9.574 22.878 1.00 0.00 C ATOM 21 CD2 LEU A 2 13.909 8.557 21.351 1.00 0.00 C ATOM 0 H LEU A 2 9.204 7.690 19.657 1.00 0.00 H new ATOM 0 HA LEU A 2 12.045 8.323 19.067 1.00 0.00 H new ATOM 0 HB2 LEU A 2 10.518 8.199 21.540 1.00 0.00 H new ATOM 0 HB3 LEU A 2 11.818 7.024 21.552 1.00 0.00 H new ATOM 0 HG LEU A 2 12.352 9.888 20.775 1.00 0.00 H new ATOM 0 HD11 LEU A 2 12.919 10.358 23.126 1.00 0.00 H new ATOM 0 HD12 LEU A 2 11.192 9.978 22.926 1.00 0.00 H new ATOM 0 HD13 LEU A 2 12.300 8.755 23.590 1.00 0.00 H new ATOM 0 HD21 LEU A 2 14.600 9.356 21.620 1.00 0.00 H new ATOM 0 HD22 LEU A 2 14.055 7.710 22.022 1.00 0.00 H new ATOM 0 HD23 LEU A 2 14.099 8.244 20.324 1.00 0.00 H new ATOM 33 N PRO A 3 12.483 5.950 18.401 1.00 0.00 N ATOM 34 CA PRO A 3 12.759 4.580 17.943 1.00 0.00 C ATOM 35 C PRO A 3 13.354 3.693 19.040 1.00 0.00 C ATOM 36 O PRO A 3 14.495 3.233 18.944 1.00 0.00 O ATOM 37 CB PRO A 3 13.774 4.774 16.800 1.00 0.00 C ATOM 38 CG PRO A 3 13.769 6.238 16.502 1.00 0.00 C ATOM 39 CD PRO A 3 13.404 6.917 17.788 1.00 0.00 C ATOM 0 HA PRO A 3 11.844 4.071 17.639 1.00 0.00 H new ATOM 0 HB2 PRO A 3 14.767 4.438 17.097 1.00 0.00 H new ATOM 0 HB3 PRO A 3 13.491 4.194 15.922 1.00 0.00 H new ATOM 0 HG2 PRO A 3 14.746 6.568 16.149 1.00 0.00 H new ATOM 0 HG3 PRO A 3 13.050 6.475 15.717 1.00 0.00 H new ATOM 0 HD2 PRO A 3 14.278 7.100 18.414 1.00 0.00 H new ATOM 0 HD3 PRO A 3 12.927 7.882 17.617 1.00 0.00 H new ATOM 47 N ALA A 4 12.571 3.457 20.084 1.00 0.00 N ATOM 48 CA ALA A 4 12.988 2.589 21.174 1.00 0.00 C ATOM 49 C ALA A 4 12.444 1.179 20.971 1.00 0.00 C ATOM 50 O ALA A 4 12.834 0.239 21.666 1.00 0.00 O ATOM 51 CB ALA A 4 12.528 3.156 22.511 1.00 0.00 C ATOM 0 H ALA A 4 11.640 3.857 20.198 1.00 0.00 H new ATOM 0 HA ALA A 4 14.077 2.538 21.180 1.00 0.00 H new ATOM 0 HB1 ALA A 4 12.848 2.495 23.316 1.00 0.00 H new ATOM 0 HB2 ALA A 4 12.965 4.144 22.657 1.00 0.00 H new ATOM 0 HB3 ALA A 4 11.441 3.236 22.518 1.00 0.00 H new ATOM 57 N SER A 5 11.536 1.042 20.013 1.00 0.00 N ATOM 58 CA SER A 5 10.938 -0.246 19.685 1.00 0.00 C ATOM 59 C SER A 5 10.424 -0.240 18.250 1.00 0.00 C ATOM 60 O SER A 5 10.093 0.822 17.718 1.00 0.00 O ATOM 61 CB SER A 5 9.792 -0.556 20.651 1.00 0.00 C ATOM 62 OG SER A 5 10.278 -0.754 21.966 1.00 0.00 O ATOM 0 H SER A 5 11.195 1.817 19.444 1.00 0.00 H new ATOM 0 HA SER A 5 11.700 -1.019 19.781 1.00 0.00 H new ATOM 0 HB2 SER A 5 9.074 0.264 20.644 1.00 0.00 H new ATOM 0 HB3 SER A 5 9.261 -1.448 20.317 1.00 0.00 H new ATOM 0 HG SER A 5 11.242 -0.578 21.988 1.00 0.00 H new ATOM 68 N ALA A 6 10.377 -1.426 17.638 1.00 0.00 N ATOM 69 CA ALA A 6 9.890 -1.602 16.267 1.00 0.00 C ATOM 70 C ALA A 6 10.706 -0.786 15.261 1.00 0.00 C ATOM 71 O ALA A 6 10.217 -0.434 14.186 1.00 0.00 O ATOM 72 CB ALA A 6 8.412 -1.248 16.181 1.00 0.00 C ATOM 0 H ALA A 6 10.677 -2.295 18.081 1.00 0.00 H new ATOM 0 HA ALA A 6 10.015 -2.652 16.004 1.00 0.00 H new ATOM 0 HB1 ALA A 6 8.064 -1.384 15.157 1.00 0.00 H new ATOM 0 HB2 ALA A 6 7.843 -1.897 16.846 1.00 0.00 H new ATOM 0 HB3 ALA A 6 8.269 -0.209 16.478 1.00 0.00 H new ATOM 78 N ALA A 7 11.959 -0.504 15.597 1.00 0.00 N ATOM 79 CA ALA A 7 12.822 0.277 14.723 1.00 0.00 C ATOM 80 C ALA A 7 13.583 -0.633 13.766 1.00 0.00 C ATOM 81 O ALA A 7 14.805 -0.767 13.856 1.00 0.00 O ATOM 82 CB ALA A 7 13.787 1.124 15.540 1.00 0.00 C ATOM 0 H ALA A 7 12.398 -0.804 16.467 1.00 0.00 H new ATOM 0 HA ALA A 7 12.196 0.946 14.133 1.00 0.00 H new ATOM 0 HB1 ALA A 7 14.423 1.700 14.869 1.00 0.00 H new ATOM 0 HB2 ALA A 7 13.223 1.804 16.179 1.00 0.00 H new ATOM 0 HB3 ALA A 7 14.406 0.475 16.159 1.00 0.00 H new ATOM 88 N LYS A 8 12.855 -1.262 12.853 1.00 0.00 N ATOM 89 CA LYS A 8 13.451 -2.178 11.889 1.00 0.00 C ATOM 90 C LYS A 8 12.796 -2.011 10.524 1.00 0.00 C ATOM 91 O LYS A 8 11.576 -1.852 10.441 1.00 0.00 O ATOM 92 CB LYS A 8 13.289 -3.625 12.367 1.00 0.00 C ATOM 93 CG LYS A 8 14.543 -4.214 12.991 1.00 0.00 C ATOM 94 CD LYS A 8 14.366 -5.692 13.308 1.00 0.00 C ATOM 95 CE LYS A 8 15.672 -6.328 13.761 1.00 0.00 C ATOM 96 NZ LYS A 8 16.553 -6.670 12.612 1.00 0.00 N ATOM 0 H LYS A 8 11.845 -1.154 12.760 1.00 0.00 H new ATOM 0 HA LYS A 8 14.513 -1.947 11.802 1.00 0.00 H new ATOM 0 HB2 LYS A 8 12.479 -3.668 13.095 1.00 0.00 H new ATOM 0 HB3 LYS A 8 12.991 -4.245 11.521 1.00 0.00 H new ATOM 0 HG2 LYS A 8 15.385 -4.085 12.310 1.00 0.00 H new ATOM 0 HG3 LYS A 8 14.786 -3.671 13.905 1.00 0.00 H new ATOM 0 HD2 LYS A 8 13.614 -5.810 14.088 1.00 0.00 H new ATOM 0 HD3 LYS A 8 13.994 -6.212 12.425 1.00 0.00 H new ATOM 0 HE2 LYS A 8 16.196 -5.644 14.429 1.00 0.00 H new ATOM 0 HE3 LYS A 8 15.457 -7.230 14.334 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 17.432 -7.101 12.964 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 16.064 -7.343 11.988 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 16.780 -5.806 12.080 1.00 0.00 H new ATOM 110 N ASN A 9 13.618 -2.013 9.469 1.00 0.00 N ATOM 111 CA ASN A 9 13.148 -1.929 8.072 1.00 0.00 C ATOM 112 C ASN A 9 12.764 -0.496 7.696 1.00 0.00 C ATOM 113 O ASN A 9 13.000 -0.063 6.564 1.00 0.00 O ATOM 114 CB ASN A 9 11.982 -2.908 7.817 1.00 0.00 C ATOM 115 CG ASN A 9 10.766 -2.266 7.165 1.00 0.00 C ATOM 116 OD1 ASN A 9 10.673 -2.179 5.942 1.00 0.00 O ATOM 117 ND2 ASN A 9 9.822 -1.826 7.984 1.00 0.00 N ATOM 0 H ASN A 9 14.633 -2.073 9.555 1.00 0.00 H new ATOM 0 HA ASN A 9 13.976 -2.224 7.428 1.00 0.00 H new ATOM 0 HB2 ASN A 9 12.335 -3.720 7.182 1.00 0.00 H new ATOM 0 HB3 ASN A 9 11.681 -3.353 8.765 1.00 0.00 H new ATOM 0 HD21 ASN A 9 8.978 -1.396 7.605 1.00 0.00 H new ATOM 0 HD22 ASN A 9 9.939 -1.918 8.993 1.00 0.00 H new ATOM 124 N ALA A 10 12.190 0.227 8.660 1.00 0.00 N ATOM 125 CA ALA A 10 11.808 1.631 8.500 1.00 0.00 C ATOM 126 C ALA A 10 10.585 1.791 7.600 1.00 0.00 C ATOM 127 O ALA A 10 9.458 1.863 8.089 1.00 0.00 O ATOM 128 CB ALA A 10 12.974 2.470 7.987 1.00 0.00 C ATOM 0 H ALA A 10 11.975 -0.150 9.583 1.00 0.00 H new ATOM 0 HA ALA A 10 11.536 2.000 9.489 1.00 0.00 H new ATOM 0 HB1 ALA A 10 12.656 3.507 7.879 1.00 0.00 H new ATOM 0 HB2 ALA A 10 13.801 2.415 8.695 1.00 0.00 H new ATOM 0 HB3 ALA A 10 13.299 2.088 7.019 1.00 0.00 H new ATOM 134 N LYS A 11 10.802 1.837 6.293 1.00 0.00 N ATOM 135 CA LYS A 11 9.726 2.120 5.355 1.00 0.00 C ATOM 136 C LYS A 11 9.924 1.410 4.021 1.00 0.00 C ATOM 137 O LYS A 11 10.582 0.377 3.942 1.00 0.00 O ATOM 138 CB LYS A 11 9.618 3.627 5.132 1.00 0.00 C ATOM 139 CG LYS A 11 8.761 4.322 6.171 1.00 0.00 C ATOM 140 CD LYS A 11 8.899 5.832 6.095 1.00 0.00 C ATOM 141 CE LYS A 11 10.143 6.318 6.820 1.00 0.00 C ATOM 142 NZ LYS A 11 9.805 7.093 8.041 1.00 0.00 N ATOM 0 H LYS A 11 11.712 1.682 5.859 1.00 0.00 H new ATOM 0 HA LYS A 11 8.801 1.742 5.791 1.00 0.00 H new ATOM 0 HB2 LYS A 11 10.617 4.062 5.144 1.00 0.00 H new ATOM 0 HB3 LYS A 11 9.201 3.813 4.142 1.00 0.00 H new ATOM 0 HG2 LYS A 11 7.717 4.044 6.026 1.00 0.00 H new ATOM 0 HG3 LYS A 11 9.047 3.980 7.166 1.00 0.00 H new ATOM 0 HD2 LYS A 11 8.942 6.142 5.051 1.00 0.00 H new ATOM 0 HD3 LYS A 11 8.017 6.301 6.531 1.00 0.00 H new ATOM 0 HE2 LYS A 11 10.762 5.463 7.092 1.00 0.00 H new ATOM 0 HE3 LYS A 11 10.735 6.939 6.148 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 10.681 7.407 8.507 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 9.236 7.923 7.779 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 9.262 6.493 8.694 1.00 0.00 H new ATOM 156 N LEU A 12 9.360 1.999 2.970 1.00 0.00 N ATOM 157 CA LEU A 12 9.369 1.416 1.634 1.00 0.00 C ATOM 158 C LEU A 12 10.727 1.623 0.966 1.00 0.00 C ATOM 159 O LEU A 12 10.803 2.138 -0.149 1.00 0.00 O ATOM 160 CB LEU A 12 8.262 2.051 0.776 1.00 0.00 C ATOM 161 CG LEU A 12 6.818 1.745 1.208 1.00 0.00 C ATOM 162 CD1 LEU A 12 6.434 2.549 2.443 1.00 0.00 C ATOM 163 CD2 LEU A 12 5.856 2.051 0.073 1.00 0.00 C ATOM 0 H LEU A 12 8.882 2.898 3.023 1.00 0.00 H new ATOM 0 HA LEU A 12 9.185 0.345 1.723 1.00 0.00 H new ATOM 0 HB2 LEU A 12 8.401 3.132 0.781 1.00 0.00 H new ATOM 0 HB3 LEU A 12 8.391 1.718 -0.254 1.00 0.00 H new ATOM 0 HG LEU A 12 6.757 0.685 1.456 1.00 0.00 H new ATOM 0 HD11 LEU A 12 5.408 2.313 2.726 1.00 0.00 H new ATOM 0 HD12 LEU A 12 7.105 2.297 3.264 1.00 0.00 H new ATOM 0 HD13 LEU A 12 6.514 3.614 2.223 1.00 0.00 H new ATOM 0 HD21 LEU A 12 4.837 1.831 0.390 1.00 0.00 H new ATOM 0 HD22 LEU A 12 5.933 3.105 -0.195 1.00 0.00 H new ATOM 0 HD23 LEU A 12 6.107 1.438 -0.792 1.00 0.00 H new ATOM 175 N ALA A 13 11.792 1.239 1.684 1.00 0.00 N ATOM 176 CA ALA A 13 13.186 1.387 1.232 1.00 0.00 C ATOM 177 C ALA A 13 13.617 2.856 1.191 1.00 0.00 C ATOM 178 O ALA A 13 14.780 3.185 1.425 1.00 0.00 O ATOM 179 CB ALA A 13 13.400 0.726 -0.124 1.00 0.00 C ATOM 0 H ALA A 13 11.710 0.811 2.606 1.00 0.00 H new ATOM 0 HA ALA A 13 13.814 0.878 1.963 1.00 0.00 H new ATOM 0 HB1 ALA A 13 14.438 0.852 -0.431 1.00 0.00 H new ATOM 0 HB2 ALA A 13 13.170 -0.337 -0.051 1.00 0.00 H new ATOM 0 HB3 ALA A 13 12.745 1.189 -0.862 1.00 0.00 H new ATOM 185 N THR A 14 12.670 3.726 0.896 1.00 0.00 N ATOM 186 CA THR A 14 12.910 5.156 0.821 1.00 0.00 C ATOM 187 C THR A 14 11.602 5.896 1.044 1.00 0.00 C ATOM 188 O THR A 14 11.472 6.672 1.989 1.00 0.00 O ATOM 189 CB THR A 14 13.492 5.572 -0.547 1.00 0.00 C ATOM 190 OG1 THR A 14 13.777 4.410 -1.338 1.00 0.00 O ATOM 191 CG2 THR A 14 14.758 6.395 -0.366 1.00 0.00 C ATOM 0 H THR A 14 11.705 3.459 0.700 1.00 0.00 H new ATOM 0 HA THR A 14 13.637 5.412 1.591 1.00 0.00 H new ATOM 0 HB THR A 14 12.750 6.183 -1.062 1.00 0.00 H new ATOM 0 HG1 THR A 14 14.144 4.686 -2.204 1.00 0.00 H new ATOM 0 HG21 THR A 14 15.151 6.677 -1.343 1.00 0.00 H new ATOM 0 HG22 THR A 14 14.529 7.294 0.207 1.00 0.00 H new ATOM 0 HG23 THR A 14 15.503 5.805 0.168 1.00 0.00 H new ATOM 199 N SER A 15 10.617 5.586 0.197 1.00 0.00 N ATOM 200 CA SER A 15 9.294 6.214 0.245 1.00 0.00 C ATOM 201 C SER A 15 9.408 7.738 0.351 1.00 0.00 C ATOM 202 O SER A 15 8.725 8.364 1.157 1.00 0.00 O ATOM 203 CB SER A 15 8.469 5.660 1.418 1.00 0.00 C ATOM 204 OG SER A 15 9.255 4.844 2.271 1.00 0.00 O ATOM 0 H SER A 15 10.715 4.891 -0.543 1.00 0.00 H new ATOM 0 HA SER A 15 8.781 5.974 -0.686 1.00 0.00 H new ATOM 0 HB2 SER A 15 8.049 6.487 1.991 1.00 0.00 H new ATOM 0 HB3 SER A 15 7.630 5.081 1.032 1.00 0.00 H new ATOM 0 HG SER A 15 9.771 5.411 2.882 1.00 0.00 H new ATOM 210 N ALA A 16 10.264 8.328 -0.482 1.00 0.00 N ATOM 211 CA ALA A 16 10.569 9.754 -0.390 1.00 0.00 C ATOM 212 C ALA A 16 9.321 10.603 -0.580 1.00 0.00 C ATOM 213 O ALA A 16 8.906 11.329 0.323 1.00 0.00 O ATOM 214 CB ALA A 16 11.631 10.130 -1.410 1.00 0.00 C ATOM 0 H ALA A 16 10.759 7.840 -1.229 1.00 0.00 H new ATOM 0 HA ALA A 16 10.954 9.953 0.610 1.00 0.00 H new ATOM 0 HB1 ALA A 16 11.850 11.195 -1.332 1.00 0.00 H new ATOM 0 HB2 ALA A 16 12.539 9.558 -1.218 1.00 0.00 H new ATOM 0 HB3 ALA A 16 11.267 9.907 -2.413 1.00 0.00 H new ATOM 220 N ALA A 17 8.712 10.498 -1.750 1.00 0.00 N ATOM 221 CA ALA A 17 7.512 11.261 -2.047 1.00 0.00 C ATOM 222 C ALA A 17 6.301 10.656 -1.349 1.00 0.00 C ATOM 223 O ALA A 17 5.327 11.348 -1.059 1.00 0.00 O ATOM 224 CB ALA A 17 7.290 11.327 -3.546 1.00 0.00 C ATOM 0 H ALA A 17 9.029 9.893 -2.508 1.00 0.00 H new ATOM 0 HA ALA A 17 7.645 12.275 -1.671 1.00 0.00 H new ATOM 0 HB1 ALA A 17 6.388 11.901 -3.755 1.00 0.00 H new ATOM 0 HB2 ALA A 17 8.145 11.809 -4.020 1.00 0.00 H new ATOM 0 HB3 ALA A 17 7.177 10.318 -3.942 1.00 0.00 H new ATOM 230 N PHE A 18 6.377 9.363 -1.069 1.00 0.00 N ATOM 231 CA PHE A 18 5.296 8.667 -0.383 1.00 0.00 C ATOM 232 C PHE A 18 5.125 9.212 1.030 1.00 0.00 C ATOM 233 O PHE A 18 4.006 9.355 1.521 1.00 0.00 O ATOM 234 CB PHE A 18 5.572 7.161 -0.343 1.00 0.00 C ATOM 235 CG PHE A 18 4.433 6.353 0.212 1.00 0.00 C ATOM 236 CD1 PHE A 18 3.245 6.237 -0.489 1.00 0.00 C ATOM 237 CD2 PHE A 18 4.558 5.707 1.431 1.00 0.00 C ATOM 238 CE1 PHE A 18 2.202 5.488 0.015 1.00 0.00 C ATOM 239 CE2 PHE A 18 3.516 4.956 1.940 1.00 0.00 C ATOM 240 CZ PHE A 18 2.336 4.848 1.232 1.00 0.00 C ATOM 0 H PHE A 18 7.175 8.774 -1.306 1.00 0.00 H new ATOM 0 HA PHE A 18 4.371 8.836 -0.934 1.00 0.00 H new ATOM 0 HB2 PHE A 18 5.794 6.814 -1.352 1.00 0.00 H new ATOM 0 HB3 PHE A 18 6.462 6.980 0.259 1.00 0.00 H new ATOM 0 HD1 PHE A 18 3.134 6.738 -1.439 1.00 0.00 H new ATOM 0 HD2 PHE A 18 5.479 5.791 1.989 1.00 0.00 H new ATOM 0 HE1 PHE A 18 1.281 5.402 -0.542 1.00 0.00 H new ATOM 0 HE2 PHE A 18 3.625 4.454 2.890 1.00 0.00 H new ATOM 0 HZ PHE A 18 1.519 4.264 1.629 1.00 0.00 H new ATOM 250 N ALA A 19 6.241 9.522 1.675 1.00 0.00 N ATOM 251 CA ALA A 19 6.224 10.077 3.023 1.00 0.00 C ATOM 252 C ALA A 19 5.658 11.496 3.037 1.00 0.00 C ATOM 253 O ALA A 19 5.222 11.985 4.077 1.00 0.00 O ATOM 254 CB ALA A 19 7.620 10.065 3.615 1.00 0.00 C ATOM 0 H ALA A 19 7.175 9.398 1.284 1.00 0.00 H new ATOM 0 HA ALA A 19 5.572 9.450 3.632 1.00 0.00 H new ATOM 0 HB1 ALA A 19 7.592 10.482 4.622 1.00 0.00 H new ATOM 0 HB2 ALA A 19 7.989 9.040 3.657 1.00 0.00 H new ATOM 0 HB3 ALA A 19 8.284 10.664 2.992 1.00 0.00 H new ATOM 260 N LYS A 20 5.658 12.154 1.883 1.00 0.00 N ATOM 261 CA LYS A 20 5.089 13.492 1.777 1.00 0.00 C ATOM 262 C LYS A 20 3.576 13.386 1.842 1.00 0.00 C ATOM 263 O LYS A 20 2.887 14.277 2.339 1.00 0.00 O ATOM 264 CB LYS A 20 5.517 14.162 0.470 1.00 0.00 C ATOM 265 CG LYS A 20 6.601 15.214 0.650 1.00 0.00 C ATOM 266 CD LYS A 20 7.953 14.705 0.184 1.00 0.00 C ATOM 267 CE LYS A 20 9.072 15.167 1.108 1.00 0.00 C ATOM 268 NZ LYS A 20 9.836 16.304 0.528 1.00 0.00 N ATOM 0 H LYS A 20 6.043 11.786 1.013 1.00 0.00 H new ATOM 0 HA LYS A 20 5.453 14.105 2.601 1.00 0.00 H new ATOM 0 HB2 LYS A 20 5.875 13.398 -0.220 1.00 0.00 H new ATOM 0 HB3 LYS A 20 4.646 14.626 0.007 1.00 0.00 H new ATOM 0 HG2 LYS A 20 6.336 16.111 0.090 1.00 0.00 H new ATOM 0 HG3 LYS A 20 6.661 15.500 1.700 1.00 0.00 H new ATOM 0 HD2 LYS A 20 7.939 13.616 0.144 1.00 0.00 H new ATOM 0 HD3 LYS A 20 8.147 15.058 -0.829 1.00 0.00 H new ATOM 0 HE2 LYS A 20 8.650 15.465 2.068 1.00 0.00 H new ATOM 0 HE3 LYS A 20 9.750 14.335 1.302 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 10.588 16.589 1.187 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 10.260 16.012 -0.376 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 9.195 17.107 0.367 1.00 0.00 H new ATOM 282 N GLN A 21 3.079 12.255 1.360 1.00 0.00 N ATOM 283 CA GLN A 21 1.663 11.948 1.401 1.00 0.00 C ATOM 284 C GLN A 21 1.234 11.619 2.828 1.00 0.00 C ATOM 285 O GLN A 21 0.079 11.815 3.204 1.00 0.00 O ATOM 286 CB GLN A 21 1.365 10.770 0.480 1.00 0.00 C ATOM 287 CG GLN A 21 0.191 11.016 -0.442 1.00 0.00 C ATOM 288 CD GLN A 21 0.165 10.067 -1.622 1.00 0.00 C ATOM 289 OE1 GLN A 21 0.349 10.475 -2.765 1.00 0.00 O ATOM 290 NE2 GLN A 21 -0.053 8.792 -1.350 1.00 0.00 N ATOM 0 H GLN A 21 3.650 11.527 0.930 1.00 0.00 H new ATOM 0 HA GLN A 21 1.102 12.819 1.061 1.00 0.00 H new ATOM 0 HB2 GLN A 21 2.249 10.553 -0.119 1.00 0.00 H new ATOM 0 HB3 GLN A 21 1.164 9.886 1.085 1.00 0.00 H new ATOM 0 HG2 GLN A 21 -0.736 10.913 0.122 1.00 0.00 H new ATOM 0 HG3 GLN A 21 0.230 12.042 -0.807 1.00 0.00 H new ATOM 0 HE21 GLN A 21 -0.201 8.494 -0.386 1.00 0.00 H new ATOM 0 HE22 GLN A 21 -0.073 8.106 -2.104 1.00 0.00 H new ATOM 299 N ALA A 22 2.189 11.142 3.620 1.00 0.00 N ATOM 300 CA ALA A 22 1.938 10.780 5.012 1.00 0.00 C ATOM 301 C ALA A 22 1.808 12.026 5.880 1.00 0.00 C ATOM 302 O ALA A 22 1.503 11.942 7.067 1.00 0.00 O ATOM 303 CB ALA A 22 3.050 9.881 5.535 1.00 0.00 C ATOM 0 H ALA A 22 3.152 10.996 3.319 1.00 0.00 H new ATOM 0 HA ALA A 22 0.997 10.233 5.059 1.00 0.00 H new ATOM 0 HB1 ALA A 22 2.848 9.620 6.574 1.00 0.00 H new ATOM 0 HB2 ALA A 22 3.096 8.972 4.935 1.00 0.00 H new ATOM 0 HB3 ALA A 22 4.003 10.406 5.471 1.00 0.00 H new ATOM 309 N GLU A 23 2.050 13.185 5.285 1.00 0.00 N ATOM 310 CA GLU A 23 1.885 14.444 5.987 1.00 0.00 C ATOM 311 C GLU A 23 0.421 14.850 5.998 1.00 0.00 C ATOM 312 O GLU A 23 -0.016 15.635 6.840 1.00 0.00 O ATOM 313 CB GLU A 23 2.729 15.535 5.332 1.00 0.00 C ATOM 314 CG GLU A 23 4.186 15.500 5.752 1.00 0.00 C ATOM 315 CD GLU A 23 4.445 16.317 6.999 1.00 0.00 C ATOM 316 OE1 GLU A 23 4.371 17.561 6.927 1.00 0.00 O ATOM 317 OE2 GLU A 23 4.723 15.716 8.060 1.00 0.00 O ATOM 0 H GLU A 23 2.361 13.277 4.318 1.00 0.00 H new ATOM 0 HA GLU A 23 2.222 14.315 7.015 1.00 0.00 H new ATOM 0 HB2 GLU A 23 2.668 15.431 4.249 1.00 0.00 H new ATOM 0 HB3 GLU A 23 2.309 16.509 5.583 1.00 0.00 H new ATOM 0 HG2 GLU A 23 4.486 14.467 5.929 1.00 0.00 H new ATOM 0 HG3 GLU A 23 4.805 15.877 4.938 1.00 0.00 H new ATOM 324 N GLY A 24 -0.336 14.301 5.059 1.00 0.00 N ATOM 325 CA GLY A 24 -1.748 14.592 4.989 1.00 0.00 C ATOM 326 C GLY A 24 -2.539 13.767 5.980 1.00 0.00 C ATOM 327 O GLY A 24 -3.598 14.184 6.444 1.00 0.00 O ATOM 0 H GLY A 24 0.006 13.658 4.344 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -1.911 15.652 5.185 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -2.111 14.395 3.980 1.00 0.00 H new ATOM 331 N THR A 25 -2.015 12.595 6.310 1.00 0.00 N ATOM 332 CA THR A 25 -2.671 11.694 7.247 1.00 0.00 C ATOM 333 C THR A 25 -1.653 11.012 8.149 1.00 0.00 C ATOM 334 O THR A 25 -0.829 10.220 7.687 1.00 0.00 O ATOM 335 CB THR A 25 -3.489 10.614 6.514 1.00 0.00 C ATOM 336 OG1 THR A 25 -3.673 10.991 5.144 1.00 0.00 O ATOM 337 CG2 THR A 25 -4.843 10.415 7.184 1.00 0.00 C ATOM 0 H THR A 25 -1.132 12.244 5.940 1.00 0.00 H new ATOM 0 HA THR A 25 -3.345 12.302 7.850 1.00 0.00 H new ATOM 0 HB THR A 25 -2.941 9.673 6.560 1.00 0.00 H new ATOM 0 HG1 THR A 25 -3.423 10.243 4.562 1.00 0.00 H new ATOM 0 HG21 THR A 25 -5.404 9.648 6.650 1.00 0.00 H new ATOM 0 HG22 THR A 25 -4.695 10.103 8.218 1.00 0.00 H new ATOM 0 HG23 THR A 25 -5.400 11.352 7.164 1.00 0.00 H new ATOM 345 N THR A 26 -1.698 11.336 9.434 1.00 0.00 N ATOM 346 CA THR A 26 -0.849 10.680 10.411 1.00 0.00 C ATOM 347 C THR A 26 -1.281 9.227 10.583 1.00 0.00 C ATOM 348 O THR A 26 -2.381 8.950 11.063 1.00 0.00 O ATOM 349 CB THR A 26 -0.887 11.401 11.782 1.00 0.00 C ATOM 350 OG1 THR A 26 -0.067 12.576 11.745 1.00 0.00 O ATOM 351 CG2 THR A 26 -0.400 10.494 12.909 1.00 0.00 C ATOM 0 H THR A 26 -2.315 12.050 9.821 1.00 0.00 H new ATOM 0 HA THR A 26 0.175 10.720 10.039 1.00 0.00 H new ATOM 0 HB THR A 26 -1.924 11.673 11.977 1.00 0.00 H new ATOM 0 HG1 THR A 26 -0.099 13.025 12.615 1.00 0.00 H new ATOM 0 HG21 THR A 26 -0.441 11.035 13.855 1.00 0.00 H new ATOM 0 HG22 THR A 26 -1.038 9.612 12.967 1.00 0.00 H new ATOM 0 HG23 THR A 26 0.627 10.187 12.711 1.00 0.00 H new ATOM 359 N CYS A 27 -0.421 8.312 10.173 1.00 0.00 N ATOM 360 CA CYS A 27 -0.689 6.893 10.308 1.00 0.00 C ATOM 361 C CYS A 27 0.622 6.139 10.511 1.00 0.00 C ATOM 362 O CYS A 27 1.699 6.659 10.215 1.00 0.00 O ATOM 363 CB CYS A 27 -1.437 6.365 9.077 1.00 0.00 C ATOM 364 SG CYS A 27 -3.155 5.841 9.410 1.00 0.00 S ATOM 0 H CYS A 27 0.476 8.530 9.740 1.00 0.00 H new ATOM 0 HA CYS A 27 -1.325 6.733 11.179 1.00 0.00 H new ATOM 0 HB2 CYS A 27 -1.448 7.142 8.312 1.00 0.00 H new ATOM 0 HB3 CYS A 27 -0.885 5.520 8.665 1.00 0.00 H new ATOM 369 N ASN A 28 0.520 4.920 11.014 1.00 0.00 N ATOM 370 CA ASN A 28 1.690 4.110 11.333 1.00 0.00 C ATOM 371 C ASN A 28 2.125 3.327 10.103 1.00 0.00 C ATOM 372 O ASN A 28 1.416 3.316 9.104 1.00 0.00 O ATOM 373 CB ASN A 28 1.358 3.148 12.479 1.00 0.00 C ATOM 374 CG ASN A 28 2.580 2.733 13.276 1.00 0.00 C ATOM 375 OD1 ASN A 28 3.714 2.975 12.869 1.00 0.00 O ATOM 376 ND2 ASN A 28 2.352 2.100 14.417 1.00 0.00 N ATOM 0 H ASN A 28 -0.370 4.463 11.213 1.00 0.00 H new ATOM 0 HA ASN A 28 2.506 4.763 11.644 1.00 0.00 H new ATOM 0 HB2 ASN A 28 0.639 3.622 13.147 1.00 0.00 H new ATOM 0 HB3 ASN A 28 0.877 2.259 12.072 1.00 0.00 H new ATOM 0 HD21 ASN A 28 3.134 1.793 14.995 1.00 0.00 H new ATOM 0 HD22 ASN A 28 1.394 1.919 14.718 1.00 0.00 H new ATOM 383 N VAL A 29 3.275 2.672 10.168 1.00 0.00 N ATOM 384 CA VAL A 29 3.732 1.849 9.055 1.00 0.00 C ATOM 385 C VAL A 29 2.776 0.682 8.822 1.00 0.00 C ATOM 386 O VAL A 29 2.494 0.316 7.682 1.00 0.00 O ATOM 387 CB VAL A 29 5.165 1.316 9.272 1.00 0.00 C ATOM 388 CG1 VAL A 29 6.183 2.436 9.103 1.00 0.00 C ATOM 389 CG2 VAL A 29 5.311 0.660 10.636 1.00 0.00 C ATOM 0 H VAL A 29 3.904 2.693 10.971 1.00 0.00 H new ATOM 0 HA VAL A 29 3.746 2.489 8.173 1.00 0.00 H new ATOM 0 HB VAL A 29 5.357 0.555 8.515 1.00 0.00 H new ATOM 0 HG11 VAL A 29 7.187 2.042 9.260 1.00 0.00 H new ATOM 0 HG12 VAL A 29 6.108 2.847 8.096 1.00 0.00 H new ATOM 0 HG13 VAL A 29 5.984 3.222 9.832 1.00 0.00 H new ATOM 0 HG21 VAL A 29 6.331 0.296 10.757 1.00 0.00 H new ATOM 0 HG22 VAL A 29 5.091 1.389 11.416 1.00 0.00 H new ATOM 0 HG23 VAL A 29 4.615 -0.176 10.714 1.00 0.00 H new ATOM 399 N GLY A 30 2.245 0.135 9.912 1.00 0.00 N ATOM 400 CA GLY A 30 1.257 -0.923 9.811 1.00 0.00 C ATOM 401 C GLY A 30 -0.151 -0.366 9.813 1.00 0.00 C ATOM 402 O GLY A 30 -1.102 -1.027 10.236 1.00 0.00 O ATOM 0 H GLY A 30 2.483 0.407 10.866 1.00 0.00 H new ATOM 0 HA2 GLY A 30 1.423 -1.492 8.896 1.00 0.00 H new ATOM 0 HA3 GLY A 30 1.377 -1.616 10.644 1.00 0.00 H new ATOM 406 N SER A 31 -0.278 0.884 9.386 1.00 0.00 N ATOM 407 CA SER A 31 -1.572 1.535 9.276 1.00 0.00 C ATOM 408 C SER A 31 -1.615 2.435 8.045 1.00 0.00 C ATOM 409 O SER A 31 -2.664 2.943 7.670 1.00 0.00 O ATOM 410 CB SER A 31 -1.873 2.349 10.535 1.00 0.00 C ATOM 411 OG SER A 31 -1.405 1.679 11.693 1.00 0.00 O ATOM 0 H SER A 31 0.509 1.470 9.108 1.00 0.00 H new ATOM 0 HA SER A 31 -2.334 0.763 9.171 1.00 0.00 H new ATOM 0 HB2 SER A 31 -1.401 3.329 10.461 1.00 0.00 H new ATOM 0 HB3 SER A 31 -2.947 2.517 10.616 1.00 0.00 H new ATOM 0 HG SER A 31 -1.606 2.218 12.486 1.00 0.00 H new ATOM 417 N ILE A 32 -0.469 2.626 7.415 1.00 0.00 N ATOM 418 CA ILE A 32 -0.403 3.419 6.207 1.00 0.00 C ATOM 419 C ILE A 32 -0.496 2.506 5.001 1.00 0.00 C ATOM 420 O ILE A 32 0.164 1.465 4.947 1.00 0.00 O ATOM 421 CB ILE A 32 0.876 4.296 6.160 1.00 0.00 C ATOM 422 CG1 ILE A 32 0.472 5.761 6.225 1.00 0.00 C ATOM 423 CG2 ILE A 32 1.725 4.039 4.918 1.00 0.00 C ATOM 424 CD1 ILE A 32 1.592 6.691 6.635 1.00 0.00 C ATOM 0 H ILE A 32 0.425 2.242 7.722 1.00 0.00 H new ATOM 0 HA ILE A 32 -1.247 4.108 6.196 1.00 0.00 H new ATOM 0 HB ILE A 32 1.494 4.030 7.018 1.00 0.00 H new ATOM 0 HG12 ILE A 32 0.098 6.068 5.248 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -0.352 5.869 6.930 1.00 0.00 H new ATOM 0 HG21 ILE A 32 2.606 4.681 4.940 1.00 0.00 H new ATOM 0 HG22 ILE A 32 2.037 2.995 4.900 1.00 0.00 H new ATOM 0 HG23 ILE A 32 1.139 4.258 4.025 1.00 0.00 H new ATOM 0 HD11 ILE A 32 1.223 7.717 6.658 1.00 0.00 H new ATOM 0 HD12 ILE A 32 1.952 6.413 7.626 1.00 0.00 H new ATOM 0 HD13 ILE A 32 2.409 6.615 5.918 1.00 0.00 H new ATOM 436 N ALA A 33 -1.323 2.878 4.044 1.00 0.00 N ATOM 437 CA ALA A 33 -1.608 1.989 2.941 1.00 0.00 C ATOM 438 C ALA A 33 -1.894 2.733 1.651 1.00 0.00 C ATOM 439 O ALA A 33 -2.141 3.943 1.646 1.00 0.00 O ATOM 440 CB ALA A 33 -2.781 1.090 3.289 1.00 0.00 C ATOM 0 H ALA A 33 -1.803 3.778 4.009 1.00 0.00 H new ATOM 0 HA ALA A 33 -0.714 1.388 2.775 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -2.989 0.423 2.452 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -2.537 0.499 4.172 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -3.660 1.701 3.493 1.00 0.00 H new ATOM 446 N CYS A 34 -1.864 1.985 0.561 1.00 0.00 N ATOM 447 CA CYS A 34 -2.241 2.499 -0.741 1.00 0.00 C ATOM 448 C CYS A 34 -3.335 1.624 -1.329 1.00 0.00 C ATOM 449 O CYS A 34 -3.351 0.409 -1.115 1.00 0.00 O ATOM 450 CB CYS A 34 -1.034 2.536 -1.678 1.00 0.00 C ATOM 451 SG CYS A 34 -1.196 3.739 -3.038 1.00 0.00 S ATOM 0 H CYS A 34 -1.578 1.006 0.556 1.00 0.00 H new ATOM 0 HA CYS A 34 -2.612 3.518 -0.626 1.00 0.00 H new ATOM 0 HB2 CYS A 34 -0.143 2.775 -1.098 1.00 0.00 H new ATOM 0 HB3 CYS A 34 -0.883 1.542 -2.100 1.00 0.00 H new ATOM 456 N CYS A 35 -4.258 2.231 -2.047 1.00 0.00 N ATOM 457 CA CYS A 35 -5.353 1.492 -2.640 1.00 0.00 C ATOM 458 C CYS A 35 -5.403 1.731 -4.135 1.00 0.00 C ATOM 459 O CYS A 35 -4.925 2.755 -4.626 1.00 0.00 O ATOM 460 CB CYS A 35 -6.679 1.904 -2.013 1.00 0.00 C ATOM 461 SG CYS A 35 -7.766 0.510 -1.581 1.00 0.00 S ATOM 0 H CYS A 35 -4.271 3.234 -2.234 1.00 0.00 H new ATOM 0 HA CYS A 35 -5.187 0.431 -2.453 1.00 0.00 H new ATOM 0 HB2 CYS A 35 -6.477 2.485 -1.113 1.00 0.00 H new ATOM 0 HB3 CYS A 35 -7.207 2.561 -2.705 1.00 0.00 H new ATOM 466 N ASN A 36 -5.984 0.782 -4.847 1.00 0.00 N ATOM 467 CA ASN A 36 -6.126 0.882 -6.290 1.00 0.00 C ATOM 468 C ASN A 36 -7.537 0.485 -6.696 1.00 0.00 C ATOM 469 O ASN A 36 -8.238 -0.182 -5.934 1.00 0.00 O ATOM 470 CB ASN A 36 -5.103 -0.017 -6.993 1.00 0.00 C ATOM 471 CG ASN A 36 -4.482 0.644 -8.211 1.00 0.00 C ATOM 472 OD1 ASN A 36 -3.505 1.383 -8.103 1.00 0.00 O ATOM 473 ND2 ASN A 36 -5.043 0.378 -9.379 1.00 0.00 N ATOM 0 H ASN A 36 -6.368 -0.074 -4.446 1.00 0.00 H new ATOM 0 HA ASN A 36 -5.943 1.914 -6.591 1.00 0.00 H new ATOM 0 HB2 ASN A 36 -4.315 -0.284 -6.288 1.00 0.00 H new ATOM 0 HB3 ASN A 36 -5.588 -0.945 -7.296 1.00 0.00 H new ATOM 0 HD21 ASN A 36 -4.666 0.791 -10.232 1.00 0.00 H new ATOM 0 HD22 ASN A 36 -5.853 -0.240 -9.427 1.00 0.00 H new ATOM 480 N SER A 37 -7.954 0.910 -7.878 1.00 0.00 N ATOM 481 CA SER A 37 -9.270 0.575 -8.394 1.00 0.00 C ATOM 482 C SER A 37 -9.466 -0.944 -8.439 1.00 0.00 C ATOM 483 O SER A 37 -8.525 -1.687 -8.734 1.00 0.00 O ATOM 484 CB SER A 37 -9.431 1.187 -9.782 1.00 0.00 C ATOM 485 OG SER A 37 -8.483 2.227 -9.978 1.00 0.00 O ATOM 0 H SER A 37 -7.395 1.492 -8.502 1.00 0.00 H new ATOM 0 HA SER A 37 -10.033 0.983 -7.731 1.00 0.00 H new ATOM 0 HB2 SER A 37 -9.299 0.418 -10.543 1.00 0.00 H new ATOM 0 HB3 SER A 37 -10.441 1.580 -9.898 1.00 0.00 H new ATOM 0 HG SER A 37 -8.597 2.609 -10.873 1.00 0.00 H new ATOM 491 N PRO A 38 -10.692 -1.417 -8.138 1.00 0.00 N ATOM 492 CA PRO A 38 -11.015 -2.855 -8.032 1.00 0.00 C ATOM 493 C PRO A 38 -10.578 -3.677 -9.243 1.00 0.00 C ATOM 494 O PRO A 38 -10.188 -4.834 -9.103 1.00 0.00 O ATOM 495 CB PRO A 38 -12.538 -2.865 -7.915 1.00 0.00 C ATOM 496 CG PRO A 38 -12.872 -1.547 -7.304 1.00 0.00 C ATOM 497 CD PRO A 38 -11.872 -0.574 -7.863 1.00 0.00 C ATOM 0 HA PRO A 38 -10.490 -3.311 -7.193 1.00 0.00 H new ATOM 0 HB2 PRO A 38 -13.011 -2.982 -8.890 1.00 0.00 H new ATOM 0 HB3 PRO A 38 -12.883 -3.690 -7.292 1.00 0.00 H new ATOM 0 HG2 PRO A 38 -13.890 -1.247 -7.552 1.00 0.00 H new ATOM 0 HG3 PRO A 38 -12.809 -1.592 -6.217 1.00 0.00 H new ATOM 0 HD2 PRO A 38 -12.242 -0.093 -8.768 1.00 0.00 H new ATOM 0 HD3 PRO A 38 -11.642 0.219 -7.152 1.00 0.00 H new ATOM 505 N ALA A 39 -10.616 -3.070 -10.425 1.00 0.00 N ATOM 506 CA ALA A 39 -10.244 -3.761 -11.660 1.00 0.00 C ATOM 507 C ALA A 39 -8.755 -4.106 -11.684 1.00 0.00 C ATOM 508 O ALA A 39 -8.283 -4.814 -12.571 1.00 0.00 O ATOM 509 CB ALA A 39 -10.607 -2.912 -12.865 1.00 0.00 C ATOM 0 H ALA A 39 -10.901 -2.099 -10.556 1.00 0.00 H new ATOM 0 HA ALA A 39 -10.802 -4.696 -11.700 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -10.325 -3.437 -13.778 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -11.681 -2.727 -12.869 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -10.075 -1.962 -12.814 1.00 0.00 H new ATOM 515 N GLU A 40 -8.023 -3.607 -10.702 1.00 0.00 N ATOM 516 CA GLU A 40 -6.591 -3.846 -10.611 1.00 0.00 C ATOM 517 C GLU A 40 -6.277 -4.698 -9.390 1.00 0.00 C ATOM 518 O GLU A 40 -5.439 -5.595 -9.444 1.00 0.00 O ATOM 519 CB GLU A 40 -5.831 -2.522 -10.544 1.00 0.00 C ATOM 520 CG GLU A 40 -5.594 -1.889 -11.907 1.00 0.00 C ATOM 521 CD GLU A 40 -4.133 -1.591 -12.157 1.00 0.00 C ATOM 522 OE1 GLU A 40 -3.403 -2.501 -12.604 1.00 0.00 O ATOM 523 OE2 GLU A 40 -3.701 -0.447 -11.894 1.00 0.00 O ATOM 0 H GLU A 40 -8.400 -3.029 -9.951 1.00 0.00 H new ATOM 0 HA GLU A 40 -6.271 -4.383 -11.504 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -6.388 -1.823 -9.920 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -4.870 -2.688 -10.057 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -5.964 -2.557 -12.684 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -6.168 -0.966 -11.981 1.00 0.00 H new ATOM 530 N THR A 41 -6.967 -4.418 -8.291 1.00 0.00 N ATOM 531 CA THR A 41 -6.822 -5.204 -7.078 1.00 0.00 C ATOM 532 C THR A 41 -7.314 -6.624 -7.299 1.00 0.00 C ATOM 533 O THR A 41 -6.790 -7.579 -6.732 1.00 0.00 O ATOM 534 CB THR A 41 -7.634 -4.582 -5.935 1.00 0.00 C ATOM 535 OG1 THR A 41 -8.164 -3.319 -6.354 1.00 0.00 O ATOM 536 CG2 THR A 41 -6.773 -4.402 -4.704 1.00 0.00 C ATOM 0 H THR A 41 -7.634 -3.650 -8.218 1.00 0.00 H new ATOM 0 HA THR A 41 -5.764 -5.217 -6.817 1.00 0.00 H new ATOM 0 HB THR A 41 -8.455 -5.253 -5.682 1.00 0.00 H new ATOM 0 HG1 THR A 41 -8.684 -2.924 -5.623 1.00 0.00 H new ATOM 0 HG21 THR A 41 -7.368 -3.959 -3.905 1.00 0.00 H new ATOM 0 HG22 THR A 41 -6.394 -5.371 -4.380 1.00 0.00 H new ATOM 0 HG23 THR A 41 -5.935 -3.745 -4.939 1.00 0.00 H new ATOM 544 N ASN A 42 -8.326 -6.746 -8.137 1.00 0.00 N ATOM 545 CA ASN A 42 -8.950 -8.026 -8.409 1.00 0.00 C ATOM 546 C ASN A 42 -8.488 -8.562 -9.755 1.00 0.00 C ATOM 547 O ASN A 42 -9.075 -9.496 -10.301 1.00 0.00 O ATOM 548 CB ASN A 42 -10.468 -7.874 -8.399 1.00 0.00 C ATOM 549 CG ASN A 42 -11.066 -8.040 -7.015 1.00 0.00 C ATOM 550 OD1 ASN A 42 -11.896 -8.923 -6.780 1.00 0.00 O ATOM 551 ND2 ASN A 42 -10.659 -7.185 -6.088 1.00 0.00 N ATOM 0 H ASN A 42 -8.737 -5.964 -8.646 1.00 0.00 H new ATOM 0 HA ASN A 42 -8.657 -8.733 -7.633 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -10.733 -6.891 -8.789 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -10.907 -8.612 -9.070 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -11.034 -7.243 -5.141 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -9.971 -6.469 -6.321 1.00 0.00 H new ATOM 558 N ASN A 43 -7.428 -7.958 -10.281 1.00 0.00 N ATOM 559 CA ASN A 43 -6.903 -8.316 -11.602 1.00 0.00 C ATOM 560 C ASN A 43 -6.342 -9.728 -11.590 1.00 0.00 C ATOM 561 O ASN A 43 -6.338 -10.417 -12.608 1.00 0.00 O ATOM 562 CB ASN A 43 -5.810 -7.335 -12.033 1.00 0.00 C ATOM 563 CG ASN A 43 -5.710 -7.184 -13.542 1.00 0.00 C ATOM 564 OD1 ASN A 43 -5.172 -8.045 -14.241 1.00 0.00 O ATOM 565 ND2 ASN A 43 -6.237 -6.084 -14.055 1.00 0.00 N ATOM 0 H ASN A 43 -6.910 -7.214 -9.813 1.00 0.00 H new ATOM 0 HA ASN A 43 -7.726 -8.266 -12.314 1.00 0.00 H new ATOM 0 HB2 ASN A 43 -6.008 -6.360 -11.588 1.00 0.00 H new ATOM 0 HB3 ASN A 43 -4.850 -7.674 -11.643 1.00 0.00 H new ATOM 0 HD21 ASN A 43 -6.206 -5.926 -15.062 1.00 0.00 H new ATOM 0 HD22 ASN A 43 -6.674 -5.394 -13.443 1.00 0.00 H new ATOM 572 N ASP A 44 -5.866 -10.151 -10.431 1.00 0.00 N ATOM 573 CA ASP A 44 -5.358 -11.500 -10.270 1.00 0.00 C ATOM 574 C ASP A 44 -6.234 -12.269 -9.294 1.00 0.00 C ATOM 575 O ASP A 44 -6.701 -11.712 -8.299 1.00 0.00 O ATOM 576 CB ASP A 44 -3.908 -11.481 -9.773 1.00 0.00 C ATOM 577 CG ASP A 44 -3.191 -12.791 -10.040 1.00 0.00 C ATOM 578 OD1 ASP A 44 -3.662 -13.841 -9.565 1.00 0.00 O ATOM 579 OD2 ASP A 44 -2.154 -12.774 -10.728 1.00 0.00 O ATOM 0 H ASP A 44 -5.821 -9.578 -9.588 1.00 0.00 H new ATOM 0 HA ASP A 44 -5.380 -11.996 -11.241 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -3.370 -10.669 -10.261 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -3.896 -11.274 -8.703 1.00 0.00 H new ATOM 584 N SER A 45 -6.468 -13.536 -9.590 1.00 0.00 N ATOM 585 CA SER A 45 -7.245 -14.404 -8.717 1.00 0.00 C ATOM 586 C SER A 45 -6.497 -14.670 -7.415 1.00 0.00 C ATOM 587 O SER A 45 -7.105 -14.949 -6.379 1.00 0.00 O ATOM 588 CB SER A 45 -7.536 -15.712 -9.444 1.00 0.00 C ATOM 589 OG SER A 45 -6.980 -15.689 -10.751 1.00 0.00 O ATOM 0 H SER A 45 -6.128 -13.992 -10.437 1.00 0.00 H new ATOM 0 HA SER A 45 -8.185 -13.912 -8.466 1.00 0.00 H new ATOM 0 HB2 SER A 45 -7.121 -16.548 -8.881 1.00 0.00 H new ATOM 0 HB3 SER A 45 -8.613 -15.870 -9.503 1.00 0.00 H new ATOM 0 HG SER A 45 -7.174 -16.536 -11.204 1.00 0.00 H new ATOM 595 N LEU A 46 -5.176 -14.584 -7.477 1.00 0.00 N ATOM 596 CA LEU A 46 -4.340 -14.766 -6.300 1.00 0.00 C ATOM 597 C LEU A 46 -4.198 -13.451 -5.549 1.00 0.00 C ATOM 598 O LEU A 46 -3.957 -13.437 -4.344 1.00 0.00 O ATOM 599 CB LEU A 46 -2.956 -15.301 -6.702 1.00 0.00 C ATOM 600 CG LEU A 46 -2.729 -16.797 -6.451 1.00 0.00 C ATOM 601 CD1 LEU A 46 -3.133 -17.181 -5.036 1.00 0.00 C ATOM 602 CD2 LEU A 46 -3.491 -17.628 -7.470 1.00 0.00 C ATOM 0 H LEU A 46 -4.659 -14.388 -8.334 1.00 0.00 H new ATOM 0 HA LEU A 46 -4.816 -15.495 -5.645 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -2.802 -15.101 -7.762 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -2.196 -14.740 -6.158 1.00 0.00 H new ATOM 0 HG LEU A 46 -1.664 -17.002 -6.563 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -2.962 -18.247 -4.885 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -2.538 -16.613 -4.321 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -4.190 -16.959 -4.886 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -3.319 -18.687 -7.278 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -4.557 -17.413 -7.391 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -3.145 -17.381 -8.473 1.00 0.00 H new ATOM 614 N LEU A 47 -4.380 -12.348 -6.266 1.00 0.00 N ATOM 615 CA LEU A 47 -4.222 -11.014 -5.695 1.00 0.00 C ATOM 616 C LEU A 47 -5.222 -10.772 -4.574 1.00 0.00 C ATOM 617 O LEU A 47 -4.871 -10.232 -3.528 1.00 0.00 O ATOM 618 CB LEU A 47 -4.411 -9.950 -6.777 1.00 0.00 C ATOM 619 CG LEU A 47 -3.365 -8.831 -6.798 1.00 0.00 C ATOM 620 CD1 LEU A 47 -3.483 -7.951 -5.558 1.00 0.00 C ATOM 621 CD2 LEU A 47 -1.960 -9.410 -6.905 1.00 0.00 C ATOM 0 H LEU A 47 -4.639 -12.351 -7.252 1.00 0.00 H new ATOM 0 HA LEU A 47 -3.214 -10.947 -5.285 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -4.409 -10.443 -7.749 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -5.395 -9.500 -6.650 1.00 0.00 H new ATOM 0 HG LEU A 47 -3.553 -8.212 -7.675 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -2.729 -7.164 -5.597 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -4.475 -7.501 -5.524 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -3.329 -8.557 -4.665 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -1.232 -8.599 -6.918 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -1.767 -10.057 -6.049 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -1.874 -9.989 -7.824 1.00 0.00 H new ATOM 633 N SER A 48 -6.458 -11.191 -4.793 1.00 0.00 N ATOM 634 CA SER A 48 -7.534 -10.940 -3.848 1.00 0.00 C ATOM 635 C SER A 48 -7.304 -11.670 -2.520 1.00 0.00 C ATOM 636 O SER A 48 -7.776 -11.237 -1.472 1.00 0.00 O ATOM 637 CB SER A 48 -8.851 -11.359 -4.485 1.00 0.00 C ATOM 638 OG SER A 48 -8.615 -12.220 -5.590 1.00 0.00 O ATOM 0 H SER A 48 -6.742 -11.710 -5.624 1.00 0.00 H new ATOM 0 HA SER A 48 -7.562 -9.876 -3.615 1.00 0.00 H new ATOM 0 HB2 SER A 48 -9.474 -11.866 -3.748 1.00 0.00 H new ATOM 0 HB3 SER A 48 -9.400 -10.477 -4.814 1.00 0.00 H new ATOM 0 HG SER A 48 -9.471 -12.483 -5.989 1.00 0.00 H new ATOM 644 N GLY A 49 -6.574 -12.779 -2.572 1.00 0.00 N ATOM 645 CA GLY A 49 -6.199 -13.480 -1.354 1.00 0.00 C ATOM 646 C GLY A 49 -4.856 -13.005 -0.835 1.00 0.00 C ATOM 647 O GLY A 49 -4.541 -13.159 0.347 1.00 0.00 O ATOM 0 H GLY A 49 -6.235 -13.206 -3.434 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -6.962 -13.322 -0.592 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -6.158 -14.552 -1.547 1.00 0.00 H new ATOM 651 N LEU A 50 -4.074 -12.419 -1.730 1.00 0.00 N ATOM 652 CA LEU A 50 -2.755 -11.896 -1.395 1.00 0.00 C ATOM 653 C LEU A 50 -2.878 -10.651 -0.525 1.00 0.00 C ATOM 654 O LEU A 50 -2.068 -10.428 0.371 1.00 0.00 O ATOM 655 CB LEU A 50 -1.990 -11.571 -2.684 1.00 0.00 C ATOM 656 CG LEU A 50 -0.583 -12.162 -2.784 1.00 0.00 C ATOM 657 CD1 LEU A 50 -0.648 -13.672 -2.964 1.00 0.00 C ATOM 658 CD2 LEU A 50 0.180 -11.516 -3.934 1.00 0.00 C ATOM 0 H LEU A 50 -4.334 -12.292 -2.708 1.00 0.00 H new ATOM 0 HA LEU A 50 -2.206 -12.651 -0.832 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -2.575 -11.927 -3.532 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -1.917 -10.488 -2.779 1.00 0.00 H new ATOM 0 HG LEU A 50 -0.052 -11.953 -1.855 1.00 0.00 H new ATOM 0 HD11 LEU A 50 0.363 -14.074 -3.033 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -1.159 -14.118 -2.111 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -1.195 -13.906 -3.877 1.00 0.00 H new ATOM 0 HD21 LEU A 50 1.180 -11.946 -3.994 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -0.350 -11.697 -4.869 1.00 0.00 H new ATOM 0 HD23 LEU A 50 0.256 -10.442 -3.762 1.00 0.00 H new ATOM 670 N LEU A 51 -3.902 -9.847 -0.793 1.00 0.00 N ATOM 671 CA LEU A 51 -4.111 -8.604 -0.052 1.00 0.00 C ATOM 672 C LEU A 51 -4.640 -8.880 1.353 1.00 0.00 C ATOM 673 O LEU A 51 -4.423 -8.094 2.272 1.00 0.00 O ATOM 674 CB LEU A 51 -5.067 -7.671 -0.811 1.00 0.00 C ATOM 675 CG LEU A 51 -6.354 -8.316 -1.336 1.00 0.00 C ATOM 676 CD1 LEU A 51 -7.502 -8.096 -0.362 1.00 0.00 C ATOM 677 CD2 LEU A 51 -6.703 -7.754 -2.709 1.00 0.00 C ATOM 0 H LEU A 51 -4.599 -10.031 -1.515 1.00 0.00 H new ATOM 0 HA LEU A 51 -3.145 -8.108 0.042 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -5.339 -6.847 -0.152 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -4.529 -7.240 -1.655 1.00 0.00 H new ATOM 0 HG LEU A 51 -6.189 -9.389 -1.430 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -8.406 -8.562 -0.754 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -7.253 -8.541 0.601 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -7.671 -7.027 -0.234 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -7.619 -8.220 -3.071 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -6.849 -6.676 -2.635 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -5.890 -7.963 -3.405 1.00 0.00 H new ATOM 689 N GLY A 52 -5.314 -10.007 1.519 1.00 0.00 N ATOM 690 CA GLY A 52 -5.907 -10.333 2.795 1.00 0.00 C ATOM 691 C GLY A 52 -4.970 -11.151 3.654 1.00 0.00 C ATOM 692 O GLY A 52 -5.311 -12.258 4.074 1.00 0.00 O ATOM 0 H GLY A 52 -5.461 -10.704 0.788 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -6.172 -9.414 3.318 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -6.832 -10.887 2.636 1.00 0.00 H new ATOM 696 N ALA A 53 -3.791 -10.602 3.924 1.00 0.00 N ATOM 697 CA ALA A 53 -2.765 -11.312 4.677 1.00 0.00 C ATOM 698 C ALA A 53 -3.040 -11.270 6.177 1.00 0.00 C ATOM 699 O ALA A 53 -2.233 -10.768 6.956 1.00 0.00 O ATOM 700 CB ALA A 53 -1.390 -10.737 4.371 1.00 0.00 C ATOM 0 H ALA A 53 -3.522 -9.663 3.631 1.00 0.00 H new ATOM 0 HA ALA A 53 -2.788 -12.357 4.366 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -0.634 -11.278 4.941 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -1.182 -10.838 3.306 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -1.367 -9.683 4.647 1.00 0.00 H new ATOM 706 N GLY A 54 -4.186 -11.798 6.573 1.00 0.00 N ATOM 707 CA GLY A 54 -4.517 -11.872 7.980 1.00 0.00 C ATOM 708 C GLY A 54 -5.784 -11.122 8.319 1.00 0.00 C ATOM 709 O GLY A 54 -5.728 -10.070 8.949 1.00 0.00 O ATOM 0 H GLY A 54 -4.894 -12.177 5.945 1.00 0.00 H new ATOM 0 HA2 GLY A 54 -4.630 -12.917 8.268 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -3.692 -11.467 8.565 1.00 0.00 H new ATOM 713 N LEU A 55 -6.925 -11.653 7.871 1.00 0.00 N ATOM 714 CA LEU A 55 -8.237 -11.070 8.175 1.00 0.00 C ATOM 715 C LEU A 55 -8.315 -9.614 7.728 1.00 0.00 C ATOM 716 O LEU A 55 -8.999 -8.790 8.341 1.00 0.00 O ATOM 717 CB LEU A 55 -8.539 -11.172 9.671 1.00 0.00 C ATOM 718 CG LEU A 55 -9.190 -12.479 10.113 1.00 0.00 C ATOM 719 CD1 LEU A 55 -9.177 -12.590 11.626 1.00 0.00 C ATOM 720 CD2 LEU A 55 -10.616 -12.574 9.586 1.00 0.00 C ATOM 0 H LEU A 55 -6.967 -12.492 7.292 1.00 0.00 H new ATOM 0 HA LEU A 55 -8.985 -11.638 7.622 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -7.608 -11.043 10.223 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -9.193 -10.346 9.951 1.00 0.00 H new ATOM 0 HG LEU A 55 -8.615 -13.307 9.698 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -9.645 -13.528 11.926 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -8.148 -12.567 11.984 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -9.729 -11.755 12.057 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -11.063 -13.513 9.912 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -11.203 -11.740 9.971 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -10.605 -12.537 8.497 1.00 0.00 H new ATOM 732 N LEU A 56 -7.616 -9.310 6.648 1.00 0.00 N ATOM 733 CA LEU A 56 -7.545 -7.954 6.137 1.00 0.00 C ATOM 734 C LEU A 56 -8.777 -7.614 5.315 1.00 0.00 C ATOM 735 O LEU A 56 -9.328 -8.467 4.622 1.00 0.00 O ATOM 736 CB LEU A 56 -6.292 -7.790 5.280 1.00 0.00 C ATOM 737 CG LEU A 56 -5.439 -6.573 5.615 1.00 0.00 C ATOM 738 CD1 LEU A 56 -4.148 -6.996 6.301 1.00 0.00 C ATOM 739 CD2 LEU A 56 -5.142 -5.775 4.357 1.00 0.00 C ATOM 0 H LEU A 56 -7.086 -9.991 6.105 1.00 0.00 H new ATOM 0 HA LEU A 56 -7.501 -7.271 6.986 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -5.679 -8.685 5.384 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -6.591 -7.729 4.234 1.00 0.00 H new ATOM 0 HG LEU A 56 -5.997 -5.938 6.303 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -3.553 -6.113 6.532 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -4.383 -7.527 7.224 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -3.582 -7.652 5.639 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -4.532 -4.908 4.611 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -4.603 -6.402 3.647 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -6.078 -5.441 3.909 1.00 0.00 H new ATOM 751 N ASN A 57 -9.201 -6.366 5.400 1.00 0.00 N ATOM 752 CA ASN A 57 -10.337 -5.889 4.637 1.00 0.00 C ATOM 753 C ASN A 57 -9.893 -4.741 3.747 1.00 0.00 C ATOM 754 O ASN A 57 -8.716 -4.379 3.731 1.00 0.00 O ATOM 755 CB ASN A 57 -11.471 -5.442 5.564 1.00 0.00 C ATOM 756 CG ASN A 57 -12.851 -5.664 4.960 1.00 0.00 C ATOM 757 OD1 ASN A 57 -13.083 -5.391 3.780 1.00 0.00 O ATOM 758 ND2 ASN A 57 -13.785 -6.134 5.769 1.00 0.00 N ATOM 0 H ASN A 57 -8.770 -5.660 5.996 1.00 0.00 H new ATOM 0 HA ASN A 57 -10.717 -6.702 4.019 1.00 0.00 H new ATOM 0 HB2 ASN A 57 -11.400 -5.986 6.506 1.00 0.00 H new ATOM 0 HB3 ASN A 57 -11.348 -4.384 5.797 1.00 0.00 H new ATOM 0 HD21 ASN A 57 -14.733 -6.281 5.422 1.00 0.00 H new ATOM 0 HD22 ASN A 57 -13.558 -6.349 6.740 1.00 0.00 H new ATOM 765 N GLY A 58 -10.827 -4.172 3.012 1.00 0.00 N ATOM 766 CA GLY A 58 -10.486 -3.134 2.067 1.00 0.00 C ATOM 767 C GLY A 58 -11.119 -1.809 2.420 1.00 0.00 C ATOM 768 O GLY A 58 -10.920 -1.294 3.520 1.00 0.00 O ATOM 0 H GLY A 58 -11.818 -4.409 3.051 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -9.403 -3.019 2.032 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -10.807 -3.434 1.069 1.00 0.00 H new ATOM 772 N LEU A 59 -11.892 -1.266 1.490 1.00 0.00 N ATOM 773 CA LEU A 59 -12.552 0.017 1.692 1.00 0.00 C ATOM 774 C LEU A 59 -13.581 -0.077 2.807 1.00 0.00 C ATOM 775 O LEU A 59 -14.238 -1.108 2.972 1.00 0.00 O ATOM 776 CB LEU A 59 -13.231 0.478 0.399 1.00 0.00 C ATOM 777 CG LEU A 59 -12.509 1.601 -0.352 1.00 0.00 C ATOM 778 CD1 LEU A 59 -12.454 2.865 0.493 1.00 0.00 C ATOM 779 CD2 LEU A 59 -11.108 1.160 -0.750 1.00 0.00 C ATOM 0 H LEU A 59 -12.078 -1.696 0.584 1.00 0.00 H new ATOM 0 HA LEU A 59 -11.793 0.746 1.976 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -13.328 -0.379 -0.267 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -14.241 0.812 0.637 1.00 0.00 H new ATOM 0 HG LEU A 59 -13.071 1.823 -1.259 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -11.937 3.650 -0.059 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -13.468 3.192 0.725 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -11.918 2.660 1.420 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -10.609 1.970 -1.283 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -10.538 0.909 0.144 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -11.172 0.285 -1.397 1.00 0.00 H new ATOM 791 N SER A 60 -13.704 0.995 3.572 1.00 0.00 N ATOM 792 CA SER A 60 -14.640 1.058 4.680 1.00 0.00 C ATOM 793 C SER A 60 -16.078 0.816 4.223 1.00 0.00 C ATOM 794 O SER A 60 -16.764 1.736 3.779 1.00 0.00 O ATOM 795 CB SER A 60 -14.518 2.419 5.361 1.00 0.00 C ATOM 796 OG SER A 60 -13.758 3.317 4.559 1.00 0.00 O ATOM 0 H SER A 60 -13.157 1.846 3.442 1.00 0.00 H new ATOM 0 HA SER A 60 -14.392 0.267 5.387 1.00 0.00 H new ATOM 0 HB2 SER A 60 -15.511 2.833 5.538 1.00 0.00 H new ATOM 0 HB3 SER A 60 -14.043 2.302 6.335 1.00 0.00 H new ATOM 0 HG SER A 60 -13.825 4.222 4.928 1.00 0.00 H new ATOM 802 N GLY A 61 -16.517 -0.435 4.313 1.00 0.00 N ATOM 803 CA GLY A 61 -17.884 -0.775 3.975 1.00 0.00 C ATOM 804 C GLY A 61 -18.059 -1.178 2.523 1.00 0.00 C ATOM 805 O GLY A 61 -19.127 -1.651 2.136 1.00 0.00 O ATOM 0 H GLY A 61 -15.945 -1.223 4.616 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -18.217 -1.592 4.615 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -18.527 0.079 4.188 1.00 0.00 H new ATOM 809 N ASN A 62 -17.017 -1.017 1.720 1.00 0.00 N ATOM 810 CA ASN A 62 -17.120 -1.290 0.290 1.00 0.00 C ATOM 811 C ASN A 62 -16.425 -2.592 -0.083 1.00 0.00 C ATOM 812 O ASN A 62 -15.368 -2.935 0.455 1.00 0.00 O ATOM 813 CB ASN A 62 -16.538 -0.135 -0.529 1.00 0.00 C ATOM 814 CG ASN A 62 -17.017 -0.146 -1.970 1.00 0.00 C ATOM 815 OD1 ASN A 62 -18.050 -0.738 -2.293 1.00 0.00 O ATOM 816 ND2 ASN A 62 -16.267 0.503 -2.849 1.00 0.00 N ATOM 0 H ASN A 62 -16.097 -0.702 2.029 1.00 0.00 H new ATOM 0 HA ASN A 62 -18.180 -1.391 0.057 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -16.815 0.811 -0.065 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -15.450 -0.193 -0.511 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -16.537 0.525 -3.832 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -15.419 0.981 -2.542 1.00 0.00 H new ATOM 823 N THR A 63 -17.040 -3.317 -0.997 1.00 0.00 N ATOM 824 CA THR A 63 -16.511 -4.572 -1.476 1.00 0.00 C ATOM 825 C THR A 63 -15.903 -4.408 -2.865 1.00 0.00 C ATOM 826 O THR A 63 -16.475 -3.736 -3.724 1.00 0.00 O ATOM 827 CB THR A 63 -17.624 -5.630 -1.527 1.00 0.00 C ATOM 828 OG1 THR A 63 -18.568 -5.394 -0.471 1.00 0.00 O ATOM 829 CG2 THR A 63 -17.044 -7.023 -1.393 1.00 0.00 C ATOM 0 H THR A 63 -17.924 -3.048 -1.428 1.00 0.00 H new ATOM 0 HA THR A 63 -15.732 -4.897 -0.787 1.00 0.00 H new ATOM 0 HB THR A 63 -18.129 -5.555 -2.490 1.00 0.00 H new ATOM 0 HG1 THR A 63 -19.277 -6.070 -0.509 1.00 0.00 H new ATOM 0 HG21 THR A 63 -17.849 -7.757 -1.432 1.00 0.00 H new ATOM 0 HG22 THR A 63 -16.346 -7.207 -2.210 1.00 0.00 H new ATOM 0 HG23 THR A 63 -16.520 -7.109 -0.441 1.00 0.00 H new ATOM 837 N GLY A 64 -14.736 -5.001 -3.075 1.00 0.00 N ATOM 838 CA GLY A 64 -14.097 -4.933 -4.372 1.00 0.00 C ATOM 839 C GLY A 64 -12.822 -4.123 -4.330 1.00 0.00 C ATOM 840 O GLY A 64 -11.830 -4.474 -4.967 1.00 0.00 O ATOM 0 H GLY A 64 -14.221 -5.528 -2.370 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -13.875 -5.942 -4.721 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -14.785 -4.491 -5.093 1.00 0.00 H new ATOM 844 N SER A 65 -12.851 -3.037 -3.574 1.00 0.00 N ATOM 845 CA SER A 65 -11.690 -2.184 -3.418 1.00 0.00 C ATOM 846 C SER A 65 -10.955 -2.535 -2.128 1.00 0.00 C ATOM 847 O SER A 65 -11.506 -2.405 -1.034 1.00 0.00 O ATOM 848 CB SER A 65 -12.126 -0.718 -3.411 1.00 0.00 C ATOM 849 OG SER A 65 -13.530 -0.610 -3.596 1.00 0.00 O ATOM 0 H SER A 65 -13.673 -2.726 -3.057 1.00 0.00 H new ATOM 0 HA SER A 65 -11.009 -2.341 -4.254 1.00 0.00 H new ATOM 0 HB2 SER A 65 -11.842 -0.254 -2.467 1.00 0.00 H new ATOM 0 HB3 SER A 65 -11.607 -0.176 -4.202 1.00 0.00 H new ATOM 0 HG SER A 65 -13.789 0.335 -3.587 1.00 0.00 H new ATOM 855 N ALA A 66 -9.726 -3.006 -2.266 1.00 0.00 N ATOM 856 CA ALA A 66 -8.923 -3.409 -1.122 1.00 0.00 C ATOM 857 C ALA A 66 -7.561 -2.737 -1.165 1.00 0.00 C ATOM 858 O ALA A 66 -7.048 -2.438 -2.244 1.00 0.00 O ATOM 859 CB ALA A 66 -8.772 -4.919 -1.097 1.00 0.00 C ATOM 0 H ALA A 66 -9.260 -3.119 -3.166 1.00 0.00 H new ATOM 0 HA ALA A 66 -9.430 -3.094 -0.210 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -8.169 -5.210 -0.237 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -9.756 -5.382 -1.024 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -8.282 -5.251 -2.012 1.00 0.00 H new ATOM 865 N CYS A 67 -6.974 -2.506 0.002 1.00 0.00 N ATOM 866 CA CYS A 67 -5.698 -1.810 0.079 1.00 0.00 C ATOM 867 C CYS A 67 -4.709 -2.581 0.943 1.00 0.00 C ATOM 868 O CYS A 67 -5.097 -3.232 1.913 1.00 0.00 O ATOM 869 CB CYS A 67 -5.881 -0.394 0.637 1.00 0.00 C ATOM 870 SG CYS A 67 -7.554 0.307 0.430 1.00 0.00 S ATOM 0 H CYS A 67 -7.359 -2.789 0.903 1.00 0.00 H new ATOM 0 HA CYS A 67 -5.299 -1.740 -0.933 1.00 0.00 H new ATOM 0 HB2 CYS A 67 -5.637 -0.404 1.699 1.00 0.00 H new ATOM 0 HB3 CYS A 67 -5.164 0.267 0.151 1.00 0.00 H new ATOM 875 N ALA A 68 -3.432 -2.500 0.589 1.00 0.00 N ATOM 876 CA ALA A 68 -2.382 -3.154 1.352 1.00 0.00 C ATOM 877 C ALA A 68 -1.459 -2.115 1.971 1.00 0.00 C ATOM 878 O ALA A 68 -1.347 -0.996 1.467 1.00 0.00 O ATOM 879 CB ALA A 68 -1.598 -4.117 0.479 1.00 0.00 C ATOM 0 H ALA A 68 -3.100 -1.985 -0.226 1.00 0.00 H new ATOM 0 HA ALA A 68 -2.845 -3.730 2.153 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -0.818 -4.594 1.073 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -2.270 -4.879 0.083 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -1.142 -3.571 -0.347 1.00 0.00 H new ATOM 885 N LYS A 69 -0.804 -2.492 3.056 1.00 0.00 N ATOM 886 CA LYS A 69 0.005 -1.559 3.830 1.00 0.00 C ATOM 887 C LYS A 69 1.481 -1.719 3.498 1.00 0.00 C ATOM 888 O LYS A 69 1.860 -2.623 2.753 1.00 0.00 O ATOM 889 CB LYS A 69 -0.216 -1.782 5.328 1.00 0.00 C ATOM 890 CG LYS A 69 -1.587 -1.347 5.830 1.00 0.00 C ATOM 891 CD LYS A 69 -2.690 -2.325 5.430 1.00 0.00 C ATOM 892 CE LYS A 69 -3.105 -3.210 6.595 1.00 0.00 C ATOM 893 NZ LYS A 69 -4.571 -3.467 6.622 1.00 0.00 N ATOM 0 H LYS A 69 -0.816 -3.443 3.424 1.00 0.00 H new ATOM 0 HA LYS A 69 -0.303 -0.546 3.569 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -0.079 -2.840 5.550 1.00 0.00 H new ATOM 0 HB3 LYS A 69 0.550 -1.239 5.881 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -1.562 -1.256 6.916 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -1.820 -0.359 5.433 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -3.555 -1.770 5.068 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -2.343 -2.948 4.605 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -2.574 -4.160 6.533 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -2.805 -2.738 7.531 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -4.994 -2.980 7.438 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -5.002 -3.111 5.745 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -4.743 -4.490 6.702 1.00 0.00 H new ATOM 907 N ALA A 70 2.304 -0.847 4.066 1.00 0.00 N ATOM 908 CA ALA A 70 3.742 -0.881 3.831 1.00 0.00 C ATOM 909 C ALA A 70 4.344 -2.198 4.303 1.00 0.00 C ATOM 910 O ALA A 70 5.223 -2.759 3.646 1.00 0.00 O ATOM 911 CB ALA A 70 4.419 0.289 4.517 1.00 0.00 C ATOM 0 H ALA A 70 1.999 -0.105 4.695 1.00 0.00 H new ATOM 0 HA ALA A 70 3.910 -0.800 2.757 1.00 0.00 H new ATOM 0 HB1 ALA A 70 5.492 0.248 4.331 1.00 0.00 H new ATOM 0 HB2 ALA A 70 4.018 1.223 4.124 1.00 0.00 H new ATOM 0 HB3 ALA A 70 4.234 0.238 5.590 1.00 0.00 H new ATOM 917 N SER A 71 3.865 -2.693 5.434 1.00 0.00 N ATOM 918 CA SER A 71 4.321 -3.969 5.954 1.00 0.00 C ATOM 919 C SER A 71 3.913 -5.105 5.017 1.00 0.00 C ATOM 920 O SER A 71 4.666 -6.059 4.811 1.00 0.00 O ATOM 921 CB SER A 71 3.744 -4.191 7.350 1.00 0.00 C ATOM 922 OG SER A 71 3.235 -2.978 7.882 1.00 0.00 O ATOM 0 H SER A 71 3.161 -2.229 6.008 1.00 0.00 H new ATOM 0 HA SER A 71 5.409 -3.958 6.019 1.00 0.00 H new ATOM 0 HB2 SER A 71 2.950 -4.936 7.306 1.00 0.00 H new ATOM 0 HB3 SER A 71 4.516 -4.587 8.009 1.00 0.00 H new ATOM 0 HG SER A 71 2.274 -2.920 7.701 1.00 0.00 H new ATOM 928 N LEU A 72 2.733 -4.982 4.425 1.00 0.00 N ATOM 929 CA LEU A 72 2.241 -5.986 3.494 1.00 0.00 C ATOM 930 C LEU A 72 2.996 -5.915 2.170 1.00 0.00 C ATOM 931 O LEU A 72 3.045 -6.892 1.419 1.00 0.00 O ATOM 932 CB LEU A 72 0.742 -5.819 3.254 1.00 0.00 C ATOM 933 CG LEU A 72 -0.095 -7.060 3.559 1.00 0.00 C ATOM 934 CD1 LEU A 72 0.277 -7.633 4.917 1.00 0.00 C ATOM 935 CD2 LEU A 72 -1.579 -6.732 3.502 1.00 0.00 C ATOM 0 H LEU A 72 2.099 -4.197 4.573 1.00 0.00 H new ATOM 0 HA LEU A 72 2.413 -6.966 3.940 1.00 0.00 H new ATOM 0 HB2 LEU A 72 0.379 -4.993 3.866 1.00 0.00 H new ATOM 0 HB3 LEU A 72 0.584 -5.537 2.213 1.00 0.00 H new ATOM 0 HG LEU A 72 0.117 -7.813 2.800 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -0.329 -8.516 5.118 1.00 0.00 H new ATOM 0 HD12 LEU A 72 1.332 -7.908 4.919 1.00 0.00 H new ATOM 0 HD13 LEU A 72 0.096 -6.886 5.689 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -2.159 -7.629 3.722 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -1.810 -5.961 4.237 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -1.834 -6.371 2.506 1.00 0.00 H new ATOM 947 N ILE A 73 3.598 -4.760 1.897 1.00 0.00 N ATOM 948 CA ILE A 73 4.415 -4.582 0.708 1.00 0.00 C ATOM 949 C ILE A 73 5.586 -5.565 0.730 1.00 0.00 C ATOM 950 O ILE A 73 5.919 -6.168 -0.287 1.00 0.00 O ATOM 951 CB ILE A 73 4.916 -3.116 0.584 1.00 0.00 C ATOM 952 CG1 ILE A 73 4.051 -2.357 -0.427 1.00 0.00 C ATOM 953 CG2 ILE A 73 6.385 -3.039 0.176 1.00 0.00 C ATOM 954 CD1 ILE A 73 3.231 -1.240 0.178 1.00 0.00 C ATOM 0 H ILE A 73 3.532 -3.932 2.489 1.00 0.00 H new ATOM 0 HA ILE A 73 3.802 -4.789 -0.169 1.00 0.00 H new ATOM 0 HB ILE A 73 4.829 -2.655 1.568 1.00 0.00 H new ATOM 0 HG12 ILE A 73 4.696 -1.942 -1.201 1.00 0.00 H new ATOM 0 HG13 ILE A 73 3.379 -3.062 -0.916 1.00 0.00 H new ATOM 0 HG21 ILE A 73 6.688 -1.995 0.103 1.00 0.00 H new ATOM 0 HG22 ILE A 73 6.997 -3.543 0.924 1.00 0.00 H new ATOM 0 HG23 ILE A 73 6.520 -3.525 -0.790 1.00 0.00 H new ATOM 0 HD11 ILE A 73 2.647 -0.753 -0.603 1.00 0.00 H new ATOM 0 HD12 ILE A 73 2.558 -1.649 0.932 1.00 0.00 H new ATOM 0 HD13 ILE A 73 3.895 -0.511 0.642 1.00 0.00 H new ATOM 966 N ASP A 74 6.175 -5.754 1.912 1.00 0.00 N ATOM 967 CA ASP A 74 7.284 -6.694 2.072 1.00 0.00 C ATOM 968 C ASP A 74 6.765 -8.093 2.384 1.00 0.00 C ATOM 969 O ASP A 74 7.536 -9.031 2.587 1.00 0.00 O ATOM 970 CB ASP A 74 8.223 -6.228 3.185 1.00 0.00 C ATOM 971 CG ASP A 74 9.581 -6.905 3.118 1.00 0.00 C ATOM 972 OD1 ASP A 74 10.090 -7.118 2.000 1.00 0.00 O ATOM 973 OD2 ASP A 74 10.150 -7.229 4.187 1.00 0.00 O ATOM 0 H ASP A 74 5.904 -5.271 2.768 1.00 0.00 H new ATOM 0 HA ASP A 74 7.837 -6.728 1.133 1.00 0.00 H new ATOM 0 HB2 ASP A 74 8.355 -5.148 3.117 1.00 0.00 H new ATOM 0 HB3 ASP A 74 7.765 -6.433 4.153 1.00 0.00 H new ATOM 978 N GLN A 75 5.449 -8.227 2.411 1.00 0.00 N ATOM 979 CA GLN A 75 4.819 -9.492 2.740 1.00 0.00 C ATOM 980 C GLN A 75 4.496 -10.285 1.483 1.00 0.00 C ATOM 981 O GLN A 75 4.888 -11.443 1.359 1.00 0.00 O ATOM 982 CB GLN A 75 3.540 -9.255 3.546 1.00 0.00 C ATOM 983 CG GLN A 75 3.390 -10.178 4.742 1.00 0.00 C ATOM 984 CD GLN A 75 4.366 -9.853 5.856 1.00 0.00 C ATOM 985 OE1 GLN A 75 4.604 -10.669 6.744 1.00 0.00 O ATOM 986 NE2 GLN A 75 4.929 -8.655 5.827 1.00 0.00 N ATOM 0 H GLN A 75 4.795 -7.471 2.208 1.00 0.00 H new ATOM 0 HA GLN A 75 5.521 -10.070 3.342 1.00 0.00 H new ATOM 0 HB2 GLN A 75 3.526 -8.222 3.892 1.00 0.00 H new ATOM 0 HB3 GLN A 75 2.679 -9.383 2.890 1.00 0.00 H new ATOM 0 HG2 GLN A 75 2.372 -10.108 5.124 1.00 0.00 H new ATOM 0 HG3 GLN A 75 3.540 -11.209 4.422 1.00 0.00 H new ATOM 0 HE21 GLN A 75 4.706 -8.005 5.073 1.00 0.00 H new ATOM 0 HE22 GLN A 75 5.586 -8.382 6.558 1.00 0.00 H new ATOM 995 N LEU A 76 3.781 -9.664 0.555 1.00 0.00 N ATOM 996 CA LEU A 76 3.314 -10.375 -0.628 1.00 0.00 C ATOM 997 C LEU A 76 3.827 -9.749 -1.921 1.00 0.00 C ATOM 998 O LEU A 76 3.780 -10.378 -2.977 1.00 0.00 O ATOM 999 CB LEU A 76 1.783 -10.416 -0.643 1.00 0.00 C ATOM 1000 CG LEU A 76 1.141 -11.575 0.131 1.00 0.00 C ATOM 1001 CD1 LEU A 76 1.959 -12.847 -0.010 1.00 0.00 C ATOM 1002 CD2 LEU A 76 0.973 -11.208 1.597 1.00 0.00 C ATOM 0 H LEU A 76 3.514 -8.681 0.596 1.00 0.00 H new ATOM 0 HA LEU A 76 3.712 -11.388 -0.575 1.00 0.00 H new ATOM 0 HB2 LEU A 76 1.409 -9.478 -0.233 1.00 0.00 H new ATOM 0 HB3 LEU A 76 1.449 -10.466 -1.679 1.00 0.00 H new ATOM 0 HG LEU A 76 0.155 -11.760 -0.296 1.00 0.00 H new ATOM 0 HD11 LEU A 76 1.480 -13.651 0.549 1.00 0.00 H new ATOM 0 HD12 LEU A 76 2.022 -13.124 -1.062 1.00 0.00 H new ATOM 0 HD13 LEU A 76 2.962 -12.680 0.382 1.00 0.00 H new ATOM 0 HD21 LEU A 76 0.516 -12.041 2.131 1.00 0.00 H new ATOM 0 HD22 LEU A 76 1.949 -10.990 2.032 1.00 0.00 H new ATOM 0 HD23 LEU A 76 0.334 -10.329 1.681 1.00 0.00 H new ATOM 1014 N GLY A 77 4.317 -8.516 -1.840 1.00 0.00 N ATOM 1015 CA GLY A 77 4.807 -7.841 -3.031 1.00 0.00 C ATOM 1016 C GLY A 77 3.684 -7.495 -3.994 1.00 0.00 C ATOM 1017 O GLY A 77 3.765 -7.772 -5.193 1.00 0.00 O ATOM 0 H GLY A 77 4.384 -7.974 -0.978 1.00 0.00 H new ATOM 0 HA2 GLY A 77 5.330 -6.929 -2.741 1.00 0.00 H new ATOM 0 HA3 GLY A 77 5.533 -8.478 -3.536 1.00 0.00 H new ATOM 1021 N LEU A 78 2.634 -6.886 -3.463 1.00 0.00 N ATOM 1022 CA LEU A 78 1.447 -6.565 -4.243 1.00 0.00 C ATOM 1023 C LEU A 78 1.681 -5.347 -5.131 1.00 0.00 C ATOM 1024 O LEU A 78 1.564 -4.208 -4.684 1.00 0.00 O ATOM 1025 CB LEU A 78 0.261 -6.307 -3.315 1.00 0.00 C ATOM 1026 CG LEU A 78 0.188 -7.212 -2.084 1.00 0.00 C ATOM 1027 CD1 LEU A 78 0.719 -6.482 -0.856 1.00 0.00 C ATOM 1028 CD2 LEU A 78 -1.243 -7.668 -1.855 1.00 0.00 C ATOM 0 H LEU A 78 2.580 -6.602 -2.485 1.00 0.00 H new ATOM 0 HA LEU A 78 1.227 -7.419 -4.884 1.00 0.00 H new ATOM 0 HB2 LEU A 78 0.300 -5.270 -2.982 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -0.659 -6.424 -3.887 1.00 0.00 H new ATOM 0 HG LEU A 78 0.810 -8.090 -2.257 1.00 0.00 H new ATOM 0 HD11 LEU A 78 0.660 -7.139 0.012 1.00 0.00 H new ATOM 0 HD12 LEU A 78 1.757 -6.195 -1.024 1.00 0.00 H new ATOM 0 HD13 LEU A 78 0.120 -5.589 -0.676 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -1.284 -8.312 -0.976 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -1.881 -6.798 -1.698 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -1.592 -8.221 -2.727 1.00 0.00 H new ATOM 1040 N LEU A 79 1.985 -5.598 -6.397 1.00 0.00 N ATOM 1041 CA LEU A 79 2.220 -4.526 -7.366 1.00 0.00 C ATOM 1042 C LEU A 79 0.905 -3.895 -7.831 1.00 0.00 C ATOM 1043 O LEU A 79 0.900 -3.018 -8.691 1.00 0.00 O ATOM 1044 CB LEU A 79 2.993 -5.056 -8.583 1.00 0.00 C ATOM 1045 CG LEU A 79 3.596 -6.451 -8.419 1.00 0.00 C ATOM 1046 CD1 LEU A 79 2.702 -7.492 -9.075 1.00 0.00 C ATOM 1047 CD2 LEU A 79 5.002 -6.502 -9.004 1.00 0.00 C ATOM 0 H LEU A 79 2.076 -6.538 -6.782 1.00 0.00 H new ATOM 0 HA LEU A 79 2.814 -3.761 -6.866 1.00 0.00 H new ATOM 0 HB2 LEU A 79 2.322 -5.067 -9.442 1.00 0.00 H new ATOM 0 HB3 LEU A 79 3.796 -4.356 -8.815 1.00 0.00 H new ATOM 0 HG LEU A 79 3.665 -6.676 -7.355 1.00 0.00 H new ATOM 0 HD11 LEU A 79 3.143 -8.481 -8.951 1.00 0.00 H new ATOM 0 HD12 LEU A 79 1.717 -7.473 -8.608 1.00 0.00 H new ATOM 0 HD13 LEU A 79 2.604 -7.270 -10.138 1.00 0.00 H new ATOM 0 HD21 LEU A 79 5.413 -7.504 -8.877 1.00 0.00 H new ATOM 0 HD22 LEU A 79 4.963 -6.258 -10.066 1.00 0.00 H new ATOM 0 HD23 LEU A 79 5.637 -5.781 -8.489 1.00 0.00 H new ATOM 1059 N ALA A 80 -0.206 -4.338 -7.251 1.00 0.00 N ATOM 1060 CA ALA A 80 -1.523 -3.847 -7.642 1.00 0.00 C ATOM 1061 C ALA A 80 -1.723 -2.386 -7.244 1.00 0.00 C ATOM 1062 O ALA A 80 -2.268 -1.596 -8.013 1.00 0.00 O ATOM 1063 CB ALA A 80 -2.614 -4.712 -7.027 1.00 0.00 C ATOM 0 H ALA A 80 -0.221 -5.037 -6.508 1.00 0.00 H new ATOM 0 HA ALA A 80 -1.587 -3.907 -8.728 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -3.591 -4.334 -7.327 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -2.501 -5.740 -7.372 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -2.532 -4.683 -5.940 1.00 0.00 H new ATOM 1069 N LEU A 81 -1.270 -2.024 -6.053 1.00 0.00 N ATOM 1070 CA LEU A 81 -1.519 -0.690 -5.519 1.00 0.00 C ATOM 1071 C LEU A 81 -0.224 0.087 -5.314 1.00 0.00 C ATOM 1072 O LEU A 81 -0.239 1.203 -4.796 1.00 0.00 O ATOM 1073 CB LEU A 81 -2.277 -0.775 -4.195 1.00 0.00 C ATOM 1074 CG LEU A 81 -2.493 -2.187 -3.660 1.00 0.00 C ATOM 1075 CD1 LEU A 81 -1.723 -2.386 -2.364 1.00 0.00 C ATOM 1076 CD2 LEU A 81 -3.974 -2.442 -3.461 1.00 0.00 C ATOM 0 H LEU A 81 -0.729 -2.632 -5.438 1.00 0.00 H new ATOM 0 HA LEU A 81 -2.125 -0.158 -6.252 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -1.734 -0.199 -3.446 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -3.249 -0.298 -4.320 1.00 0.00 H new ATOM 0 HG LEU A 81 -2.115 -2.906 -4.387 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -1.887 -3.398 -1.995 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -0.659 -2.234 -2.546 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -2.070 -1.668 -1.621 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -4.121 -3.452 -3.079 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -4.374 -1.722 -2.747 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -4.493 -2.335 -4.414 1.00 0.00 H new ATOM 1088 N VAL A 82 0.891 -0.497 -5.710 1.00 0.00 N ATOM 1089 CA VAL A 82 2.173 0.172 -5.558 1.00 0.00 C ATOM 1090 C VAL A 82 2.732 0.554 -6.917 1.00 0.00 C ATOM 1091 O VAL A 82 2.701 -0.240 -7.855 1.00 0.00 O ATOM 1092 CB VAL A 82 3.201 -0.711 -4.818 1.00 0.00 C ATOM 1093 CG1 VAL A 82 4.435 0.095 -4.439 1.00 0.00 C ATOM 1094 CG2 VAL A 82 2.578 -1.348 -3.588 1.00 0.00 C ATOM 0 H VAL A 82 0.938 -1.423 -6.135 1.00 0.00 H new ATOM 0 HA VAL A 82 1.998 1.067 -4.961 1.00 0.00 H new ATOM 0 HB VAL A 82 3.511 -1.507 -5.495 1.00 0.00 H new ATOM 0 HG11 VAL A 82 5.144 -0.549 -3.919 1.00 0.00 H new ATOM 0 HG12 VAL A 82 4.900 0.494 -5.341 1.00 0.00 H new ATOM 0 HG13 VAL A 82 4.145 0.918 -3.786 1.00 0.00 H new ATOM 0 HG21 VAL A 82 3.320 -1.966 -3.082 1.00 0.00 H new ATOM 0 HG22 VAL A 82 2.232 -0.568 -2.910 1.00 0.00 H new ATOM 0 HG23 VAL A 82 1.733 -1.968 -3.888 1.00 0.00 H new ATOM 1104 N ASP A 83 3.260 1.759 -7.012 1.00 0.00 N ATOM 1105 CA ASP A 83 3.833 2.245 -8.256 1.00 0.00 C ATOM 1106 C ASP A 83 5.306 2.563 -8.049 1.00 0.00 C ATOM 1107 O ASP A 83 5.784 2.613 -6.913 1.00 0.00 O ATOM 1108 CB ASP A 83 3.080 3.487 -8.752 1.00 0.00 C ATOM 1109 CG ASP A 83 3.094 3.621 -10.265 1.00 0.00 C ATOM 1110 OD1 ASP A 83 4.121 3.288 -10.894 1.00 0.00 O ATOM 1111 OD2 ASP A 83 2.072 4.064 -10.832 1.00 0.00 O ATOM 0 H ASP A 83 3.305 2.424 -6.239 1.00 0.00 H new ATOM 0 HA ASP A 83 3.738 1.469 -9.015 1.00 0.00 H new ATOM 0 HB2 ASP A 83 2.047 3.442 -8.406 1.00 0.00 H new ATOM 0 HB3 ASP A 83 3.526 4.377 -8.309 1.00 0.00 H new ATOM 1116 N HIS A 84 6.020 2.784 -9.135 1.00 0.00 N ATOM 1117 CA HIS A 84 7.441 3.046 -9.059 1.00 0.00 C ATOM 1118 C HIS A 84 7.812 4.282 -9.848 1.00 0.00 C ATOM 1119 O HIS A 84 7.958 4.233 -11.067 1.00 0.00 O ATOM 1120 CB HIS A 84 8.246 1.856 -9.568 1.00 0.00 C ATOM 1121 CG HIS A 84 9.549 1.685 -8.858 1.00 0.00 C ATOM 1122 ND1 HIS A 84 10.490 2.689 -8.759 1.00 0.00 N ATOM 1123 CD2 HIS A 84 10.048 0.635 -8.173 1.00 0.00 C ATOM 1124 CE1 HIS A 84 11.513 2.257 -8.051 1.00 0.00 C ATOM 1125 NE2 HIS A 84 11.270 1.017 -7.680 1.00 0.00 N ATOM 0 H HIS A 84 5.638 2.787 -10.081 1.00 0.00 H new ATOM 0 HA HIS A 84 7.682 3.213 -8.009 1.00 0.00 H new ATOM 0 HB2 HIS A 84 7.654 0.948 -9.453 1.00 0.00 H new ATOM 0 HB3 HIS A 84 8.433 1.981 -10.634 1.00 0.00 H new ATOM 0 HD1 HIS A 84 10.407 3.619 -9.169 1.00 0.00 H new ATOM 0 HD2 HIS A 84 9.574 -0.326 -8.038 1.00 0.00 H new ATOM 0 HE1 HIS A 84 12.401 2.824 -7.815 1.00 0.00 H new ATOM 1134 N THR A 85 7.960 5.385 -9.151 1.00 0.00 N ATOM 1135 CA THR A 85 8.444 6.602 -9.760 1.00 0.00 C ATOM 1136 C THR A 85 9.939 6.730 -9.509 1.00 0.00 C ATOM 1137 O THR A 85 10.582 5.781 -9.042 1.00 0.00 O ATOM 1138 CB THR A 85 7.719 7.835 -9.194 1.00 0.00 C ATOM 1139 OG1 THR A 85 7.825 7.846 -7.763 1.00 0.00 O ATOM 1140 CG2 THR A 85 6.253 7.834 -9.598 1.00 0.00 C ATOM 0 H THR A 85 7.751 5.464 -8.156 1.00 0.00 H new ATOM 0 HA THR A 85 8.246 6.554 -10.831 1.00 0.00 H new ATOM 0 HB THR A 85 8.190 8.729 -9.603 1.00 0.00 H new ATOM 0 HG1 THR A 85 7.392 8.651 -7.409 1.00 0.00 H new ATOM 0 HG21 THR A 85 5.761 8.715 -9.186 1.00 0.00 H new ATOM 0 HG22 THR A 85 6.175 7.850 -10.685 1.00 0.00 H new ATOM 0 HG23 THR A 85 5.770 6.936 -9.213 1.00 0.00 H new ATOM 1148 N GLU A 86 10.493 7.893 -9.807 1.00 0.00 N ATOM 1149 CA GLU A 86 11.891 8.165 -9.522 1.00 0.00 C ATOM 1150 C GLU A 86 12.058 8.576 -8.060 1.00 0.00 C ATOM 1151 O GLU A 86 13.131 9.011 -7.635 1.00 0.00 O ATOM 1152 CB GLU A 86 12.408 9.261 -10.449 1.00 0.00 C ATOM 1153 CG GLU A 86 11.813 9.195 -11.845 1.00 0.00 C ATOM 1154 CD GLU A 86 12.833 9.465 -12.924 1.00 0.00 C ATOM 1155 OE1 GLU A 86 13.293 10.620 -13.030 1.00 0.00 O ATOM 1156 OE2 GLU A 86 13.172 8.528 -13.676 1.00 0.00 O ATOM 0 H GLU A 86 9.994 8.666 -10.248 1.00 0.00 H new ATOM 0 HA GLU A 86 12.473 7.260 -9.695 1.00 0.00 H new ATOM 0 HB2 GLU A 86 12.184 10.234 -10.011 1.00 0.00 H new ATOM 0 HB3 GLU A 86 13.493 9.186 -10.520 1.00 0.00 H new ATOM 0 HG2 GLU A 86 11.375 8.210 -12.003 1.00 0.00 H new ATOM 0 HG3 GLU A 86 11.004 9.921 -11.926 1.00 0.00 H new ATOM 1163 N GLU A 87 10.974 8.446 -7.300 1.00 0.00 N ATOM 1164 CA GLU A 87 10.986 8.732 -5.874 1.00 0.00 C ATOM 1165 C GLU A 87 10.978 7.420 -5.086 1.00 0.00 C ATOM 1166 O GLU A 87 10.899 7.419 -3.856 1.00 0.00 O ATOM 1167 CB GLU A 87 9.768 9.584 -5.500 1.00 0.00 C ATOM 1168 CG GLU A 87 9.651 10.880 -6.295 1.00 0.00 C ATOM 1169 CD GLU A 87 8.367 10.973 -7.100 1.00 0.00 C ATOM 1170 OE1 GLU A 87 7.394 10.260 -6.772 1.00 0.00 O ATOM 1171 OE2 GLU A 87 8.327 11.758 -8.069 1.00 0.00 O ATOM 0 H GLU A 87 10.068 8.141 -7.656 1.00 0.00 H new ATOM 0 HA GLU A 87 11.890 9.289 -5.626 1.00 0.00 H new ATOM 0 HB2 GLU A 87 8.864 8.994 -5.651 1.00 0.00 H new ATOM 0 HB3 GLU A 87 9.818 9.824 -4.438 1.00 0.00 H new ATOM 0 HG2 GLU A 87 9.705 11.726 -5.609 1.00 0.00 H new ATOM 0 HG3 GLU A 87 10.503 10.963 -6.970 1.00 0.00 H new ATOM 1178 N GLY A 88 11.052 6.306 -5.815 1.00 0.00 N ATOM 1179 CA GLY A 88 11.063 4.998 -5.187 1.00 0.00 C ATOM 1180 C GLY A 88 9.701 4.336 -5.223 1.00 0.00 C ATOM 1181 O GLY A 88 8.854 4.703 -6.040 1.00 0.00 O ATOM 0 H GLY A 88 11.105 6.289 -6.834 1.00 0.00 H new ATOM 0 HA2 GLY A 88 11.789 4.360 -5.692 1.00 0.00 H new ATOM 0 HA3 GLY A 88 11.390 5.096 -4.152 1.00 0.00 H new ATOM 1185 N PRO A 89 9.469 3.329 -4.368 1.00 0.00 N ATOM 1186 CA PRO A 89 8.153 2.699 -4.219 1.00 0.00 C ATOM 1187 C PRO A 89 7.132 3.680 -3.656 1.00 0.00 C ATOM 1188 O PRO A 89 7.279 4.168 -2.530 1.00 0.00 O ATOM 1189 CB PRO A 89 8.401 1.556 -3.226 1.00 0.00 C ATOM 1190 CG PRO A 89 9.879 1.359 -3.222 1.00 0.00 C ATOM 1191 CD PRO A 89 10.472 2.710 -3.491 1.00 0.00 C ATOM 0 HA PRO A 89 7.748 2.357 -5.172 1.00 0.00 H new ATOM 0 HB2 PRO A 89 8.035 1.811 -2.232 1.00 0.00 H new ATOM 0 HB3 PRO A 89 7.883 0.647 -3.533 1.00 0.00 H new ATOM 0 HG2 PRO A 89 10.219 0.967 -2.263 1.00 0.00 H new ATOM 0 HG3 PRO A 89 10.180 0.641 -3.985 1.00 0.00 H new ATOM 0 HD2 PRO A 89 10.616 3.280 -2.573 1.00 0.00 H new ATOM 0 HD3 PRO A 89 11.445 2.637 -3.976 1.00 0.00 H new ATOM 1199 N VAL A 90 6.108 3.976 -4.438 1.00 0.00 N ATOM 1200 CA VAL A 90 5.155 5.015 -4.080 1.00 0.00 C ATOM 1201 C VAL A 90 3.718 4.558 -4.290 1.00 0.00 C ATOM 1202 O VAL A 90 3.467 3.445 -4.752 1.00 0.00 O ATOM 1203 CB VAL A 90 5.400 6.295 -4.905 1.00 0.00 C ATOM 1204 CG1 VAL A 90 6.555 7.097 -4.325 1.00 0.00 C ATOM 1205 CG2 VAL A 90 5.667 5.950 -6.365 1.00 0.00 C ATOM 0 H VAL A 90 5.914 3.512 -5.325 1.00 0.00 H new ATOM 0 HA VAL A 90 5.305 5.228 -3.021 1.00 0.00 H new ATOM 0 HB VAL A 90 4.500 6.909 -4.856 1.00 0.00 H new ATOM 0 HG11 VAL A 90 6.710 7.995 -4.922 1.00 0.00 H new ATOM 0 HG12 VAL A 90 6.322 7.380 -3.298 1.00 0.00 H new ATOM 0 HG13 VAL A 90 7.461 6.491 -4.338 1.00 0.00 H new ATOM 0 HG21 VAL A 90 5.837 6.866 -6.930 1.00 0.00 H new ATOM 0 HG22 VAL A 90 6.549 5.313 -6.433 1.00 0.00 H new ATOM 0 HG23 VAL A 90 4.806 5.424 -6.778 1.00 0.00 H new ATOM 1215 N CYS A 91 2.781 5.430 -3.944 1.00 0.00 N ATOM 1216 CA CYS A 91 1.367 5.150 -4.130 1.00 0.00 C ATOM 1217 C CYS A 91 1.020 5.123 -5.612 1.00 0.00 C ATOM 1218 O CYS A 91 1.390 6.031 -6.359 1.00 0.00 O ATOM 1219 CB CYS A 91 0.515 6.202 -3.417 1.00 0.00 C ATOM 1220 SG CYS A 91 -0.643 5.504 -2.203 1.00 0.00 S ATOM 0 H CYS A 91 2.978 6.342 -3.531 1.00 0.00 H new ATOM 0 HA CYS A 91 1.154 4.172 -3.699 1.00 0.00 H new ATOM 0 HB2 CYS A 91 1.174 6.909 -2.913 1.00 0.00 H new ATOM 0 HB3 CYS A 91 -0.048 6.766 -4.161 1.00 0.00 H new ATOM 1225 N LYS A 92 0.322 4.077 -6.032 1.00 0.00 N ATOM 1226 CA LYS A 92 -0.071 3.932 -7.423 1.00 0.00 C ATOM 1227 C LYS A 92 -1.330 4.733 -7.717 1.00 0.00 C ATOM 1228 O LYS A 92 -1.506 5.249 -8.822 1.00 0.00 O ATOM 1229 CB LYS A 92 -0.314 2.462 -7.754 1.00 0.00 C ATOM 1230 CG LYS A 92 -0.310 2.161 -9.241 1.00 0.00 C ATOM 1231 CD LYS A 92 0.188 0.756 -9.512 1.00 0.00 C ATOM 1232 CE LYS A 92 -0.400 0.189 -10.792 1.00 0.00 C ATOM 1233 NZ LYS A 92 -1.499 -0.767 -10.509 1.00 0.00 N ATOM 0 H LYS A 92 0.017 3.316 -5.426 1.00 0.00 H new ATOM 0 HA LYS A 92 0.740 4.313 -8.043 1.00 0.00 H new ATOM 0 HB2 LYS A 92 0.453 1.858 -7.268 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -1.273 2.158 -7.334 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -1.317 2.277 -9.641 1.00 0.00 H new ATOM 0 HG3 LYS A 92 0.323 2.881 -9.759 1.00 0.00 H new ATOM 0 HD2 LYS A 92 1.276 0.763 -9.583 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -0.073 0.109 -8.674 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -0.775 1.003 -11.413 1.00 0.00 H new ATOM 0 HE3 LYS A 92 0.382 -0.313 -11.362 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -1.321 -1.659 -11.012 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -1.545 -0.950 -9.486 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -2.402 -0.363 -10.830 1.00 0.00 H new ATOM 1247 N ASN A 93 -2.205 4.839 -6.727 1.00 0.00 N ATOM 1248 CA ASN A 93 -3.496 5.485 -6.933 1.00 0.00 C ATOM 1249 C ASN A 93 -3.913 6.314 -5.723 1.00 0.00 C ATOM 1250 O ASN A 93 -3.517 7.471 -5.588 1.00 0.00 O ATOM 1251 CB ASN A 93 -4.572 4.443 -7.257 1.00 0.00 C ATOM 1252 CG ASN A 93 -5.003 4.473 -8.712 1.00 0.00 C ATOM 1253 OD1 ASN A 93 -6.069 4.989 -9.052 1.00 0.00 O ATOM 1254 ND2 ASN A 93 -4.176 3.915 -9.583 1.00 0.00 N ATOM 0 H ASN A 93 -2.048 4.490 -5.781 1.00 0.00 H new ATOM 0 HA ASN A 93 -3.390 6.163 -7.780 1.00 0.00 H new ATOM 0 HB2 ASN A 93 -4.193 3.450 -7.016 1.00 0.00 H new ATOM 0 HB3 ASN A 93 -5.441 4.616 -6.622 1.00 0.00 H new ATOM 0 HD21 ASN A 93 -4.413 3.902 -10.575 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -3.302 3.498 -9.262 1.00 0.00 H new ATOM 1261 N ILE A 94 -4.700 5.717 -4.838 1.00 0.00 N ATOM 1262 CA ILE A 94 -5.286 6.455 -3.729 1.00 0.00 C ATOM 1263 C ILE A 94 -4.611 6.096 -2.409 1.00 0.00 C ATOM 1264 O ILE A 94 -4.149 4.967 -2.217 1.00 0.00 O ATOM 1265 CB ILE A 94 -6.823 6.224 -3.646 1.00 0.00 C ATOM 1266 CG1 ILE A 94 -7.164 5.062 -2.717 1.00 0.00 C ATOM 1267 CG2 ILE A 94 -7.400 5.950 -5.030 1.00 0.00 C ATOM 1268 CD1 ILE A 94 -8.650 4.776 -2.615 1.00 0.00 C ATOM 0 H ILE A 94 -4.946 4.728 -4.867 1.00 0.00 H new ATOM 0 HA ILE A 94 -5.117 7.515 -3.915 1.00 0.00 H new ATOM 0 HB ILE A 94 -7.266 7.134 -3.241 1.00 0.00 H new ATOM 0 HG12 ILE A 94 -6.654 4.165 -3.070 1.00 0.00 H new ATOM 0 HG13 ILE A 94 -6.776 5.279 -1.722 1.00 0.00 H new ATOM 0 HG21 ILE A 94 -8.475 5.791 -4.951 1.00 0.00 H new ATOM 0 HG22 ILE A 94 -7.206 6.803 -5.680 1.00 0.00 H new ATOM 0 HG23 ILE A 94 -6.932 5.060 -5.450 1.00 0.00 H new ATOM 0 HD11 ILE A 94 -8.814 3.938 -1.938 1.00 0.00 H new ATOM 0 HD12 ILE A 94 -9.165 5.657 -2.233 1.00 0.00 H new ATOM 0 HD13 ILE A 94 -9.041 4.527 -3.601 1.00 0.00 H new ATOM 1280 N VAL A 95 -4.541 7.069 -1.510 1.00 0.00 N ATOM 1281 CA VAL A 95 -3.911 6.882 -0.211 1.00 0.00 C ATOM 1282 C VAL A 95 -4.970 6.655 0.868 1.00 0.00 C ATOM 1283 O VAL A 95 -6.027 7.298 0.866 1.00 0.00 O ATOM 1284 CB VAL A 95 -3.015 8.093 0.155 1.00 0.00 C ATOM 1285 CG1 VAL A 95 -3.779 9.404 0.018 1.00 0.00 C ATOM 1286 CG2 VAL A 95 -2.431 7.944 1.555 1.00 0.00 C ATOM 0 H VAL A 95 -4.917 8.005 -1.660 1.00 0.00 H new ATOM 0 HA VAL A 95 -3.275 5.998 -0.269 1.00 0.00 H new ATOM 0 HB VAL A 95 -2.185 8.115 -0.551 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -3.125 10.235 0.281 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -4.119 9.521 -1.011 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -4.641 9.395 0.686 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -1.807 8.808 1.783 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -3.241 7.879 2.282 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -1.827 7.038 1.603 1.00 0.00 H new ATOM 1296 N ALA A 96 -4.693 5.734 1.781 1.00 0.00 N ATOM 1297 CA ALA A 96 -5.655 5.359 2.801 1.00 0.00 C ATOM 1298 C ALA A 96 -4.971 4.992 4.113 1.00 0.00 C ATOM 1299 O ALA A 96 -3.779 4.681 4.142 1.00 0.00 O ATOM 1300 CB ALA A 96 -6.499 4.193 2.305 1.00 0.00 C ATOM 0 H ALA A 96 -3.806 5.233 1.834 1.00 0.00 H new ATOM 0 HA ALA A 96 -6.296 6.219 2.994 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -7.220 3.913 3.073 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -7.029 4.487 1.399 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -5.853 3.343 2.088 1.00 0.00 H new ATOM 1306 N CYS A 97 -5.738 5.024 5.194 1.00 0.00 N ATOM 1307 CA CYS A 97 -5.254 4.588 6.492 1.00 0.00 C ATOM 1308 C CYS A 97 -5.856 3.229 6.807 1.00 0.00 C ATOM 1309 O CYS A 97 -7.051 3.109 7.092 1.00 0.00 O ATOM 1310 CB CYS A 97 -5.592 5.602 7.590 1.00 0.00 C ATOM 1311 SG CYS A 97 -4.239 6.771 7.962 1.00 0.00 S ATOM 0 H CYS A 97 -6.704 5.350 5.195 1.00 0.00 H new ATOM 0 HA CYS A 97 -4.167 4.511 6.458 1.00 0.00 H new ATOM 0 HB2 CYS A 97 -6.474 6.167 7.290 1.00 0.00 H new ATOM 0 HB3 CYS A 97 -5.853 5.063 8.501 1.00 0.00 H new ATOM 1316 N CYS A 98 -5.022 2.210 6.742 1.00 0.00 N ATOM 1317 CA CYS A 98 -5.471 0.834 6.794 1.00 0.00 C ATOM 1318 C CYS A 98 -4.769 0.074 7.917 1.00 0.00 C ATOM 1319 O CYS A 98 -3.579 -0.211 7.829 1.00 0.00 O ATOM 1320 CB CYS A 98 -5.196 0.175 5.438 1.00 0.00 C ATOM 1321 SG CYS A 98 -6.078 -1.385 5.133 1.00 0.00 S ATOM 0 H CYS A 98 -4.011 2.314 6.651 1.00 0.00 H new ATOM 0 HA CYS A 98 -6.541 0.809 7.003 1.00 0.00 H new ATOM 0 HB2 CYS A 98 -5.459 0.881 4.650 1.00 0.00 H new ATOM 0 HB3 CYS A 98 -4.125 -0.011 5.354 1.00 0.00 H new ATOM 1326 N PRO A 99 -5.488 -0.254 8.996 1.00 0.00 N ATOM 1327 CA PRO A 99 -4.917 -0.979 10.137 1.00 0.00 C ATOM 1328 C PRO A 99 -4.575 -2.433 9.798 1.00 0.00 C ATOM 1329 O PRO A 99 -5.409 -3.173 9.267 1.00 0.00 O ATOM 1330 CB PRO A 99 -6.037 -0.922 11.182 1.00 0.00 C ATOM 1331 CG PRO A 99 -7.286 -0.783 10.387 1.00 0.00 C ATOM 1332 CD PRO A 99 -6.918 0.057 9.197 1.00 0.00 C ATOM 0 HA PRO A 99 -3.976 -0.540 10.470 1.00 0.00 H new ATOM 0 HB2 PRO A 99 -6.055 -1.824 11.793 1.00 0.00 H new ATOM 0 HB3 PRO A 99 -5.903 -0.080 11.861 1.00 0.00 H new ATOM 0 HG2 PRO A 99 -7.663 -1.757 10.077 1.00 0.00 H new ATOM 0 HG3 PRO A 99 -8.073 -0.308 10.973 1.00 0.00 H new ATOM 0 HD2 PRO A 99 -7.514 -0.202 8.321 1.00 0.00 H new ATOM 0 HD3 PRO A 99 -7.077 1.118 9.388 1.00 0.00 H new ATOM 1340 N GLU A 100 -3.337 -2.832 10.061 1.00 0.00 N ATOM 1341 CA GLU A 100 -2.933 -4.220 9.882 1.00 0.00 C ATOM 1342 C GLU A 100 -3.477 -5.065 11.030 1.00 0.00 C ATOM 1343 O GLU A 100 -2.975 -4.996 12.153 1.00 0.00 O ATOM 1344 CB GLU A 100 -1.403 -4.340 9.816 1.00 0.00 C ATOM 1345 CG GLU A 100 -0.906 -5.267 8.711 1.00 0.00 C ATOM 1346 CD GLU A 100 -0.191 -4.532 7.590 1.00 0.00 C ATOM 1347 OE1 GLU A 100 0.678 -3.689 7.886 1.00 0.00 O ATOM 1348 OE2 GLU A 100 -0.510 -4.796 6.413 1.00 0.00 O ATOM 0 H GLU A 100 -2.597 -2.216 10.398 1.00 0.00 H new ATOM 0 HA GLU A 100 -3.343 -4.583 8.940 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -0.976 -3.348 9.665 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -1.034 -4.703 10.775 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -0.230 -6.005 9.142 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -1.753 -5.814 8.296 1.00 0.00 H new ATOM 1355 N GLY A 101 -4.520 -5.834 10.756 1.00 0.00 N ATOM 1356 CA GLY A 101 -5.094 -6.681 11.779 1.00 0.00 C ATOM 1357 C GLY A 101 -6.474 -7.182 11.415 1.00 0.00 C ATOM 1358 O GLY A 101 -6.667 -8.374 11.199 1.00 0.00 O ATOM 0 H GLY A 101 -4.978 -5.886 9.846 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -4.436 -7.533 11.951 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -5.149 -6.126 12.716 1.00 0.00 H new ATOM 1362 N THR A 102 -7.444 -6.274 11.355 1.00 0.00 N ATOM 1363 CA THR A 102 -8.825 -6.651 11.062 1.00 0.00 C ATOM 1364 C THR A 102 -9.645 -5.447 10.606 1.00 0.00 C ATOM 1365 O THR A 102 -9.268 -4.303 10.864 1.00 0.00 O ATOM 1366 CB THR A 102 -9.516 -7.269 12.301 1.00 0.00 C ATOM 1367 OG1 THR A 102 -8.605 -7.311 13.411 1.00 0.00 O ATOM 1368 CG2 THR A 102 -10.024 -8.672 12.007 1.00 0.00 C ATOM 0 H THR A 102 -7.301 -5.275 11.505 1.00 0.00 H new ATOM 0 HA THR A 102 -8.781 -7.389 10.261 1.00 0.00 H new ATOM 0 HB THR A 102 -10.368 -6.638 12.554 1.00 0.00 H new ATOM 0 HG1 THR A 102 -9.055 -7.703 14.189 1.00 0.00 H new ATOM 0 HG21 THR A 102 -10.504 -9.079 12.897 1.00 0.00 H new ATOM 0 HG22 THR A 102 -10.745 -8.634 11.191 1.00 0.00 H new ATOM 0 HG23 THR A 102 -9.187 -9.310 11.723 1.00 0.00 H new ATOM 1376 N THR A 103 -10.755 -5.727 9.914 1.00 0.00 N ATOM 1377 CA THR A 103 -11.756 -4.717 9.558 1.00 0.00 C ATOM 1378 C THR A 103 -11.272 -3.767 8.457 1.00 0.00 C ATOM 1379 O THR A 103 -10.093 -3.744 8.096 1.00 0.00 O ATOM 1380 CB THR A 103 -12.226 -3.926 10.806 1.00 0.00 C ATOM 1381 OG1 THR A 103 -12.231 -4.800 11.948 1.00 0.00 O ATOM 1382 CG2 THR A 103 -13.629 -3.359 10.614 1.00 0.00 C ATOM 0 H THR A 103 -10.985 -6.665 9.584 1.00 0.00 H new ATOM 0 HA THR A 103 -12.611 -5.259 9.153 1.00 0.00 H new ATOM 0 HB THR A 103 -11.536 -3.096 10.958 1.00 0.00 H new ATOM 0 HG1 THR A 103 -12.526 -4.303 12.739 1.00 0.00 H new ATOM 0 HG21 THR A 103 -13.926 -2.811 11.508 1.00 0.00 H new ATOM 0 HG22 THR A 103 -13.635 -2.685 9.757 1.00 0.00 H new ATOM 0 HG23 THR A 103 -14.330 -4.175 10.439 1.00 0.00 H new ATOM 1390 N ASN A 104 -12.219 -3.013 7.907 1.00 0.00 N ATOM 1391 CA ASN A 104 -11.989 -2.176 6.738 1.00 0.00 C ATOM 1392 C ASN A 104 -11.186 -0.926 7.071 1.00 0.00 C ATOM 1393 O ASN A 104 -11.089 -0.517 8.228 1.00 0.00 O ATOM 1394 CB ASN A 104 -13.324 -1.774 6.092 1.00 0.00 C ATOM 1395 CG ASN A 104 -14.380 -1.319 7.093 1.00 0.00 C ATOM 1396 OD1 ASN A 104 -15.551 -1.679 6.974 1.00 0.00 O ATOM 1397 ND2 ASN A 104 -13.981 -0.523 8.075 1.00 0.00 N ATOM 0 H ASN A 104 -13.173 -2.967 8.264 1.00 0.00 H new ATOM 0 HA ASN A 104 -11.405 -2.770 6.035 1.00 0.00 H new ATOM 0 HB2 ASN A 104 -13.144 -0.971 5.378 1.00 0.00 H new ATOM 0 HB3 ASN A 104 -13.713 -2.621 5.527 1.00 0.00 H new ATOM 0 HD21 ASN A 104 -14.653 -0.188 8.765 1.00 0.00 H new ATOM 0 HD22 ASN A 104 -13.002 -0.246 8.141 1.00 0.00 H new ATOM 1404 N CYS A 105 -10.655 -0.308 6.034 1.00 0.00 N ATOM 1405 CA CYS A 105 -9.785 0.839 6.176 1.00 0.00 C ATOM 1406 C CYS A 105 -10.364 2.054 5.460 1.00 0.00 C ATOM 1407 O CYS A 105 -10.993 1.929 4.408 1.00 0.00 O ATOM 1408 CB CYS A 105 -8.423 0.484 5.605 1.00 0.00 C ATOM 1409 SG CYS A 105 -7.833 -1.166 6.117 1.00 0.00 S ATOM 0 H CYS A 105 -10.816 -0.590 5.067 1.00 0.00 H new ATOM 0 HA CYS A 105 -9.691 1.096 7.231 1.00 0.00 H new ATOM 0 HB2 CYS A 105 -8.472 0.523 4.517 1.00 0.00 H new ATOM 0 HB3 CYS A 105 -7.698 1.235 5.919 1.00 0.00 H new ATOM 1414 N VAL A 106 -10.153 3.227 6.038 1.00 0.00 N ATOM 1415 CA VAL A 106 -10.681 4.461 5.479 1.00 0.00 C ATOM 1416 C VAL A 106 -9.672 5.087 4.517 1.00 0.00 C ATOM 1417 O VAL A 106 -8.461 4.944 4.694 1.00 0.00 O ATOM 1418 CB VAL A 106 -11.058 5.473 6.598 1.00 0.00 C ATOM 1419 CG1 VAL A 106 -11.386 4.743 7.892 1.00 0.00 C ATOM 1420 CG2 VAL A 106 -9.954 6.495 6.838 1.00 0.00 C ATOM 0 H VAL A 106 -9.617 3.350 6.897 1.00 0.00 H new ATOM 0 HA VAL A 106 -11.589 4.215 4.928 1.00 0.00 H new ATOM 0 HB VAL A 106 -11.942 6.014 6.259 1.00 0.00 H new ATOM 0 HG11 VAL A 106 -11.647 5.468 8.663 1.00 0.00 H new ATOM 0 HG12 VAL A 106 -12.227 4.070 7.727 1.00 0.00 H new ATOM 0 HG13 VAL A 106 -10.519 4.167 8.215 1.00 0.00 H new ATOM 0 HG21 VAL A 106 -10.259 7.182 7.627 1.00 0.00 H new ATOM 0 HG22 VAL A 106 -9.041 5.981 7.138 1.00 0.00 H new ATOM 0 HG23 VAL A 106 -9.771 7.055 5.921 1.00 0.00 H new ATOM 1430 N ALA A 107 -10.173 5.767 3.498 1.00 0.00 N ATOM 1431 CA ALA A 107 -9.314 6.437 2.531 1.00 0.00 C ATOM 1432 C ALA A 107 -9.405 7.948 2.694 1.00 0.00 C ATOM 1433 O ALA A 107 -10.489 8.487 2.928 1.00 0.00 O ATOM 1434 CB ALA A 107 -9.696 6.032 1.112 1.00 0.00 C ATOM 0 H ALA A 107 -11.172 5.870 3.318 1.00 0.00 H new ATOM 0 HA ALA A 107 -8.284 6.132 2.714 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -9.045 6.541 0.401 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -9.584 4.954 0.999 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -10.732 6.312 0.920 1.00 0.00 H new ATOM 1440 N VAL A 108 -8.275 8.634 2.569 1.00 0.00 N ATOM 1441 CA VAL A 108 -8.250 10.082 2.743 1.00 0.00 C ATOM 1442 C VAL A 108 -8.227 10.795 1.396 1.00 0.00 C ATOM 1443 O VAL A 108 -8.234 12.025 1.318 1.00 0.00 O ATOM 1444 CB VAL A 108 -7.055 10.524 3.623 1.00 0.00 C ATOM 1445 CG1 VAL A 108 -5.808 10.767 2.790 1.00 0.00 C ATOM 1446 CG2 VAL A 108 -7.423 11.756 4.436 1.00 0.00 C ATOM 0 H VAL A 108 -7.371 8.216 2.350 1.00 0.00 H new ATOM 0 HA VAL A 108 -9.166 10.367 3.260 1.00 0.00 H new ATOM 0 HB VAL A 108 -6.826 9.712 4.314 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -4.990 11.076 3.441 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -5.532 9.849 2.271 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -6.006 11.551 2.059 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -6.573 12.054 5.049 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -7.688 12.571 3.762 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -8.272 11.527 5.080 1.00 0.00 H new ATOM 1456 N ASP A 109 -8.228 10.006 0.341 1.00 0.00 N ATOM 1457 CA ASP A 109 -8.275 10.533 -1.015 1.00 0.00 C ATOM 1458 C ASP A 109 -9.710 10.463 -1.534 1.00 0.00 C ATOM 1459 O ASP A 109 -10.547 9.773 -0.947 1.00 0.00 O ATOM 1460 CB ASP A 109 -7.322 9.749 -1.929 1.00 0.00 C ATOM 1461 CG ASP A 109 -7.686 9.878 -3.393 1.00 0.00 C ATOM 1462 OD1 ASP A 109 -7.483 10.969 -3.969 1.00 0.00 O ATOM 1463 OD2 ASP A 109 -8.214 8.910 -3.961 1.00 0.00 O ATOM 0 H ASP A 109 -8.197 8.988 0.394 1.00 0.00 H new ATOM 0 HA ASP A 109 -7.950 11.574 -1.011 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -6.303 10.106 -1.778 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -7.336 8.697 -1.646 1.00 0.00 H new ATOM 1468 N ASN A 110 -10.012 11.190 -2.606 1.00 0.00 N ATOM 1469 CA ASN A 110 -11.367 11.215 -3.140 1.00 0.00 C ATOM 1470 C ASN A 110 -11.408 10.967 -4.648 1.00 0.00 C ATOM 1471 O ASN A 110 -12.486 10.788 -5.213 1.00 0.00 O ATOM 1472 CB ASN A 110 -12.027 12.558 -2.820 1.00 0.00 C ATOM 1473 CG ASN A 110 -12.865 12.504 -1.558 1.00 0.00 C ATOM 1474 OD1 ASN A 110 -14.045 12.147 -1.595 1.00 0.00 O ATOM 1475 ND2 ASN A 110 -12.268 12.857 -0.429 1.00 0.00 N ATOM 0 H ASN A 110 -9.342 11.765 -3.117 1.00 0.00 H new ATOM 0 HA ASN A 110 -11.916 10.403 -2.663 1.00 0.00 H new ATOM 0 HB2 ASN A 110 -11.257 13.321 -2.709 1.00 0.00 H new ATOM 0 HB3 ASN A 110 -12.656 12.860 -3.658 1.00 0.00 H new ATOM 0 HD21 ASN A 110 -12.786 12.839 0.449 1.00 0.00 H new ATOM 0 HD22 ASN A 110 -11.290 13.147 -0.438 1.00 0.00 H new ATOM 1482 N ALA A 111 -10.253 10.931 -5.302 1.00 0.00 N ATOM 1483 CA ALA A 111 -10.239 10.826 -6.761 1.00 0.00 C ATOM 1484 C ALA A 111 -8.910 10.314 -7.315 1.00 0.00 C ATOM 1485 O ALA A 111 -8.581 10.569 -8.473 1.00 0.00 O ATOM 1486 CB ALA A 111 -10.577 12.175 -7.382 1.00 0.00 C ATOM 0 H ALA A 111 -9.334 10.972 -4.861 1.00 0.00 H new ATOM 0 HA ALA A 111 -10.995 10.088 -7.030 1.00 0.00 H new ATOM 0 HB1 ALA A 111 -10.565 12.089 -8.469 1.00 0.00 H new ATOM 0 HB2 ALA A 111 -11.568 12.488 -7.054 1.00 0.00 H new ATOM 0 HB3 ALA A 111 -9.840 12.915 -7.068 1.00 0.00 H new ATOM 1492 N GLY A 112 -8.158 9.585 -6.504 1.00 0.00 N ATOM 1493 CA GLY A 112 -6.892 9.040 -6.958 1.00 0.00 C ATOM 1494 C GLY A 112 -5.839 10.111 -7.163 1.00 0.00 C ATOM 1495 O GLY A 112 -4.994 10.000 -8.055 1.00 0.00 O ATOM 0 H GLY A 112 -8.400 9.360 -5.539 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -6.530 8.314 -6.230 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -7.046 8.503 -7.894 1.00 0.00 H new ATOM 1499 N ALA A 113 -5.882 11.148 -6.338 1.00 0.00 N ATOM 1500 CA ALA A 113 -4.941 12.250 -6.454 1.00 0.00 C ATOM 1501 C ALA A 113 -3.689 11.974 -5.635 1.00 0.00 C ATOM 1502 O ALA A 113 -3.422 12.640 -4.634 1.00 0.00 O ATOM 1503 CB ALA A 113 -5.593 13.558 -6.026 1.00 0.00 C ATOM 0 H ALA A 113 -6.559 11.248 -5.582 1.00 0.00 H new ATOM 0 HA ALA A 113 -4.647 12.344 -7.500 1.00 0.00 H new ATOM 0 HB1 ALA A 113 -4.873 14.371 -6.120 1.00 0.00 H new ATOM 0 HB2 ALA A 113 -6.454 13.761 -6.663 1.00 0.00 H new ATOM 0 HB3 ALA A 113 -5.919 13.480 -4.989 1.00 0.00 H new ATOM 1509 N GLY A 114 -2.929 10.978 -6.060 1.00 0.00 N ATOM 1510 CA GLY A 114 -1.707 10.634 -5.370 1.00 0.00 C ATOM 1511 C GLY A 114 -0.499 11.335 -5.953 1.00 0.00 C ATOM 1512 O GLY A 114 0.432 10.684 -6.431 1.00 0.00 O ATOM 0 H GLY A 114 -3.138 10.400 -6.874 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -1.802 10.895 -4.316 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -1.557 9.556 -5.419 1.00 0.00 H new ATOM 1516 N THR A 115 -0.508 12.664 -5.912 1.00 0.00 N ATOM 1517 CA THR A 115 0.592 13.452 -6.439 1.00 0.00 C ATOM 1518 C THR A 115 1.844 13.287 -5.579 1.00 0.00 C ATOM 1519 O THR A 115 2.965 13.514 -6.048 1.00 0.00 O ATOM 1520 CB THR A 115 0.218 14.945 -6.514 1.00 0.00 C ATOM 1521 OG1 THR A 115 -1.067 15.159 -5.908 1.00 0.00 O ATOM 1522 CG2 THR A 115 0.187 15.423 -7.960 1.00 0.00 C ATOM 0 H THR A 115 -1.270 13.216 -5.517 1.00 0.00 H new ATOM 0 HA THR A 115 0.799 13.087 -7.445 1.00 0.00 H new ATOM 0 HB THR A 115 0.975 15.515 -5.975 1.00 0.00 H new ATOM 0 HG1 THR A 115 -1.254 16.120 -5.868 1.00 0.00 H new ATOM 0 HG21 THR A 115 -0.079 16.480 -7.988 1.00 0.00 H new ATOM 0 HG22 THR A 115 1.170 15.284 -8.410 1.00 0.00 H new ATOM 0 HG23 THR A 115 -0.552 14.848 -8.518 1.00 0.00 H new ATOM 1530 N LYS A 116 1.638 12.865 -4.326 1.00 0.00 N ATOM 1531 CA LYS A 116 2.711 12.711 -3.343 1.00 0.00 C ATOM 1532 C LYS A 116 3.250 14.074 -2.907 1.00 0.00 C ATOM 1533 O LYS A 116 2.968 14.537 -1.805 1.00 0.00 O ATOM 1534 CB LYS A 116 3.845 11.840 -3.887 1.00 0.00 C ATOM 1535 CG LYS A 116 3.418 10.427 -4.239 1.00 0.00 C ATOM 1536 CD LYS A 116 4.413 9.767 -5.175 1.00 0.00 C ATOM 1537 CE LYS A 116 3.947 9.825 -6.621 1.00 0.00 C ATOM 1538 NZ LYS A 116 4.817 10.696 -7.456 1.00 0.00 N ATOM 0 H LYS A 116 0.716 12.620 -3.966 1.00 0.00 H new ATOM 0 HA LYS A 116 2.288 12.210 -2.472 1.00 0.00 H new ATOM 0 HB2 LYS A 116 4.262 12.315 -4.775 1.00 0.00 H new ATOM 0 HB3 LYS A 116 4.643 11.794 -3.146 1.00 0.00 H new ATOM 0 HG2 LYS A 116 3.325 9.836 -3.328 1.00 0.00 H new ATOM 0 HG3 LYS A 116 2.434 10.448 -4.707 1.00 0.00 H new ATOM 0 HD2 LYS A 116 5.381 10.260 -5.084 1.00 0.00 H new ATOM 0 HD3 LYS A 116 4.556 8.727 -4.880 1.00 0.00 H new ATOM 0 HE2 LYS A 116 3.936 8.818 -7.038 1.00 0.00 H new ATOM 0 HE3 LYS A 116 2.923 10.196 -6.656 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 4.592 10.550 -8.461 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 4.653 11.692 -7.206 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 5.814 10.456 -7.286 1.00 0.00 H new ATOM 1552 N ALA A 117 4.012 14.711 -3.777 1.00 0.00 N ATOM 1553 CA ALA A 117 4.534 16.037 -3.505 1.00 0.00 C ATOM 1554 C ALA A 117 4.010 17.012 -4.549 1.00 0.00 C ATOM 1555 O ALA A 117 4.337 16.904 -5.733 1.00 0.00 O ATOM 1556 CB ALA A 117 6.056 16.025 -3.490 1.00 0.00 C ATOM 0 H ALA A 117 4.284 14.329 -4.683 1.00 0.00 H new ATOM 0 HA ALA A 117 4.197 16.358 -2.519 1.00 0.00 H new ATOM 0 HB1 ALA A 117 6.426 17.030 -3.284 1.00 0.00 H new ATOM 0 HB2 ALA A 117 6.407 15.343 -2.715 1.00 0.00 H new ATOM 0 HB3 ALA A 117 6.427 15.693 -4.460 1.00 0.00 H new ATOM 1562 N GLU A 118 3.180 17.944 -4.109 1.00 0.00 N ATOM 1563 CA GLU A 118 2.552 18.901 -4.998 1.00 0.00 C ATOM 1564 C GLU A 118 2.647 20.287 -4.379 1.00 0.00 C ATOM 1565 O GLU A 118 2.258 20.430 -3.204 1.00 0.00 O ATOM 1566 CB GLU A 118 1.090 18.503 -5.233 1.00 0.00 C ATOM 1567 CG GLU A 118 0.280 19.523 -6.012 1.00 0.00 C ATOM 1568 CD GLU A 118 -1.125 19.037 -6.304 1.00 0.00 C ATOM 1569 OE1 GLU A 118 -1.487 17.922 -5.854 1.00 0.00 O ATOM 1570 OE2 GLU A 118 -1.878 19.762 -6.987 1.00 0.00 O ATOM 1571 OXT GLU A 118 3.163 21.209 -5.046 1.00 0.00 O ATOM 0 H GLU A 118 2.925 18.056 -3.128 1.00 0.00 H new ATOM 0 HA GLU A 118 3.061 18.911 -5.962 1.00 0.00 H new ATOM 0 HB2 GLU A 118 1.066 17.553 -5.767 1.00 0.00 H new ATOM 0 HB3 GLU A 118 0.612 18.338 -4.268 1.00 0.00 H new ATOM 0 HG2 GLU A 118 0.230 20.453 -5.446 1.00 0.00 H new ATOM 0 HG3 GLU A 118 0.787 19.747 -6.950 1.00 0.00 H new TER 1578 GLU A 118