USER MOD reduce.3.24.130724 H: found=0, std=0, add=887, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 888 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 33 ASN : amide:sc= -2.21 K(o=-3,f=-5.1!) USER MOD Set 1.2: A 36 THR OG1 : rot 159:sc= -0.827 USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 LYS NZ :NH3+ 176:sc= 1.25 (180deg=1.23) USER MOD Single : A 14 LYS NZ :NH3+ -179:sc= 2.22 (180deg=2.22) USER MOD Single : A 15 LYS NZ :NH3+ -177:sc= 1.28 (180deg=1.24) USER MOD Single : A 20 LYS NZ :NH3+ -171:sc= 2.36 (180deg=2.22) USER MOD Single : A 21 LYS NZ :NH3+ -147:sc= 0.0549 (180deg=0) USER MOD Single : A 22 LYS NZ :NH3+ 176:sc= 1.22 (180deg=1.16) USER MOD Single : A 26 GLN : amide:sc= 0.798 K(o=0.8,f=-1.4) USER MOD Single : A 27 LYS NZ :NH3+ 168:sc= 1.27 (180deg=1.19) USER MOD Single : A 34 TYR OH : rot 98:sc= 0.683 USER MOD Single : A 37 ASN : amide:sc= 0.604 K(o=0.6,f=0) USER MOD Single : A 38 THR OG1 : rot 180:sc= 0 USER MOD Single : A 39 TYR OH : rot 180:sc= 0 USER MOD Single : A 40 LYS NZ :NH3+ -176:sc= 1.23 (180deg=1.11) USER MOD Single : A 41 THR OG1 : rot -82:sc= 1.23 USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 54 LYS NZ :NH3+ -163:sc= 1.22 (180deg=0.894) USER MOD Single : A 55 LYS NZ :NH3+ 162:sc= 1.26 (180deg=1.04) USER MOD Single : A 62 LYS NZ :NH3+ 154:sc= 1.2 (180deg=0.663) USER MOD Single : A 66 LYS NZ :NH3+ -172:sc= 0.872 (180deg=0.812) USER MOD Single : A 70 ASN : amide:sc= 0.774 K(o=0.77,f=-0.03) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 GLN : amide:sc= 0.326 X(o=0.33,f=0) USER MOD Single : A 78 LYS NZ :NH3+ 176:sc= 1.28 (180deg=1.17) USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 84 LYS NZ :NH3+ -156:sc= 1.11 (180deg=0.765) USER MOD Single : A 85 LYS NZ :NH3+ -159:sc= 1.25 (180deg=1.15) USER MOD Single : A 89 THR OG1 : rot 85:sc= 0.0551 USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 THR OG1 : rot 74:sc= 0.859 USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 LYS NZ :NH3+ -170:sc= 0.763 (180deg=0.704) USER MOD Single : A 116 LYS NZ :NH3+ -171:sc= 1.24 (180deg=0.999) USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 55 N PRO A 5 13.584 14.928 16.626 1.00 0.00 N ATOM 56 CA PRO A 5 12.396 14.541 15.873 1.00 0.00 C ATOM 57 C PRO A 5 12.582 14.755 14.379 1.00 0.00 C ATOM 58 O PRO A 5 12.278 13.864 13.602 1.00 0.00 O ATOM 59 CB PRO A 5 11.256 15.392 16.421 1.00 0.00 C ATOM 60 CG PRO A 5 11.961 16.670 16.867 1.00 0.00 C ATOM 61 CD PRO A 5 13.264 16.113 17.426 1.00 0.00 C ATOM 0 HA PRO A 5 12.188 13.478 15.991 1.00 0.00 H new ATOM 0 HB2 PRO A 5 10.501 15.592 15.661 1.00 0.00 H new ATOM 0 HB3 PRO A 5 10.749 14.900 17.251 1.00 0.00 H new ATOM 0 HG2 PRO A 5 12.130 17.357 16.038 1.00 0.00 H new ATOM 0 HG3 PRO A 5 11.390 17.213 17.620 1.00 0.00 H new ATOM 0 HD2 PRO A 5 14.062 16.853 17.361 1.00 0.00 H new ATOM 0 HD3 PRO A 5 13.155 15.853 18.479 1.00 0.00 H new ATOM 69 N GLU A 6 13.136 15.899 13.971 1.00 0.00 N ATOM 70 CA GLU A 6 13.318 16.267 12.561 1.00 0.00 C ATOM 71 C GLU A 6 14.269 15.293 11.850 1.00 0.00 C ATOM 72 O GLU A 6 14.139 15.022 10.658 1.00 0.00 O ATOM 73 CB GLU A 6 13.800 17.710 12.447 1.00 0.00 C ATOM 74 CG GLU A 6 12.839 18.695 13.128 1.00 0.00 C ATOM 75 CD GLU A 6 11.429 18.807 12.513 1.00 0.00 C ATOM 76 OE1 GLU A 6 11.257 18.582 11.292 1.00 0.00 O ATOM 77 OE2 GLU A 6 10.491 19.170 13.266 1.00 0.00 O ATOM 0 H GLU A 6 13.477 16.608 14.620 1.00 0.00 H new ATOM 0 HA GLU A 6 12.353 16.194 12.059 1.00 0.00 H new ATOM 0 HB2 GLU A 6 14.789 17.798 12.898 1.00 0.00 H new ATOM 0 HB3 GLU A 6 13.905 17.975 11.395 1.00 0.00 H new ATOM 0 HG2 GLU A 6 12.735 18.404 14.173 1.00 0.00 H new ATOM 0 HG3 GLU A 6 13.297 19.684 13.116 1.00 0.00 H new ATOM 84 N LYS A 7 15.195 14.712 12.624 1.00 0.00 N ATOM 85 CA LYS A 7 16.077 13.613 12.211 1.00 0.00 C ATOM 86 C LYS A 7 15.319 12.298 12.077 1.00 0.00 C ATOM 87 O LYS A 7 15.376 11.664 11.024 1.00 0.00 O ATOM 88 CB LYS A 7 17.268 13.513 13.179 1.00 0.00 C ATOM 89 CG LYS A 7 17.912 14.868 13.521 1.00 0.00 C ATOM 90 CD LYS A 7 18.344 15.627 12.276 1.00 0.00 C ATOM 91 CE LYS A 7 19.542 14.905 11.660 1.00 0.00 C ATOM 92 NZ LYS A 7 20.275 15.759 10.689 1.00 0.00 N ATOM 0 H LYS A 7 15.356 15.004 13.588 1.00 0.00 H new ATOM 0 HA LYS A 7 16.468 13.830 11.217 1.00 0.00 H new ATOM 0 HB2 LYS A 7 16.934 13.038 14.101 1.00 0.00 H new ATOM 0 HB3 LYS A 7 18.025 12.863 12.741 1.00 0.00 H new ATOM 0 HG2 LYS A 7 17.203 15.473 14.086 1.00 0.00 H new ATOM 0 HG3 LYS A 7 18.777 14.706 14.164 1.00 0.00 H new ATOM 0 HD2 LYS A 7 17.524 15.679 11.560 1.00 0.00 H new ATOM 0 HD3 LYS A 7 18.610 16.653 12.531 1.00 0.00 H new ATOM 0 HE2 LYS A 7 20.222 14.593 12.452 1.00 0.00 H new ATOM 0 HE3 LYS A 7 19.200 14.000 11.159 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 21.079 15.228 10.297 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 19.634 16.036 9.918 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 20.625 16.611 11.171 1.00 0.00 H new ATOM 106 N LYS A 8 14.558 11.906 13.104 1.00 0.00 N ATOM 107 CA LYS A 8 13.786 10.658 13.090 1.00 0.00 C ATOM 108 C LYS A 8 12.711 10.624 12.006 1.00 0.00 C ATOM 109 O LYS A 8 12.542 9.593 11.356 1.00 0.00 O ATOM 110 CB LYS A 8 13.181 10.390 14.479 1.00 0.00 C ATOM 111 CG LYS A 8 14.188 9.884 15.529 1.00 0.00 C ATOM 112 CD LYS A 8 15.107 8.738 15.070 1.00 0.00 C ATOM 113 CE LYS A 8 14.353 7.625 14.327 1.00 0.00 C ATOM 114 NZ LYS A 8 15.282 6.557 13.882 1.00 0.00 N ATOM 0 H LYS A 8 14.460 12.442 13.966 1.00 0.00 H new ATOM 0 HA LYS A 8 14.484 9.858 12.842 1.00 0.00 H new ATOM 0 HB2 LYS A 8 12.724 11.309 14.846 1.00 0.00 H new ATOM 0 HB3 LYS A 8 12.382 9.656 14.377 1.00 0.00 H new ATOM 0 HG2 LYS A 8 14.811 10.722 15.843 1.00 0.00 H new ATOM 0 HG3 LYS A 8 13.634 9.552 16.407 1.00 0.00 H new ATOM 0 HD2 LYS A 8 15.883 9.141 14.419 1.00 0.00 H new ATOM 0 HD3 LYS A 8 15.609 8.312 15.939 1.00 0.00 H new ATOM 0 HE2 LYS A 8 13.590 7.200 14.979 1.00 0.00 H new ATOM 0 HE3 LYS A 8 13.836 8.045 13.464 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 14.740 5.786 13.443 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 15.953 6.947 13.189 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 15.806 6.189 14.702 1.00 0.00 H new ATOM 128 N VAL A 9 12.015 11.736 11.772 1.00 0.00 N ATOM 129 CA VAL A 9 10.993 11.817 10.719 1.00 0.00 C ATOM 130 C VAL A 9 11.591 11.785 9.317 1.00 0.00 C ATOM 131 O VAL A 9 10.981 11.228 8.419 1.00 0.00 O ATOM 132 CB VAL A 9 10.114 13.051 10.844 1.00 0.00 C ATOM 133 CG1 VAL A 9 9.338 12.957 12.156 1.00 0.00 C ATOM 134 CG2 VAL A 9 10.828 14.388 10.680 1.00 0.00 C ATOM 0 H VAL A 9 12.139 12.600 12.299 1.00 0.00 H new ATOM 0 HA VAL A 9 10.378 10.929 10.865 1.00 0.00 H new ATOM 0 HB VAL A 9 9.431 13.046 9.995 1.00 0.00 H new ATOM 0 HG11 VAL A 9 8.700 13.834 12.265 1.00 0.00 H new ATOM 0 HG12 VAL A 9 8.721 12.058 12.150 1.00 0.00 H new ATOM 0 HG13 VAL A 9 10.038 12.911 12.990 1.00 0.00 H new ATOM 0 HG21 VAL A 9 10.109 15.200 10.788 1.00 0.00 H new ATOM 0 HG22 VAL A 9 11.600 14.484 11.443 1.00 0.00 H new ATOM 0 HG23 VAL A 9 11.286 14.437 9.692 1.00 0.00 H new ATOM 144 N ALA A 10 12.774 12.370 9.119 1.00 0.00 N ATOM 145 CA ALA A 10 13.522 12.328 7.859 1.00 0.00 C ATOM 146 C ALA A 10 13.999 10.902 7.532 1.00 0.00 C ATOM 147 O ALA A 10 13.840 10.428 6.409 1.00 0.00 O ATOM 148 CB ALA A 10 14.693 13.314 7.923 1.00 0.00 C ATOM 0 H ALA A 10 13.251 12.900 9.848 1.00 0.00 H new ATOM 0 HA ALA A 10 12.858 12.628 7.048 1.00 0.00 H new ATOM 0 HB1 ALA A 10 15.248 13.281 6.985 1.00 0.00 H new ATOM 0 HB2 ALA A 10 14.311 14.322 8.084 1.00 0.00 H new ATOM 0 HB3 ALA A 10 15.354 13.041 8.745 1.00 0.00 H new ATOM 154 N GLU A 11 14.525 10.174 8.516 1.00 0.00 N ATOM 155 CA GLU A 11 14.829 8.743 8.369 1.00 0.00 C ATOM 156 C GLU A 11 13.582 7.909 8.041 1.00 0.00 C ATOM 157 O GLU A 11 13.601 7.076 7.134 1.00 0.00 O ATOM 158 CB GLU A 11 15.488 8.231 9.652 1.00 0.00 C ATOM 159 CG GLU A 11 16.870 8.862 9.837 1.00 0.00 C ATOM 160 CD GLU A 11 17.585 8.408 11.129 1.00 0.00 C ATOM 161 OE1 GLU A 11 16.951 7.784 12.017 1.00 0.00 O ATOM 162 OE2 GLU A 11 18.805 8.672 11.262 1.00 0.00 O ATOM 0 H GLU A 11 14.753 10.553 9.435 1.00 0.00 H new ATOM 0 HA GLU A 11 15.512 8.632 7.527 1.00 0.00 H new ATOM 0 HB2 GLU A 11 14.857 8.466 10.510 1.00 0.00 H new ATOM 0 HB3 GLU A 11 15.580 7.146 9.612 1.00 0.00 H new ATOM 0 HG2 GLU A 11 17.493 8.611 8.979 1.00 0.00 H new ATOM 0 HG3 GLU A 11 16.767 9.947 9.850 1.00 0.00 H new ATOM 169 N ALA A 12 12.470 8.156 8.735 1.00 0.00 N ATOM 170 CA ALA A 12 11.204 7.489 8.452 1.00 0.00 C ATOM 171 C ALA A 12 10.518 7.959 7.154 1.00 0.00 C ATOM 172 O ALA A 12 9.775 7.197 6.538 1.00 0.00 O ATOM 173 CB ALA A 12 10.316 7.617 9.687 1.00 0.00 C ATOM 0 H ALA A 12 12.424 8.822 9.506 1.00 0.00 H new ATOM 0 HA ALA A 12 11.402 6.436 8.252 1.00 0.00 H new ATOM 0 HB1 ALA A 12 9.361 7.125 9.501 1.00 0.00 H new ATOM 0 HB2 ALA A 12 10.807 7.146 10.539 1.00 0.00 H new ATOM 0 HB3 ALA A 12 10.145 8.671 9.904 1.00 0.00 H new ATOM 179 N GLU A 13 10.813 9.166 6.667 1.00 0.00 N ATOM 180 CA GLU A 13 10.363 9.668 5.368 1.00 0.00 C ATOM 181 C GLU A 13 11.012 8.813 4.292 1.00 0.00 C ATOM 182 O GLU A 13 10.393 8.495 3.284 1.00 0.00 O ATOM 183 CB GLU A 13 10.749 11.152 5.196 1.00 0.00 C ATOM 184 CG GLU A 13 10.645 11.659 3.750 1.00 0.00 C ATOM 185 CD GLU A 13 11.298 13.039 3.573 1.00 0.00 C ATOM 186 OE1 GLU A 13 10.711 14.064 3.997 1.00 0.00 O ATOM 187 OE2 GLU A 13 12.407 13.093 2.983 1.00 0.00 O ATOM 0 H GLU A 13 11.386 9.838 7.178 1.00 0.00 H new ATOM 0 HA GLU A 13 9.277 9.606 5.293 1.00 0.00 H new ATOM 0 HB2 GLU A 13 10.105 11.761 5.831 1.00 0.00 H new ATOM 0 HB3 GLU A 13 11.771 11.295 5.548 1.00 0.00 H new ATOM 0 HG2 GLU A 13 11.123 10.944 3.080 1.00 0.00 H new ATOM 0 HG3 GLU A 13 9.596 11.715 3.461 1.00 0.00 H new ATOM 194 N LYS A 14 12.265 8.423 4.530 1.00 0.00 N ATOM 195 CA LYS A 14 13.085 7.659 3.603 1.00 0.00 C ATOM 196 C LYS A 14 12.519 6.263 3.364 1.00 0.00 C ATOM 197 O LYS A 14 12.439 5.779 2.234 1.00 0.00 O ATOM 198 CB LYS A 14 14.523 7.630 4.154 1.00 0.00 C ATOM 199 CG LYS A 14 15.484 8.229 3.123 1.00 0.00 C ATOM 200 CD LYS A 14 15.908 9.678 3.428 1.00 0.00 C ATOM 201 CE LYS A 14 14.750 10.687 3.489 1.00 0.00 C ATOM 202 NZ LYS A 14 14.276 11.132 2.154 1.00 0.00 N ATOM 0 H LYS A 14 12.748 8.639 5.402 1.00 0.00 H new ATOM 0 HA LYS A 14 13.086 8.137 2.623 1.00 0.00 H new ATOM 0 HB2 LYS A 14 14.577 8.193 5.086 1.00 0.00 H new ATOM 0 HB3 LYS A 14 14.814 6.605 4.384 1.00 0.00 H new ATOM 0 HG2 LYS A 14 16.376 7.605 3.067 1.00 0.00 H new ATOM 0 HG3 LYS A 14 15.012 8.199 2.141 1.00 0.00 H new ATOM 0 HD2 LYS A 14 16.437 9.694 4.381 1.00 0.00 H new ATOM 0 HD3 LYS A 14 16.616 10.003 2.665 1.00 0.00 H new ATOM 0 HE2 LYS A 14 13.917 10.238 4.030 1.00 0.00 H new ATOM 0 HE3 LYS A 14 15.069 11.559 4.061 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 13.507 11.823 2.271 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 15.062 11.573 1.636 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 13.926 10.312 1.619 1.00 0.00 H new ATOM 216 N LYS A 15 12.016 5.662 4.438 1.00 0.00 N ATOM 217 CA LYS A 15 11.158 4.479 4.400 1.00 0.00 C ATOM 218 C LYS A 15 9.821 4.723 3.688 1.00 0.00 C ATOM 219 O LYS A 15 9.435 3.942 2.820 1.00 0.00 O ATOM 220 CB LYS A 15 10.948 4.031 5.845 1.00 0.00 C ATOM 221 CG LYS A 15 9.876 2.954 5.970 1.00 0.00 C ATOM 222 CD LYS A 15 10.116 1.716 5.089 1.00 0.00 C ATOM 223 CE LYS A 15 11.413 1.007 5.483 1.00 0.00 C ATOM 224 NZ LYS A 15 11.591 -0.278 4.760 1.00 0.00 N ATOM 0 H LYS A 15 12.198 5.992 5.386 1.00 0.00 H new ATOM 0 HA LYS A 15 11.645 3.700 3.814 1.00 0.00 H new ATOM 0 HB2 LYS A 15 11.888 3.652 6.245 1.00 0.00 H new ATOM 0 HB3 LYS A 15 10.667 4.892 6.452 1.00 0.00 H new ATOM 0 HG2 LYS A 15 9.815 2.638 7.011 1.00 0.00 H new ATOM 0 HG3 LYS A 15 8.910 3.388 5.711 1.00 0.00 H new ATOM 0 HD2 LYS A 15 9.277 1.027 5.186 1.00 0.00 H new ATOM 0 HD3 LYS A 15 10.164 2.014 4.042 1.00 0.00 H new ATOM 0 HE2 LYS A 15 12.260 1.660 5.274 1.00 0.00 H new ATOM 0 HE3 LYS A 15 11.412 0.821 6.557 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 12.456 -0.748 5.095 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 10.772 -0.893 4.938 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 11.670 -0.094 3.739 1.00 0.00 H new ATOM 238 N VAL A 16 9.134 5.820 4.009 1.00 0.00 N ATOM 239 CA VAL A 16 7.872 6.221 3.339 1.00 0.00 C ATOM 240 C VAL A 16 8.090 6.373 1.826 1.00 0.00 C ATOM 241 O VAL A 16 7.169 6.215 1.034 1.00 0.00 O ATOM 242 CB VAL A 16 7.280 7.495 3.984 1.00 0.00 C ATOM 243 CG1 VAL A 16 6.500 8.432 3.053 1.00 0.00 C ATOM 244 CG2 VAL A 16 6.337 7.090 5.121 1.00 0.00 C ATOM 0 H VAL A 16 9.429 6.465 4.742 1.00 0.00 H new ATOM 0 HA VAL A 16 7.135 5.431 3.480 1.00 0.00 H new ATOM 0 HB VAL A 16 8.153 8.058 4.316 1.00 0.00 H new ATOM 0 HG11 VAL A 16 6.135 9.288 3.621 1.00 0.00 H new ATOM 0 HG12 VAL A 16 7.155 8.779 2.254 1.00 0.00 H new ATOM 0 HG13 VAL A 16 5.655 7.896 2.622 1.00 0.00 H new ATOM 0 HG21 VAL A 16 5.916 7.984 5.580 1.00 0.00 H new ATOM 0 HG22 VAL A 16 5.532 6.473 4.723 1.00 0.00 H new ATOM 0 HG23 VAL A 16 6.892 6.524 5.870 1.00 0.00 H new ATOM 254 N GLU A 17 9.335 6.621 1.431 1.00 0.00 N ATOM 255 CA GLU A 17 9.786 6.913 0.069 1.00 0.00 C ATOM 256 C GLU A 17 10.055 5.607 -0.688 1.00 0.00 C ATOM 257 O GLU A 17 9.611 5.460 -1.822 1.00 0.00 O ATOM 258 CB GLU A 17 10.987 7.886 0.124 1.00 0.00 C ATOM 259 CG GLU A 17 12.094 7.633 -0.904 1.00 0.00 C ATOM 260 CD GLU A 17 13.266 8.631 -0.832 1.00 0.00 C ATOM 261 OE1 GLU A 17 13.399 9.398 0.154 1.00 0.00 O ATOM 262 OE2 GLU A 17 14.088 8.618 -1.782 1.00 0.00 O ATOM 0 H GLU A 17 10.109 6.624 2.096 1.00 0.00 H new ATOM 0 HA GLU A 17 9.009 7.422 -0.501 1.00 0.00 H new ATOM 0 HB2 GLU A 17 10.615 8.901 -0.012 1.00 0.00 H new ATOM 0 HB3 GLU A 17 11.425 7.838 1.121 1.00 0.00 H new ATOM 0 HG2 GLU A 17 12.482 6.624 -0.762 1.00 0.00 H new ATOM 0 HG3 GLU A 17 11.661 7.670 -1.904 1.00 0.00 H new ATOM 269 N GLU A 18 10.710 4.627 -0.061 1.00 0.00 N ATOM 270 CA GLU A 18 10.786 3.250 -0.568 1.00 0.00 C ATOM 271 C GLU A 18 9.381 2.661 -0.784 1.00 0.00 C ATOM 272 O GLU A 18 9.075 2.140 -1.859 1.00 0.00 O ATOM 273 CB GLU A 18 11.611 2.409 0.418 1.00 0.00 C ATOM 274 CG GLU A 18 11.832 0.970 -0.062 1.00 0.00 C ATOM 275 CD GLU A 18 12.675 0.181 0.956 1.00 0.00 C ATOM 276 OE1 GLU A 18 12.161 -0.118 2.062 1.00 0.00 O ATOM 277 OE2 GLU A 18 13.850 -0.147 0.661 1.00 0.00 O ATOM 0 H GLU A 18 11.207 4.765 0.819 1.00 0.00 H new ATOM 0 HA GLU A 18 11.278 3.242 -1.541 1.00 0.00 H new ATOM 0 HB2 GLU A 18 12.578 2.887 0.574 1.00 0.00 H new ATOM 0 HB3 GLU A 18 11.105 2.391 1.383 1.00 0.00 H new ATOM 0 HG2 GLU A 18 10.870 0.477 -0.205 1.00 0.00 H new ATOM 0 HG3 GLU A 18 12.334 0.977 -1.030 1.00 0.00 H new ATOM 284 N ALA A 19 8.503 2.803 0.214 1.00 0.00 N ATOM 285 CA ALA A 19 7.108 2.374 0.151 1.00 0.00 C ATOM 286 C ALA A 19 6.330 3.080 -0.982 1.00 0.00 C ATOM 287 O ALA A 19 5.661 2.415 -1.777 1.00 0.00 O ATOM 288 CB ALA A 19 6.510 2.580 1.541 1.00 0.00 C ATOM 0 H ALA A 19 8.751 3.229 1.107 1.00 0.00 H new ATOM 0 HA ALA A 19 7.037 1.318 -0.111 1.00 0.00 H new ATOM 0 HB1 ALA A 19 5.465 2.271 1.537 1.00 0.00 H new ATOM 0 HB2 ALA A 19 7.062 1.983 2.267 1.00 0.00 H new ATOM 0 HB3 ALA A 19 6.575 3.634 1.813 1.00 0.00 H new ATOM 294 N LYS A 20 6.465 4.408 -1.121 1.00 0.00 N ATOM 295 CA LYS A 20 5.899 5.195 -2.236 1.00 0.00 C ATOM 296 C LYS A 20 6.449 4.797 -3.611 1.00 0.00 C ATOM 297 O LYS A 20 5.668 4.677 -4.550 1.00 0.00 O ATOM 298 CB LYS A 20 6.108 6.701 -1.985 1.00 0.00 C ATOM 299 CG LYS A 20 4.887 7.395 -1.352 1.00 0.00 C ATOM 300 CD LYS A 20 3.766 7.642 -2.381 1.00 0.00 C ATOM 301 CE LYS A 20 2.614 8.496 -1.826 1.00 0.00 C ATOM 302 NZ LYS A 20 1.691 7.716 -0.966 1.00 0.00 N ATOM 0 H LYS A 20 6.980 4.979 -0.451 1.00 0.00 H new ATOM 0 HA LYS A 20 4.833 4.970 -2.261 1.00 0.00 H new ATOM 0 HB2 LYS A 20 6.971 6.836 -1.333 1.00 0.00 H new ATOM 0 HB3 LYS A 20 6.344 7.189 -2.931 1.00 0.00 H new ATOM 0 HG2 LYS A 20 4.503 6.781 -0.538 1.00 0.00 H new ATOM 0 HG3 LYS A 20 5.195 8.345 -0.917 1.00 0.00 H new ATOM 0 HD2 LYS A 20 4.187 8.136 -3.256 1.00 0.00 H new ATOM 0 HD3 LYS A 20 3.371 6.683 -2.716 1.00 0.00 H new ATOM 0 HE2 LYS A 20 3.026 9.326 -1.252 1.00 0.00 H new ATOM 0 HE3 LYS A 20 2.054 8.928 -2.655 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 0.855 8.292 -0.742 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 1.394 6.855 -1.467 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 2.176 7.453 -0.084 1.00 0.00 H new ATOM 316 N LYS A 21 7.755 4.557 -3.761 1.00 0.00 N ATOM 317 CA LYS A 21 8.366 4.091 -5.020 1.00 0.00 C ATOM 318 C LYS A 21 7.839 2.715 -5.444 1.00 0.00 C ATOM 319 O LYS A 21 7.516 2.524 -6.617 1.00 0.00 O ATOM 320 CB LYS A 21 9.900 4.130 -4.905 1.00 0.00 C ATOM 321 CG LYS A 21 10.411 5.578 -5.040 1.00 0.00 C ATOM 322 CD LYS A 21 11.937 5.730 -4.951 1.00 0.00 C ATOM 323 CE LYS A 21 12.498 5.276 -3.596 1.00 0.00 C ATOM 324 NZ LYS A 21 13.900 5.736 -3.402 1.00 0.00 N ATOM 0 H LYS A 21 8.430 4.681 -3.006 1.00 0.00 H new ATOM 0 HA LYS A 21 8.073 4.773 -5.819 1.00 0.00 H new ATOM 0 HB2 LYS A 21 10.210 3.716 -3.946 1.00 0.00 H new ATOM 0 HB3 LYS A 21 10.345 3.506 -5.680 1.00 0.00 H new ATOM 0 HG2 LYS A 21 10.074 5.980 -5.995 1.00 0.00 H new ATOM 0 HG3 LYS A 21 9.953 6.185 -4.259 1.00 0.00 H new ATOM 0 HD2 LYS A 21 12.403 5.148 -5.746 1.00 0.00 H new ATOM 0 HD3 LYS A 21 12.205 6.773 -5.120 1.00 0.00 H new ATOM 0 HE2 LYS A 21 11.872 5.666 -2.793 1.00 0.00 H new ATOM 0 HE3 LYS A 21 12.459 4.189 -3.531 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 14.423 5.031 -2.844 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 14.358 5.853 -4.328 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 13.900 6.646 -2.898 1.00 0.00 H new ATOM 338 N LYS A 22 7.654 1.778 -4.506 1.00 0.00 N ATOM 339 CA LYS A 22 6.961 0.502 -4.777 1.00 0.00 C ATOM 340 C LYS A 22 5.466 0.660 -5.050 1.00 0.00 C ATOM 341 O LYS A 22 4.938 -0.065 -5.890 1.00 0.00 O ATOM 342 CB LYS A 22 7.250 -0.532 -3.676 1.00 0.00 C ATOM 343 CG LYS A 22 8.734 -0.947 -3.609 1.00 0.00 C ATOM 344 CD LYS A 22 9.354 -1.392 -4.947 1.00 0.00 C ATOM 345 CE LYS A 22 8.665 -2.621 -5.553 1.00 0.00 C ATOM 346 NZ LYS A 22 9.269 -2.965 -6.865 1.00 0.00 N ATOM 0 H LYS A 22 7.976 1.877 -3.543 1.00 0.00 H new ATOM 0 HA LYS A 22 7.377 0.120 -5.710 1.00 0.00 H new ATOM 0 HB2 LYS A 22 6.950 -0.121 -2.712 1.00 0.00 H new ATOM 0 HB3 LYS A 22 6.639 -1.418 -3.849 1.00 0.00 H new ATOM 0 HG2 LYS A 22 9.312 -0.108 -3.221 1.00 0.00 H new ATOM 0 HG3 LYS A 22 8.834 -1.762 -2.892 1.00 0.00 H new ATOM 0 HD2 LYS A 22 9.301 -0.567 -5.657 1.00 0.00 H new ATOM 0 HD3 LYS A 22 10.410 -1.614 -4.795 1.00 0.00 H new ATOM 0 HE2 LYS A 22 8.755 -3.467 -4.872 1.00 0.00 H new ATOM 0 HE3 LYS A 22 7.600 -2.423 -5.677 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 8.836 -3.838 -7.228 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 9.102 -2.190 -7.538 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 10.293 -3.108 -6.749 1.00 0.00 H new ATOM 360 N ALA A 23 4.771 1.610 -4.428 1.00 0.00 N ATOM 361 CA ALA A 23 3.429 1.996 -4.873 1.00 0.00 C ATOM 362 C ALA A 23 3.444 2.541 -6.319 1.00 0.00 C ATOM 363 O ALA A 23 2.578 2.199 -7.114 1.00 0.00 O ATOM 364 CB ALA A 23 2.805 2.975 -3.869 1.00 0.00 C ATOM 0 H ALA A 23 5.111 2.127 -3.617 1.00 0.00 H new ATOM 0 HA ALA A 23 2.796 1.109 -4.900 1.00 0.00 H new ATOM 0 HB1 ALA A 23 1.808 3.257 -4.207 1.00 0.00 H new ATOM 0 HB2 ALA A 23 2.735 2.498 -2.891 1.00 0.00 H new ATOM 0 HB3 ALA A 23 3.428 3.866 -3.794 1.00 0.00 H new ATOM 370 N GLU A 24 4.449 3.320 -6.721 1.00 0.00 N ATOM 371 CA GLU A 24 4.541 3.881 -8.075 1.00 0.00 C ATOM 372 C GLU A 24 4.831 2.814 -9.147 1.00 0.00 C ATOM 373 O GLU A 24 4.292 2.874 -10.250 1.00 0.00 O ATOM 374 CB GLU A 24 5.569 5.025 -8.099 1.00 0.00 C ATOM 375 CG GLU A 24 5.525 5.828 -9.405 1.00 0.00 C ATOM 376 CD GLU A 24 6.466 7.046 -9.337 1.00 0.00 C ATOM 377 OE1 GLU A 24 7.671 6.910 -9.662 1.00 0.00 O ATOM 378 OE2 GLU A 24 6.005 8.155 -8.969 1.00 0.00 O ATOM 0 H GLU A 24 5.227 3.582 -6.116 1.00 0.00 H new ATOM 0 HA GLU A 24 3.564 4.289 -8.334 1.00 0.00 H new ATOM 0 HB2 GLU A 24 5.383 5.694 -7.259 1.00 0.00 H new ATOM 0 HB3 GLU A 24 6.569 4.613 -7.963 1.00 0.00 H new ATOM 0 HG2 GLU A 24 5.813 5.188 -10.239 1.00 0.00 H new ATOM 0 HG3 GLU A 24 4.505 6.162 -9.596 1.00 0.00 H new ATOM 385 N ASP A 25 5.598 1.776 -8.815 1.00 0.00 N ATOM 386 CA ASP A 25 5.719 0.567 -9.643 1.00 0.00 C ATOM 387 C ASP A 25 4.372 -0.158 -9.851 1.00 0.00 C ATOM 388 O ASP A 25 4.117 -0.746 -10.903 1.00 0.00 O ATOM 389 CB ASP A 25 6.711 -0.400 -8.977 1.00 0.00 C ATOM 390 CG ASP A 25 8.200 -0.110 -9.228 1.00 0.00 C ATOM 391 OD1 ASP A 25 8.558 0.645 -10.163 1.00 0.00 O ATOM 392 OD2 ASP A 25 9.027 -0.715 -8.504 1.00 0.00 O ATOM 0 H ASP A 25 6.157 1.746 -7.962 1.00 0.00 H new ATOM 0 HA ASP A 25 6.072 0.882 -10.625 1.00 0.00 H new ATOM 0 HB2 ASP A 25 6.534 -0.388 -7.901 1.00 0.00 H new ATOM 0 HB3 ASP A 25 6.493 -1.410 -9.324 1.00 0.00 H new ATOM 397 N GLN A 26 3.494 -0.124 -8.850 1.00 0.00 N ATOM 398 CA GLN A 26 2.179 -0.778 -8.892 1.00 0.00 C ATOM 399 C GLN A 26 1.118 0.119 -9.565 1.00 0.00 C ATOM 400 O GLN A 26 0.199 -0.366 -10.223 1.00 0.00 O ATOM 401 CB GLN A 26 1.819 -1.197 -7.461 1.00 0.00 C ATOM 402 CG GLN A 26 2.719 -2.353 -6.981 1.00 0.00 C ATOM 403 CD GLN A 26 2.549 -2.650 -5.495 1.00 0.00 C ATOM 404 OE1 GLN A 26 1.945 -3.626 -5.084 1.00 0.00 O ATOM 405 NE2 GLN A 26 3.101 -1.833 -4.628 1.00 0.00 N ATOM 0 H GLN A 26 3.675 0.364 -7.973 1.00 0.00 H new ATOM 0 HA GLN A 26 2.211 -1.671 -9.516 1.00 0.00 H new ATOM 0 HB2 GLN A 26 1.927 -0.344 -6.790 1.00 0.00 H new ATOM 0 HB3 GLN A 26 0.774 -1.504 -7.420 1.00 0.00 H new ATOM 0 HG2 GLN A 26 2.489 -3.250 -7.556 1.00 0.00 H new ATOM 0 HG3 GLN A 26 3.761 -2.104 -7.181 1.00 0.00 H new ATOM 0 HE21 GLN A 26 3.610 -1.011 -4.954 1.00 0.00 H new ATOM 0 HE22 GLN A 26 3.021 -2.020 -3.628 1.00 0.00 H new ATOM 414 N LYS A 27 1.294 1.442 -9.490 1.00 0.00 N ATOM 415 CA LYS A 27 0.602 2.464 -10.290 1.00 0.00 C ATOM 416 C LYS A 27 0.918 2.385 -11.778 1.00 0.00 C ATOM 417 O LYS A 27 0.036 2.543 -12.621 1.00 0.00 O ATOM 418 CB LYS A 27 1.056 3.824 -9.773 1.00 0.00 C ATOM 419 CG LYS A 27 0.334 5.002 -10.425 1.00 0.00 C ATOM 420 CD LYS A 27 -1.191 5.035 -10.292 1.00 0.00 C ATOM 421 CE LYS A 27 -1.646 4.769 -8.853 1.00 0.00 C ATOM 422 NZ LYS A 27 -3.115 4.947 -8.730 1.00 0.00 N ATOM 0 H LYS A 27 1.959 1.854 -8.835 1.00 0.00 H new ATOM 0 HA LYS A 27 -0.471 2.304 -10.187 1.00 0.00 H new ATOM 0 HB2 LYS A 27 0.898 3.864 -8.695 1.00 0.00 H new ATOM 0 HB3 LYS A 27 2.128 3.928 -9.942 1.00 0.00 H new ATOM 0 HG2 LYS A 27 0.732 5.923 -9.999 1.00 0.00 H new ATOM 0 HG3 LYS A 27 0.583 5.008 -11.486 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -1.563 6.007 -10.616 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -1.629 4.289 -10.955 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -1.371 3.756 -8.560 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -1.133 5.448 -8.172 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -3.435 4.571 -7.815 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -3.348 5.959 -8.789 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -3.592 4.436 -9.500 1.00 0.00 H new ATOM 436 N GLU A 28 2.183 2.133 -12.094 1.00 0.00 N ATOM 437 CA GLU A 28 2.590 1.762 -13.451 1.00 0.00 C ATOM 438 C GLU A 28 1.696 0.621 -13.966 1.00 0.00 C ATOM 439 O GLU A 28 1.206 0.694 -15.087 1.00 0.00 O ATOM 440 CB GLU A 28 4.088 1.416 -13.518 1.00 0.00 C ATOM 441 CG GLU A 28 4.638 1.312 -14.947 1.00 0.00 C ATOM 442 CD GLU A 28 4.616 2.671 -15.666 1.00 0.00 C ATOM 443 OE1 GLU A 28 5.483 3.532 -15.391 1.00 0.00 O ATOM 444 OE2 GLU A 28 3.695 2.927 -16.473 1.00 0.00 O ATOM 0 H GLU A 28 2.952 2.178 -11.426 1.00 0.00 H new ATOM 0 HA GLU A 28 2.453 2.619 -14.110 1.00 0.00 H new ATOM 0 HB2 GLU A 28 4.651 2.176 -12.977 1.00 0.00 H new ATOM 0 HB3 GLU A 28 4.256 0.469 -13.005 1.00 0.00 H new ATOM 0 HG2 GLU A 28 5.660 0.933 -14.917 1.00 0.00 H new ATOM 0 HG3 GLU A 28 4.047 0.592 -15.513 1.00 0.00 H new ATOM 451 N GLU A 29 1.359 -0.374 -13.134 1.00 0.00 N ATOM 452 CA GLU A 29 0.314 -1.343 -13.498 1.00 0.00 C ATOM 453 C GLU A 29 -1.108 -0.755 -13.625 1.00 0.00 C ATOM 454 O GLU A 29 -1.729 -0.977 -14.648 1.00 0.00 O ATOM 455 CB GLU A 29 0.391 -2.655 -12.705 1.00 0.00 C ATOM 456 CG GLU A 29 1.780 -3.284 -12.896 1.00 0.00 C ATOM 457 CD GLU A 29 1.798 -4.791 -12.596 1.00 0.00 C ATOM 458 OE1 GLU A 29 1.684 -5.192 -11.415 1.00 0.00 O ATOM 459 OE2 GLU A 29 1.941 -5.576 -13.567 1.00 0.00 O ATOM 0 H GLU A 29 1.785 -0.529 -12.220 1.00 0.00 H new ATOM 0 HA GLU A 29 0.555 -1.621 -14.524 1.00 0.00 H new ATOM 0 HB2 GLU A 29 0.208 -2.465 -11.647 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -0.383 -3.344 -13.044 1.00 0.00 H new ATOM 0 HG2 GLU A 29 2.111 -3.118 -13.921 1.00 0.00 H new ATOM 0 HG3 GLU A 29 2.495 -2.780 -12.245 1.00 0.00 H new ATOM 466 N ASP A 30 -1.631 0.093 -12.747 1.00 0.00 N ATOM 467 CA ASP A 30 -2.821 0.933 -12.939 1.00 0.00 C ATOM 468 C ASP A 30 -2.721 1.983 -14.084 1.00 0.00 C ATOM 469 O ASP A 30 -3.534 2.905 -14.156 1.00 0.00 O ATOM 470 CB ASP A 30 -3.063 1.564 -11.562 1.00 0.00 C ATOM 471 CG ASP A 30 -4.348 2.386 -11.382 1.00 0.00 C ATOM 472 OD1 ASP A 30 -5.442 1.926 -11.771 1.00 0.00 O ATOM 473 OD2 ASP A 30 -4.269 3.474 -10.760 1.00 0.00 O ATOM 0 H ASP A 30 -1.215 0.225 -11.825 1.00 0.00 H new ATOM 0 HA ASP A 30 -3.661 0.330 -13.283 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -3.066 0.765 -10.820 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -2.215 2.209 -11.332 1.00 0.00 H new ATOM 478 N ARG A 31 -1.774 1.837 -15.027 1.00 0.00 N ATOM 479 CA ARG A 31 -1.854 2.374 -16.406 1.00 0.00 C ATOM 480 C ARG A 31 -1.343 1.417 -17.502 1.00 0.00 C ATOM 481 O ARG A 31 -1.506 1.721 -18.684 1.00 0.00 O ATOM 482 CB ARG A 31 -1.217 3.773 -16.464 1.00 0.00 C ATOM 483 CG ARG A 31 0.293 3.748 -16.215 1.00 0.00 C ATOM 484 CD ARG A 31 0.777 5.106 -15.696 1.00 0.00 C ATOM 485 NE ARG A 31 2.241 5.135 -15.533 1.00 0.00 N ATOM 486 CZ ARG A 31 2.959 6.095 -14.982 1.00 0.00 C ATOM 487 NH1 ARG A 31 2.419 7.190 -14.521 1.00 0.00 N ATOM 488 NH2 ARG A 31 4.249 5.974 -14.879 1.00 0.00 N ATOM 0 H ARG A 31 -0.907 1.329 -14.851 1.00 0.00 H new ATOM 0 HA ARG A 31 -2.913 2.471 -16.647 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -1.412 4.216 -17.441 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -1.692 4.415 -15.722 1.00 0.00 H new ATOM 0 HG2 ARG A 31 0.535 2.969 -15.492 1.00 0.00 H new ATOM 0 HG3 ARG A 31 0.815 3.499 -17.139 1.00 0.00 H new ATOM 0 HD2 ARG A 31 0.472 5.890 -16.389 1.00 0.00 H new ATOM 0 HD3 ARG A 31 0.300 5.322 -14.740 1.00 0.00 H new ATOM 0 HE ARG A 31 2.754 4.326 -15.884 1.00 0.00 H new ATOM 0 HH11 ARG A 31 1.410 7.325 -14.580 1.00 0.00 H new ATOM 0 HH12 ARG A 31 3.006 7.911 -14.101 1.00 0.00 H new ATOM 0 HH21 ARG A 31 4.712 5.133 -15.225 1.00 0.00 H new ATOM 0 HH22 ARG A 31 4.799 6.720 -14.452 1.00 0.00 H new ATOM 502 N ARG A 32 -0.806 0.238 -17.142 1.00 0.00 N ATOM 503 CA ARG A 32 -0.418 -0.861 -18.053 1.00 0.00 C ATOM 504 C ARG A 32 -1.444 -1.962 -18.137 1.00 0.00 C ATOM 505 O ARG A 32 -1.536 -2.675 -19.127 1.00 0.00 O ATOM 506 CB ARG A 32 1.009 -1.341 -17.745 1.00 0.00 C ATOM 507 CG ARG A 32 1.312 -2.843 -17.894 1.00 0.00 C ATOM 508 CD ARG A 32 0.591 -3.631 -16.791 1.00 0.00 C ATOM 509 NE ARG A 32 1.344 -4.771 -16.242 1.00 0.00 N ATOM 510 CZ ARG A 32 1.580 -5.944 -16.793 1.00 0.00 C ATOM 511 NH1 ARG A 32 1.288 -6.223 -18.032 1.00 0.00 N ATOM 512 NH2 ARG A 32 2.116 -6.866 -16.053 1.00 0.00 N ATOM 0 H ARG A 32 -0.621 0.012 -16.165 1.00 0.00 H new ATOM 0 HA ARG A 32 -0.399 -0.461 -19.067 1.00 0.00 H new ATOM 0 HB2 ARG A 32 1.693 -0.796 -18.396 1.00 0.00 H new ATOM 0 HB3 ARG A 32 1.245 -1.052 -16.721 1.00 0.00 H new ATOM 0 HG2 ARG A 32 0.989 -3.193 -18.874 1.00 0.00 H new ATOM 0 HG3 ARG A 32 2.387 -3.014 -17.833 1.00 0.00 H new ATOM 0 HD2 ARG A 32 0.351 -2.948 -15.976 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -0.355 -3.998 -17.188 1.00 0.00 H new ATOM 0 HE ARG A 32 1.735 -4.634 -15.310 1.00 0.00 H new ATOM 0 HH11 ARG A 32 0.855 -5.516 -18.626 1.00 0.00 H new ATOM 0 HH12 ARG A 32 1.493 -7.149 -18.408 1.00 0.00 H new ATOM 0 HH21 ARG A 32 2.341 -6.670 -15.077 1.00 0.00 H new ATOM 0 HH22 ARG A 32 2.312 -7.786 -16.447 1.00 0.00 H new ATOM 526 N ASN A 33 -2.173 -2.116 -17.053 1.00 0.00 N ATOM 527 CA ASN A 33 -3.122 -3.190 -16.831 1.00 0.00 C ATOM 528 C ASN A 33 -4.576 -2.724 -17.065 1.00 0.00 C ATOM 529 O ASN A 33 -5.511 -3.479 -16.884 1.00 0.00 O ATOM 530 CB ASN A 33 -2.793 -3.756 -15.449 1.00 0.00 C ATOM 531 CG ASN A 33 -3.493 -5.040 -15.116 1.00 0.00 C ATOM 532 OD1 ASN A 33 -3.990 -5.799 -15.927 1.00 0.00 O ATOM 533 ND2 ASN A 33 -3.589 -5.291 -13.845 1.00 0.00 N ATOM 0 H ASN A 33 -2.119 -1.469 -16.267 1.00 0.00 H new ATOM 0 HA ASN A 33 -3.035 -4.001 -17.554 1.00 0.00 H new ATOM 0 HB2 ASN A 33 -1.717 -3.917 -15.384 1.00 0.00 H new ATOM 0 HB3 ASN A 33 -3.050 -3.012 -14.696 1.00 0.00 H new ATOM 0 HD21 ASN A 33 -4.081 -6.125 -13.526 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -3.172 -4.654 -13.166 1.00 0.00 H new ATOM 540 N TYR A 34 -4.756 -1.462 -17.449 1.00 0.00 N ATOM 541 CA TYR A 34 -5.860 -0.800 -18.202 1.00 0.00 C ATOM 542 C TYR A 34 -6.134 -1.311 -19.622 1.00 0.00 C ATOM 543 O TYR A 34 -7.272 -1.657 -19.934 1.00 0.00 O ATOM 544 CB TYR A 34 -5.634 0.715 -18.281 1.00 0.00 C ATOM 545 CG TYR A 34 -6.467 1.427 -17.304 1.00 0.00 C ATOM 546 CD1 TYR A 34 -7.842 1.588 -17.501 1.00 0.00 C ATOM 547 CD2 TYR A 34 -5.845 1.808 -16.126 1.00 0.00 C ATOM 548 CE1 TYR A 34 -8.599 2.169 -16.479 1.00 0.00 C ATOM 549 CE2 TYR A 34 -6.594 2.378 -15.116 1.00 0.00 C ATOM 550 CZ TYR A 34 -7.980 2.605 -15.283 1.00 0.00 C ATOM 551 OH TYR A 34 -8.717 3.205 -14.307 1.00 0.00 O ATOM 0 H TYR A 34 -4.042 -0.773 -17.215 1.00 0.00 H new ATOM 0 HA TYR A 34 -6.741 -1.062 -17.615 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -4.583 0.939 -18.098 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -5.865 1.068 -19.286 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -8.309 1.271 -18.422 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -4.783 1.660 -15.999 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -9.665 2.286 -16.603 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -6.116 2.654 -14.188 1.00 0.00 H new ATOM 0 HH TYR A 34 -8.950 2.545 -13.621 1.00 0.00 H new ATOM 561 N PRO A 35 -5.101 -1.404 -20.468 1.00 0.00 N ATOM 562 CA PRO A 35 -4.995 -2.293 -21.623 1.00 0.00 C ATOM 563 C PRO A 35 -5.768 -3.606 -21.491 1.00 0.00 C ATOM 564 O PRO A 35 -6.450 -4.062 -22.410 1.00 0.00 O ATOM 565 CB PRO A 35 -3.490 -2.526 -21.658 1.00 0.00 C ATOM 566 CG PRO A 35 -2.973 -1.100 -21.457 1.00 0.00 C ATOM 567 CD PRO A 35 -3.890 -0.621 -20.332 1.00 0.00 C ATOM 0 HA PRO A 35 -5.429 -1.866 -22.527 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -3.158 -3.201 -20.869 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -3.160 -2.955 -22.604 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -1.921 -1.078 -21.171 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -3.071 -0.494 -22.357 1.00 0.00 H new ATOM 0 HD2 PRO A 35 -3.429 -0.775 -19.356 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -4.099 0.445 -20.421 1.00 0.00 H new ATOM 575 N THR A 36 -5.643 -4.183 -20.303 1.00 0.00 N ATOM 576 CA THR A 36 -6.218 -5.466 -19.871 1.00 0.00 C ATOM 577 C THR A 36 -7.442 -5.318 -18.945 1.00 0.00 C ATOM 578 O THR A 36 -8.214 -6.259 -18.762 1.00 0.00 O ATOM 579 CB THR A 36 -5.096 -6.288 -19.202 1.00 0.00 C ATOM 580 OG1 THR A 36 -3.936 -5.516 -18.962 1.00 0.00 O ATOM 581 CG2 THR A 36 -4.581 -7.350 -20.156 1.00 0.00 C ATOM 0 H THR A 36 -5.101 -3.743 -19.559 1.00 0.00 H new ATOM 0 HA THR A 36 -6.603 -5.983 -20.750 1.00 0.00 H new ATOM 0 HB THR A 36 -5.540 -6.677 -18.286 1.00 0.00 H new ATOM 0 HG1 THR A 36 -3.398 -5.943 -18.263 1.00 0.00 H new ATOM 0 HG21 THR A 36 -3.790 -7.922 -19.671 1.00 0.00 H new ATOM 0 HG22 THR A 36 -5.397 -8.019 -20.430 1.00 0.00 H new ATOM 0 HG23 THR A 36 -4.186 -6.873 -21.053 1.00 0.00 H new ATOM 589 N ASN A 37 -7.613 -4.131 -18.359 1.00 0.00 N ATOM 590 CA ASN A 37 -8.520 -3.711 -17.306 1.00 0.00 C ATOM 591 C ASN A 37 -8.696 -4.683 -16.141 1.00 0.00 C ATOM 592 O ASN A 37 -9.792 -4.940 -15.642 1.00 0.00 O ATOM 593 CB ASN A 37 -9.704 -2.909 -17.835 1.00 0.00 C ATOM 594 CG ASN A 37 -10.801 -3.716 -18.519 1.00 0.00 C ATOM 595 OD1 ASN A 37 -11.029 -3.608 -19.716 1.00 0.00 O ATOM 596 ND2 ASN A 37 -11.534 -4.533 -17.798 1.00 0.00 N ATOM 0 H ASN A 37 -7.038 -3.343 -18.658 1.00 0.00 H new ATOM 0 HA ASN A 37 -8.011 -2.949 -16.716 1.00 0.00 H new ATOM 0 HB2 ASN A 37 -10.147 -2.361 -17.004 1.00 0.00 H new ATOM 0 HB3 ASN A 37 -9.330 -2.168 -18.542 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -12.283 -5.068 -18.237 1.00 0.00 H new ATOM 0 HD22 ASN A 37 -11.354 -4.632 -16.799 1.00 0.00 H new ATOM 603 N THR A 38 -7.531 -5.048 -15.605 1.00 0.00 N ATOM 604 CA THR A 38 -7.345 -5.439 -14.207 1.00 0.00 C ATOM 605 C THR A 38 -6.571 -4.378 -13.396 1.00 0.00 C ATOM 606 O THR A 38 -6.491 -4.486 -12.175 1.00 0.00 O ATOM 607 CB THR A 38 -6.727 -6.840 -14.146 1.00 0.00 C ATOM 608 OG1 THR A 38 -7.334 -7.656 -15.120 1.00 0.00 O ATOM 609 CG2 THR A 38 -6.908 -7.528 -12.806 1.00 0.00 C ATOM 0 H THR A 38 -6.667 -5.081 -16.146 1.00 0.00 H new ATOM 0 HA THR A 38 -8.318 -5.489 -13.719 1.00 0.00 H new ATOM 0 HB THR A 38 -5.659 -6.707 -14.316 1.00 0.00 H new ATOM 0 HG1 THR A 38 -6.941 -8.553 -15.086 1.00 0.00 H new ATOM 0 HG21 THR A 38 -6.445 -8.514 -12.838 1.00 0.00 H new ATOM 0 HG22 THR A 38 -6.438 -6.932 -12.024 1.00 0.00 H new ATOM 0 HG23 THR A 38 -7.972 -7.633 -12.592 1.00 0.00 H new ATOM 617 N TYR A 39 -6.050 -3.328 -14.060 1.00 0.00 N ATOM 618 CA TYR A 39 -5.622 -2.004 -13.561 1.00 0.00 C ATOM 619 C TYR A 39 -5.715 -1.661 -12.055 1.00 0.00 C ATOM 620 O TYR A 39 -4.732 -1.180 -11.497 1.00 0.00 O ATOM 621 CB TYR A 39 -6.417 -0.936 -14.320 1.00 0.00 C ATOM 622 CG TYR A 39 -7.855 -0.751 -13.866 1.00 0.00 C ATOM 623 CD1 TYR A 39 -8.822 -1.721 -14.169 1.00 0.00 C ATOM 624 CD2 TYR A 39 -8.198 0.324 -13.032 1.00 0.00 C ATOM 625 CE1 TYR A 39 -10.131 -1.618 -13.673 1.00 0.00 C ATOM 626 CE2 TYR A 39 -9.513 0.456 -12.549 1.00 0.00 C ATOM 627 CZ TYR A 39 -10.488 -0.514 -12.868 1.00 0.00 C ATOM 628 OH TYR A 39 -11.751 -0.397 -12.372 1.00 0.00 O ATOM 0 H TYR A 39 -5.902 -3.392 -15.067 1.00 0.00 H new ATOM 0 HA TYR A 39 -4.546 -2.032 -13.735 1.00 0.00 H new ATOM 0 HB2 TYR A 39 -5.897 0.017 -14.223 1.00 0.00 H new ATOM 0 HB3 TYR A 39 -6.418 -1.192 -15.379 1.00 0.00 H new ATOM 0 HD1 TYR A 39 -8.555 -2.560 -14.794 1.00 0.00 H new ATOM 0 HD2 TYR A 39 -7.449 1.053 -12.760 1.00 0.00 H new ATOM 0 HE1 TYR A 39 -10.861 -2.379 -13.906 1.00 0.00 H new ATOM 0 HE2 TYR A 39 -9.777 1.302 -11.932 1.00 0.00 H new ATOM 0 HH TYR A 39 -11.819 0.423 -11.839 1.00 0.00 H new ATOM 638 N LYS A 40 -6.860 -1.869 -11.382 1.00 0.00 N ATOM 639 CA LYS A 40 -7.152 -1.424 -10.020 1.00 0.00 C ATOM 640 C LYS A 40 -6.213 -2.037 -8.994 1.00 0.00 C ATOM 641 O LYS A 40 -6.016 -1.452 -7.932 1.00 0.00 O ATOM 642 CB LYS A 40 -8.622 -1.768 -9.715 1.00 0.00 C ATOM 643 CG LYS A 40 -9.422 -0.562 -9.227 1.00 0.00 C ATOM 644 CD LYS A 40 -9.205 -0.228 -7.753 1.00 0.00 C ATOM 645 CE LYS A 40 -10.105 0.961 -7.419 1.00 0.00 C ATOM 646 NZ LYS A 40 -10.234 1.167 -5.955 1.00 0.00 N ATOM 0 H LYS A 40 -7.640 -2.377 -11.798 1.00 0.00 H new ATOM 0 HA LYS A 40 -6.994 -0.348 -9.953 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -9.090 -2.170 -10.613 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -8.658 -2.552 -8.959 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -9.154 0.306 -9.829 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -10.482 -0.751 -9.394 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -9.451 -1.084 -7.125 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -8.160 0.016 -7.564 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -9.699 1.863 -7.878 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -11.093 0.801 -7.851 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -10.906 1.940 -5.771 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -10.581 0.293 -5.511 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -9.306 1.413 -5.556 1.00 0.00 H new ATOM 660 N THR A 41 -5.651 -3.197 -9.357 1.00 0.00 N ATOM 661 CA THR A 41 -4.446 -3.804 -8.785 1.00 0.00 C ATOM 662 C THR A 41 -4.329 -3.573 -7.285 1.00 0.00 C ATOM 663 O THR A 41 -3.547 -2.767 -6.801 1.00 0.00 O ATOM 664 CB THR A 41 -3.170 -3.377 -9.520 1.00 0.00 C ATOM 665 OG1 THR A 41 -2.979 -1.981 -9.571 1.00 0.00 O ATOM 666 CG2 THR A 41 -3.137 -3.871 -10.968 1.00 0.00 C ATOM 0 H THR A 41 -6.050 -3.769 -10.101 1.00 0.00 H new ATOM 0 HA THR A 41 -4.556 -4.878 -8.932 1.00 0.00 H new ATOM 0 HB THR A 41 -2.376 -3.834 -8.929 1.00 0.00 H new ATOM 0 HG1 THR A 41 -3.502 -1.606 -10.310 1.00 0.00 H new ATOM 0 HG21 THR A 41 -2.213 -3.542 -11.444 1.00 0.00 H new ATOM 0 HG22 THR A 41 -3.185 -4.960 -10.982 1.00 0.00 H new ATOM 0 HG23 THR A 41 -3.990 -3.464 -11.511 1.00 0.00 H new ATOM 674 N LEU A 42 -5.175 -4.271 -6.539 1.00 0.00 N ATOM 675 CA LEU A 42 -5.357 -4.032 -5.092 1.00 0.00 C ATOM 676 C LEU A 42 -4.056 -4.070 -4.269 1.00 0.00 C ATOM 677 O LEU A 42 -3.988 -3.433 -3.230 1.00 0.00 O ATOM 678 CB LEU A 42 -6.407 -4.967 -4.464 1.00 0.00 C ATOM 679 CG LEU A 42 -7.850 -4.862 -4.938 1.00 0.00 C ATOM 680 CD1 LEU A 42 -8.347 -3.436 -4.876 1.00 0.00 C ATOM 681 CD2 LEU A 42 -8.117 -5.472 -6.302 1.00 0.00 C ATOM 0 H LEU A 42 -5.759 -5.021 -6.909 1.00 0.00 H new ATOM 0 HA LEU A 42 -5.726 -3.008 -5.044 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -6.078 -5.993 -4.629 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -6.399 -4.799 -3.387 1.00 0.00 H new ATOM 0 HG LEU A 42 -8.420 -5.470 -4.235 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -9.380 -3.395 -5.221 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -8.293 -3.076 -3.848 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -7.727 -2.806 -5.514 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -9.170 -5.350 -6.555 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -7.503 -4.972 -7.051 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -7.870 -6.533 -6.281 1.00 0.00 H new ATOM 693 N GLU A 43 -3.008 -4.743 -4.739 1.00 0.00 N ATOM 694 CA GLU A 43 -1.623 -4.597 -4.259 1.00 0.00 C ATOM 695 C GLU A 43 -1.112 -3.133 -4.186 1.00 0.00 C ATOM 696 O GLU A 43 -0.524 -2.747 -3.172 1.00 0.00 O ATOM 697 CB GLU A 43 -0.739 -5.551 -5.073 1.00 0.00 C ATOM 698 CG GLU A 43 -0.679 -5.234 -6.574 1.00 0.00 C ATOM 699 CD GLU A 43 -0.242 -6.482 -7.363 1.00 0.00 C ATOM 700 OE1 GLU A 43 0.974 -6.775 -7.443 1.00 0.00 O ATOM 701 OE2 GLU A 43 -1.141 -7.197 -7.872 1.00 0.00 O ATOM 0 H GLU A 43 -3.095 -5.429 -5.489 1.00 0.00 H new ATOM 0 HA GLU A 43 -1.578 -4.885 -3.209 1.00 0.00 H new ATOM 0 HB2 GLU A 43 0.272 -5.525 -4.668 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -1.108 -6.568 -4.943 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -1.656 -4.898 -6.922 1.00 0.00 H new ATOM 0 HG3 GLU A 43 0.021 -4.418 -6.753 1.00 0.00 H new ATOM 708 N LEU A 44 -1.423 -2.284 -5.178 1.00 0.00 N ATOM 709 CA LEU A 44 -1.317 -0.820 -5.100 1.00 0.00 C ATOM 710 C LEU A 44 -2.172 -0.270 -3.957 1.00 0.00 C ATOM 711 O LEU A 44 -1.656 0.443 -3.107 1.00 0.00 O ATOM 712 CB LEU A 44 -1.744 -0.176 -6.443 1.00 0.00 C ATOM 713 CG LEU A 44 -1.613 1.358 -6.576 1.00 0.00 C ATOM 714 CD1 LEU A 44 -2.810 2.142 -6.031 1.00 0.00 C ATOM 715 CD2 LEU A 44 -0.349 1.918 -5.934 1.00 0.00 C ATOM 0 H LEU A 44 -1.765 -2.608 -6.083 1.00 0.00 H new ATOM 0 HA LEU A 44 -0.276 -0.566 -4.902 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -1.154 -0.633 -7.237 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -2.785 -0.441 -6.626 1.00 0.00 H new ATOM 0 HG LEU A 44 -1.566 1.500 -7.656 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -2.636 3.210 -6.164 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -3.711 1.851 -6.570 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -2.936 1.924 -4.970 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -0.323 3.000 -6.065 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -0.346 1.681 -4.870 1.00 0.00 H new ATOM 0 HD23 LEU A 44 0.527 1.474 -6.407 1.00 0.00 H new ATOM 727 N GLU A 45 -3.472 -0.573 -3.934 1.00 0.00 N ATOM 728 CA GLU A 45 -4.414 -0.020 -2.943 1.00 0.00 C ATOM 729 C GLU A 45 -3.967 -0.291 -1.489 1.00 0.00 C ATOM 730 O GLU A 45 -3.965 0.607 -0.645 1.00 0.00 O ATOM 731 CB GLU A 45 -5.822 -0.564 -3.220 1.00 0.00 C ATOM 732 CG GLU A 45 -6.946 0.293 -2.637 1.00 0.00 C ATOM 733 CD GLU A 45 -7.175 1.580 -3.451 1.00 0.00 C ATOM 734 OE1 GLU A 45 -7.964 1.540 -4.426 1.00 0.00 O ATOM 735 OE2 GLU A 45 -6.588 2.635 -3.114 1.00 0.00 O ATOM 0 H GLU A 45 -3.908 -1.210 -4.601 1.00 0.00 H new ATOM 0 HA GLU A 45 -4.427 1.065 -3.049 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -5.963 -0.646 -4.298 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -5.898 -1.572 -2.811 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -7.868 -0.288 -2.611 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -6.705 0.554 -1.607 1.00 0.00 H new ATOM 742 N ILE A 46 -3.517 -1.521 -1.224 1.00 0.00 N ATOM 743 CA ILE A 46 -2.858 -1.965 0.018 1.00 0.00 C ATOM 744 C ILE A 46 -1.634 -1.104 0.334 1.00 0.00 C ATOM 745 O ILE A 46 -1.581 -0.483 1.397 1.00 0.00 O ATOM 746 CB ILE A 46 -2.451 -3.450 -0.107 1.00 0.00 C ATOM 747 CG1 ILE A 46 -3.705 -4.323 -0.195 1.00 0.00 C ATOM 748 CG2 ILE A 46 -1.563 -3.941 1.052 1.00 0.00 C ATOM 749 CD1 ILE A 46 -3.460 -5.673 -0.860 1.00 0.00 C ATOM 0 H ILE A 46 -3.605 -2.277 -1.903 1.00 0.00 H new ATOM 0 HA ILE A 46 -3.565 -1.854 0.840 1.00 0.00 H new ATOM 0 HB ILE A 46 -1.857 -3.535 -1.017 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -4.095 -4.487 0.809 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -4.473 -3.787 -0.752 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -1.315 -4.991 0.900 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -0.646 -3.352 1.083 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -2.099 -3.827 1.994 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -4.391 -6.239 -0.888 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -3.099 -5.518 -1.877 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -2.715 -6.229 -0.291 1.00 0.00 H new ATOM 761 N ALA A 47 -0.652 -1.068 -0.576 1.00 0.00 N ATOM 762 CA ALA A 47 0.600 -0.340 -0.380 1.00 0.00 C ATOM 763 C ALA A 47 0.362 1.161 -0.144 1.00 0.00 C ATOM 764 O ALA A 47 0.951 1.746 0.761 1.00 0.00 O ATOM 765 CB ALA A 47 1.511 -0.584 -1.591 1.00 0.00 C ATOM 0 H ALA A 47 -0.708 -1.548 -1.474 1.00 0.00 H new ATOM 0 HA ALA A 47 1.089 -0.713 0.520 1.00 0.00 H new ATOM 0 HB1 ALA A 47 2.449 -0.045 -1.455 1.00 0.00 H new ATOM 0 HB2 ALA A 47 1.716 -1.651 -1.683 1.00 0.00 H new ATOM 0 HB3 ALA A 47 1.017 -0.230 -2.496 1.00 0.00 H new ATOM 771 N GLU A 48 -0.525 1.771 -0.933 1.00 0.00 N ATOM 772 CA GLU A 48 -0.878 3.192 -0.870 1.00 0.00 C ATOM 773 C GLU A 48 -1.574 3.562 0.452 1.00 0.00 C ATOM 774 O GLU A 48 -1.301 4.616 1.032 1.00 0.00 O ATOM 775 CB GLU A 48 -1.765 3.537 -2.082 1.00 0.00 C ATOM 776 CG GLU A 48 -1.973 5.038 -2.322 1.00 0.00 C ATOM 777 CD GLU A 48 -0.748 5.696 -2.986 1.00 0.00 C ATOM 778 OE1 GLU A 48 0.325 5.778 -2.343 1.00 0.00 O ATOM 779 OE2 GLU A 48 -0.859 6.155 -4.149 1.00 0.00 O ATOM 0 H GLU A 48 -1.036 1.271 -1.660 1.00 0.00 H new ATOM 0 HA GLU A 48 0.039 3.781 -0.904 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -1.321 3.099 -2.976 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -2.739 3.067 -1.947 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -2.849 5.185 -2.953 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -2.178 5.531 -1.372 1.00 0.00 H new ATOM 786 N SER A 49 -2.452 2.692 0.958 1.00 0.00 N ATOM 787 CA SER A 49 -3.089 2.881 2.264 1.00 0.00 C ATOM 788 C SER A 49 -2.104 2.678 3.427 1.00 0.00 C ATOM 789 O SER A 49 -1.966 3.571 4.262 1.00 0.00 O ATOM 790 CB SER A 49 -4.326 1.996 2.362 1.00 0.00 C ATOM 791 OG SER A 49 -5.105 2.366 3.485 1.00 0.00 O ATOM 0 H SER A 49 -2.740 1.840 0.476 1.00 0.00 H new ATOM 0 HA SER A 49 -3.414 3.918 2.351 1.00 0.00 H new ATOM 0 HB2 SER A 49 -4.920 2.087 1.453 1.00 0.00 H new ATOM 0 HB3 SER A 49 -4.028 0.951 2.445 1.00 0.00 H new ATOM 0 HG SER A 49 -5.898 1.792 3.537 1.00 0.00 H new ATOM 797 N ASP A 50 -1.344 1.573 3.465 1.00 0.00 N ATOM 798 CA ASP A 50 -0.345 1.290 4.500 1.00 0.00 C ATOM 799 C ASP A 50 0.751 2.372 4.603 1.00 0.00 C ATOM 800 O ASP A 50 1.122 2.780 5.704 1.00 0.00 O ATOM 801 CB ASP A 50 0.310 -0.058 4.190 1.00 0.00 C ATOM 802 CG ASP A 50 1.215 -0.521 5.338 1.00 0.00 C ATOM 803 OD1 ASP A 50 0.673 -0.900 6.401 1.00 0.00 O ATOM 804 OD2 ASP A 50 2.458 -0.526 5.177 1.00 0.00 O ATOM 0 H ASP A 50 -1.410 0.838 2.761 1.00 0.00 H new ATOM 0 HA ASP A 50 -0.865 1.275 5.458 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -0.462 -0.806 4.010 1.00 0.00 H new ATOM 0 HB3 ASP A 50 0.895 0.023 3.274 1.00 0.00 H new ATOM 809 N VAL A 51 1.264 2.868 3.467 1.00 0.00 N ATOM 810 CA VAL A 51 2.319 3.896 3.451 1.00 0.00 C ATOM 811 C VAL A 51 1.826 5.214 4.048 1.00 0.00 C ATOM 812 O VAL A 51 2.573 5.944 4.697 1.00 0.00 O ATOM 813 CB VAL A 51 2.964 4.064 2.073 1.00 0.00 C ATOM 814 CG1 VAL A 51 2.062 4.748 1.073 1.00 0.00 C ATOM 815 CG2 VAL A 51 4.227 4.906 2.186 1.00 0.00 C ATOM 0 H VAL A 51 0.963 2.571 2.539 1.00 0.00 H new ATOM 0 HA VAL A 51 3.120 3.540 4.099 1.00 0.00 H new ATOM 0 HB VAL A 51 3.177 3.055 1.721 1.00 0.00 H new ATOM 0 HG11 VAL A 51 2.579 4.836 0.117 1.00 0.00 H new ATOM 0 HG12 VAL A 51 1.153 4.161 0.941 1.00 0.00 H new ATOM 0 HG13 VAL A 51 1.802 5.742 1.438 1.00 0.00 H new ATOM 0 HG21 VAL A 51 4.678 5.019 1.200 1.00 0.00 H new ATOM 0 HG22 VAL A 51 3.975 5.889 2.585 1.00 0.00 H new ATOM 0 HG23 VAL A 51 4.934 4.414 2.854 1.00 0.00 H new ATOM 825 N GLU A 52 0.538 5.511 3.888 1.00 0.00 N ATOM 826 CA GLU A 52 -0.080 6.709 4.443 1.00 0.00 C ATOM 827 C GLU A 52 -0.624 6.548 5.872 1.00 0.00 C ATOM 828 O GLU A 52 -0.927 7.553 6.519 1.00 0.00 O ATOM 829 CB GLU A 52 -1.106 7.253 3.439 1.00 0.00 C ATOM 830 CG GLU A 52 -0.365 7.939 2.286 1.00 0.00 C ATOM 831 CD GLU A 52 -1.255 8.533 1.178 1.00 0.00 C ATOM 832 OE1 GLU A 52 -2.453 8.829 1.405 1.00 0.00 O ATOM 833 OE2 GLU A 52 -0.711 8.752 0.066 1.00 0.00 O ATOM 0 H GLU A 52 -0.109 4.921 3.365 1.00 0.00 H new ATOM 0 HA GLU A 52 0.701 7.456 4.581 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -1.726 6.441 3.058 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -1.774 7.960 3.930 1.00 0.00 H new ATOM 0 HG2 GLU A 52 0.251 8.738 2.699 1.00 0.00 H new ATOM 0 HG3 GLU A 52 0.313 7.216 1.833 1.00 0.00 H new ATOM 840 N VAL A 53 -0.612 5.333 6.436 1.00 0.00 N ATOM 841 CA VAL A 53 -0.632 5.159 7.900 1.00 0.00 C ATOM 842 C VAL A 53 0.685 5.660 8.470 1.00 0.00 C ATOM 843 O VAL A 53 0.715 6.363 9.481 1.00 0.00 O ATOM 844 CB VAL A 53 -0.830 3.682 8.311 1.00 0.00 C ATOM 845 CG1 VAL A 53 -0.747 3.421 9.822 1.00 0.00 C ATOM 846 CG2 VAL A 53 -2.174 3.151 7.811 1.00 0.00 C ATOM 0 H VAL A 53 -0.589 4.460 5.908 1.00 0.00 H new ATOM 0 HA VAL A 53 -1.474 5.728 8.294 1.00 0.00 H new ATOM 0 HB VAL A 53 0.003 3.158 7.843 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -0.898 2.359 10.017 1.00 0.00 H new ATOM 0 HG12 VAL A 53 0.234 3.722 10.190 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -1.518 3.997 10.334 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -2.289 2.110 8.113 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -2.982 3.745 8.239 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -2.211 3.219 6.724 1.00 0.00 H new ATOM 856 N LYS A 54 1.784 5.333 7.782 1.00 0.00 N ATOM 857 CA LYS A 54 3.126 5.720 8.185 1.00 0.00 C ATOM 858 C LYS A 54 3.260 7.228 8.114 1.00 0.00 C ATOM 859 O LYS A 54 3.598 7.863 9.107 1.00 0.00 O ATOM 860 CB LYS A 54 4.138 4.972 7.304 1.00 0.00 C ATOM 861 CG LYS A 54 4.703 3.769 8.063 1.00 0.00 C ATOM 862 CD LYS A 54 3.687 2.623 8.197 1.00 0.00 C ATOM 863 CE LYS A 54 4.201 1.561 9.179 1.00 0.00 C ATOM 864 NZ LYS A 54 3.909 1.919 10.594 1.00 0.00 N ATOM 0 H LYS A 54 1.759 4.786 6.921 1.00 0.00 H new ATOM 0 HA LYS A 54 3.329 5.441 9.219 1.00 0.00 H new ATOM 0 HB2 LYS A 54 3.656 4.639 6.385 1.00 0.00 H new ATOM 0 HB3 LYS A 54 4.947 5.643 7.015 1.00 0.00 H new ATOM 0 HG2 LYS A 54 5.591 3.404 7.547 1.00 0.00 H new ATOM 0 HG3 LYS A 54 5.019 4.087 9.056 1.00 0.00 H new ATOM 0 HD2 LYS A 54 2.731 3.015 8.544 1.00 0.00 H new ATOM 0 HD3 LYS A 54 3.510 2.170 7.222 1.00 0.00 H new ATOM 0 HE2 LYS A 54 3.742 0.600 8.946 1.00 0.00 H new ATOM 0 HE3 LYS A 54 5.277 1.440 9.051 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 4.505 1.348 11.227 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 4.110 2.928 10.745 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 2.907 1.731 10.800 1.00 0.00 H new ATOM 878 N LYS A 55 2.869 7.814 6.983 1.00 0.00 N ATOM 879 CA LYS A 55 2.838 9.263 6.756 1.00 0.00 C ATOM 880 C LYS A 55 2.253 10.063 7.923 1.00 0.00 C ATOM 881 O LYS A 55 2.860 11.037 8.361 1.00 0.00 O ATOM 882 CB LYS A 55 2.055 9.521 5.455 1.00 0.00 C ATOM 883 CG LYS A 55 2.295 10.883 4.801 1.00 0.00 C ATOM 884 CD LYS A 55 3.792 11.068 4.513 1.00 0.00 C ATOM 885 CE LYS A 55 4.453 11.953 5.584 1.00 0.00 C ATOM 886 NZ LYS A 55 4.350 13.401 5.262 1.00 0.00 N ATOM 0 H LYS A 55 2.555 7.279 6.173 1.00 0.00 H new ATOM 0 HA LYS A 55 3.866 9.615 6.671 1.00 0.00 H new ATOM 0 HB2 LYS A 55 2.311 8.742 4.737 1.00 0.00 H new ATOM 0 HB3 LYS A 55 0.990 9.422 5.666 1.00 0.00 H new ATOM 0 HG2 LYS A 55 1.726 10.957 3.874 1.00 0.00 H new ATOM 0 HG3 LYS A 55 1.941 11.678 5.457 1.00 0.00 H new ATOM 0 HD2 LYS A 55 4.284 10.096 4.485 1.00 0.00 H new ATOM 0 HD3 LYS A 55 3.924 11.520 3.530 1.00 0.00 H new ATOM 0 HE2 LYS A 55 3.983 11.763 6.549 1.00 0.00 H new ATOM 0 HE3 LYS A 55 5.503 11.679 5.681 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 4.523 13.961 6.121 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 5.057 13.647 4.540 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 3.398 13.609 4.899 1.00 0.00 H new ATOM 900 N ALA A 56 1.105 9.634 8.439 1.00 0.00 N ATOM 901 CA ALA A 56 0.403 10.330 9.513 1.00 0.00 C ATOM 902 C ALA A 56 1.156 10.230 10.847 1.00 0.00 C ATOM 903 O ALA A 56 1.252 11.220 11.576 1.00 0.00 O ATOM 904 CB ALA A 56 -1.006 9.754 9.628 1.00 0.00 C ATOM 0 H ALA A 56 0.632 8.788 8.122 1.00 0.00 H new ATOM 0 HA ALA A 56 0.347 11.392 9.272 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -1.544 10.264 10.427 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -1.535 9.897 8.686 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -0.947 8.689 9.853 1.00 0.00 H new ATOM 910 N GLU A 57 1.717 9.058 11.169 1.00 0.00 N ATOM 911 CA GLU A 57 2.527 8.903 12.371 1.00 0.00 C ATOM 912 C GLU A 57 3.843 9.712 12.289 1.00 0.00 C ATOM 913 O GLU A 57 4.237 10.302 13.297 1.00 0.00 O ATOM 914 CB GLU A 57 2.681 7.407 12.710 1.00 0.00 C ATOM 915 CG GLU A 57 4.007 6.773 12.308 1.00 0.00 C ATOM 916 CD GLU A 57 4.059 5.269 12.634 1.00 0.00 C ATOM 917 OE1 GLU A 57 4.176 4.905 13.830 1.00 0.00 O ATOM 918 OE2 GLU A 57 4.008 4.439 11.694 1.00 0.00 O ATOM 0 H GLU A 57 1.622 8.209 10.612 1.00 0.00 H new ATOM 0 HA GLU A 57 2.014 9.346 13.225 1.00 0.00 H new ATOM 0 HB2 GLU A 57 2.550 7.281 13.785 1.00 0.00 H new ATOM 0 HB3 GLU A 57 1.874 6.858 12.224 1.00 0.00 H new ATOM 0 HG2 GLU A 57 4.166 6.916 11.239 1.00 0.00 H new ATOM 0 HG3 GLU A 57 4.822 7.282 12.823 1.00 0.00 H new ATOM 925 N LEU A 58 4.489 9.821 11.110 1.00 0.00 N ATOM 926 CA LEU A 58 5.701 10.641 10.946 1.00 0.00 C ATOM 927 C LEU A 58 5.422 12.121 11.260 1.00 0.00 C ATOM 928 O LEU A 58 6.173 12.744 12.009 1.00 0.00 O ATOM 929 CB LEU A 58 6.352 10.533 9.545 1.00 0.00 C ATOM 930 CG LEU A 58 6.492 9.173 8.841 1.00 0.00 C ATOM 931 CD1 LEU A 58 7.542 9.333 7.752 1.00 0.00 C ATOM 932 CD2 LEU A 58 6.896 8.041 9.781 1.00 0.00 C ATOM 0 H LEU A 58 4.188 9.349 10.257 1.00 0.00 H new ATOM 0 HA LEU A 58 6.412 10.232 11.664 1.00 0.00 H new ATOM 0 HB2 LEU A 58 5.784 11.181 8.878 1.00 0.00 H new ATOM 0 HB3 LEU A 58 7.353 10.956 9.624 1.00 0.00 H new ATOM 0 HG LEU A 58 5.519 8.894 8.438 1.00 0.00 H new ATOM 0 HD11 LEU A 58 7.670 8.386 7.228 1.00 0.00 H new ATOM 0 HD12 LEU A 58 7.220 10.098 7.045 1.00 0.00 H new ATOM 0 HD13 LEU A 58 8.490 9.630 8.201 1.00 0.00 H new ATOM 0 HD21 LEU A 58 6.976 7.111 9.218 1.00 0.00 H new ATOM 0 HD22 LEU A 58 7.858 8.273 10.237 1.00 0.00 H new ATOM 0 HD23 LEU A 58 6.142 7.929 10.561 1.00 0.00 H new ATOM 944 N GLU A 59 4.333 12.688 10.728 1.00 0.00 N ATOM 945 CA GLU A 59 3.950 14.077 10.998 1.00 0.00 C ATOM 946 C GLU A 59 3.797 14.361 12.501 1.00 0.00 C ATOM 947 O GLU A 59 4.307 15.371 12.987 1.00 0.00 O ATOM 948 CB GLU A 59 2.658 14.440 10.249 1.00 0.00 C ATOM 949 CG GLU A 59 2.791 14.518 8.720 1.00 0.00 C ATOM 950 CD GLU A 59 3.860 15.514 8.239 1.00 0.00 C ATOM 951 OE1 GLU A 59 3.845 16.697 8.654 1.00 0.00 O ATOM 952 OE2 GLU A 59 4.727 15.113 7.426 1.00 0.00 O ATOM 0 H GLU A 59 3.695 12.198 10.101 1.00 0.00 H new ATOM 0 HA GLU A 59 4.761 14.706 10.632 1.00 0.00 H new ATOM 0 HB2 GLU A 59 1.894 13.702 10.495 1.00 0.00 H new ATOM 0 HB3 GLU A 59 2.301 15.402 10.617 1.00 0.00 H new ATOM 0 HG2 GLU A 59 3.032 13.527 8.335 1.00 0.00 H new ATOM 0 HG3 GLU A 59 1.828 14.800 8.295 1.00 0.00 H new ATOM 959 N LEU A 60 3.148 13.471 13.261 1.00 0.00 N ATOM 960 CA LEU A 60 2.977 13.666 14.704 1.00 0.00 C ATOM 961 C LEU A 60 4.251 13.395 15.532 1.00 0.00 C ATOM 962 O LEU A 60 4.360 13.946 16.629 1.00 0.00 O ATOM 963 CB LEU A 60 1.739 12.904 15.220 1.00 0.00 C ATOM 964 CG LEU A 60 0.762 13.747 16.077 1.00 0.00 C ATOM 965 CD1 LEU A 60 1.381 14.510 17.251 1.00 0.00 C ATOM 966 CD2 LEU A 60 -0.013 14.747 15.215 1.00 0.00 C ATOM 0 H LEU A 60 2.734 12.611 12.901 1.00 0.00 H new ATOM 0 HA LEU A 60 2.792 14.730 14.854 1.00 0.00 H new ATOM 0 HB2 LEU A 60 1.195 12.503 14.365 1.00 0.00 H new ATOM 0 HB3 LEU A 60 2.075 12.052 15.811 1.00 0.00 H new ATOM 0 HG LEU A 60 0.105 12.993 16.511 1.00 0.00 H new ATOM 0 HD11 LEU A 60 0.602 15.063 17.777 1.00 0.00 H new ATOM 0 HD12 LEU A 60 1.851 13.804 17.936 1.00 0.00 H new ATOM 0 HD13 LEU A 60 2.131 15.207 16.877 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -0.690 15.323 15.846 1.00 0.00 H new ATOM 0 HD22 LEU A 60 0.687 15.422 14.723 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -0.589 14.209 14.462 1.00 0.00 H new ATOM 978 N VAL A 61 5.256 12.642 15.043 1.00 0.00 N ATOM 979 CA VAL A 61 6.558 12.565 15.742 1.00 0.00 C ATOM 980 C VAL A 61 7.199 13.953 15.857 1.00 0.00 C ATOM 981 O VAL A 61 7.715 14.288 16.931 1.00 0.00 O ATOM 982 CB VAL A 61 7.489 11.524 15.081 1.00 0.00 C ATOM 983 CG1 VAL A 61 8.961 11.615 15.510 1.00 0.00 C ATOM 984 CG2 VAL A 61 7.013 10.106 15.422 1.00 0.00 C ATOM 0 H VAL A 61 5.197 12.090 14.187 1.00 0.00 H new ATOM 0 HA VAL A 61 6.384 12.215 16.760 1.00 0.00 H new ATOM 0 HB VAL A 61 7.437 11.744 14.015 1.00 0.00 H new ATOM 0 HG11 VAL A 61 9.538 10.846 14.996 1.00 0.00 H new ATOM 0 HG12 VAL A 61 9.355 12.598 15.252 1.00 0.00 H new ATOM 0 HG13 VAL A 61 9.036 11.465 16.587 1.00 0.00 H new ATOM 0 HG21 VAL A 61 7.674 9.378 14.953 1.00 0.00 H new ATOM 0 HG22 VAL A 61 7.029 9.967 16.503 1.00 0.00 H new ATOM 0 HG23 VAL A 61 5.997 9.965 15.053 1.00 0.00 H new ATOM 994 N LYS A 62 7.076 14.791 14.811 1.00 0.00 N ATOM 995 CA LYS A 62 7.387 16.233 14.883 1.00 0.00 C ATOM 996 C LYS A 62 6.529 16.936 15.924 1.00 0.00 C ATOM 997 O LYS A 62 7.055 17.559 16.844 1.00 0.00 O ATOM 998 CB LYS A 62 7.178 16.978 13.556 1.00 0.00 C ATOM 999 CG LYS A 62 7.833 16.280 12.375 1.00 0.00 C ATOM 1000 CD LYS A 62 7.805 17.157 11.123 1.00 0.00 C ATOM 1001 CE LYS A 62 6.364 17.303 10.616 1.00 0.00 C ATOM 1002 NZ LYS A 62 6.286 17.881 9.252 1.00 0.00 N ATOM 0 H LYS A 62 6.758 14.488 13.890 1.00 0.00 H new ATOM 0 HA LYS A 62 8.444 16.267 15.148 1.00 0.00 H new ATOM 0 HB2 LYS A 62 6.109 17.077 13.366 1.00 0.00 H new ATOM 0 HB3 LYS A 62 7.581 17.987 13.644 1.00 0.00 H new ATOM 0 HG2 LYS A 62 8.865 16.031 12.624 1.00 0.00 H new ATOM 0 HG3 LYS A 62 7.318 15.340 12.174 1.00 0.00 H new ATOM 0 HD2 LYS A 62 8.221 18.139 11.348 1.00 0.00 H new ATOM 0 HD3 LYS A 62 8.430 16.716 10.346 1.00 0.00 H new ATOM 0 HE2 LYS A 62 5.883 16.325 10.618 1.00 0.00 H new ATOM 0 HE3 LYS A 62 5.804 17.935 11.305 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 5.408 17.567 8.792 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 6.292 18.919 9.314 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 7.103 17.563 8.693 1.00 0.00 H new ATOM 1016 N GLU A 63 5.204 16.868 15.761 1.00 0.00 N ATOM 1017 CA GLU A 63 4.298 17.863 16.334 1.00 0.00 C ATOM 1018 C GLU A 63 4.116 17.685 17.844 1.00 0.00 C ATOM 1019 O GLU A 63 3.604 18.588 18.505 1.00 0.00 O ATOM 1020 CB GLU A 63 2.963 17.860 15.573 1.00 0.00 C ATOM 1021 CG GLU A 63 3.054 18.477 14.169 1.00 0.00 C ATOM 1022 CD GLU A 63 3.336 19.991 14.214 1.00 0.00 C ATOM 1023 OE1 GLU A 63 2.377 20.787 14.371 1.00 0.00 O ATOM 1024 OE2 GLU A 63 4.516 20.396 14.085 1.00 0.00 O ATOM 0 H GLU A 63 4.736 16.131 15.235 1.00 0.00 H new ATOM 0 HA GLU A 63 4.752 18.847 16.212 1.00 0.00 H new ATOM 0 HB2 GLU A 63 2.606 16.834 15.487 1.00 0.00 H new ATOM 0 HB3 GLU A 63 2.222 18.408 16.154 1.00 0.00 H new ATOM 0 HG2 GLU A 63 3.843 17.979 13.606 1.00 0.00 H new ATOM 0 HG3 GLU A 63 2.121 18.299 13.635 1.00 0.00 H new ATOM 1031 N GLU A 64 4.607 16.573 18.407 1.00 0.00 N ATOM 1032 CA GLU A 64 4.707 16.388 19.851 1.00 0.00 C ATOM 1033 C GLU A 64 6.111 16.489 20.450 1.00 0.00 C ATOM 1034 O GLU A 64 6.222 16.748 21.643 1.00 0.00 O ATOM 1035 CB GLU A 64 4.011 15.091 20.269 1.00 0.00 C ATOM 1036 CG GLU A 64 2.777 15.423 21.102 1.00 0.00 C ATOM 1037 CD GLU A 64 2.613 14.420 22.244 1.00 0.00 C ATOM 1038 OE1 GLU A 64 3.189 14.684 23.324 1.00 0.00 O ATOM 1039 OE2 GLU A 64 1.953 13.373 22.066 1.00 0.00 O ATOM 0 H GLU A 64 4.946 15.777 17.867 1.00 0.00 H new ATOM 0 HA GLU A 64 4.189 17.247 20.277 1.00 0.00 H new ATOM 0 HB2 GLU A 64 3.724 14.519 19.387 1.00 0.00 H new ATOM 0 HB3 GLU A 64 4.695 14.468 20.845 1.00 0.00 H new ATOM 0 HG2 GLU A 64 2.865 16.431 21.506 1.00 0.00 H new ATOM 0 HG3 GLU A 64 1.890 15.410 20.469 1.00 0.00 H new ATOM 1046 N ALA A 65 7.195 16.330 19.681 1.00 0.00 N ATOM 1047 CA ALA A 65 8.546 16.683 20.164 1.00 0.00 C ATOM 1048 C ALA A 65 8.751 18.205 20.323 1.00 0.00 C ATOM 1049 O ALA A 65 9.666 18.675 21.001 1.00 0.00 O ATOM 1050 CB ALA A 65 9.554 16.084 19.204 1.00 0.00 C ATOM 0 H ALA A 65 7.170 15.963 18.730 1.00 0.00 H new ATOM 0 HA ALA A 65 8.682 16.273 21.165 1.00 0.00 H new ATOM 0 HB1 ALA A 65 10.563 16.329 19.536 1.00 0.00 H new ATOM 0 HB2 ALA A 65 9.433 15.001 19.179 1.00 0.00 H new ATOM 0 HB3 ALA A 65 9.392 16.491 18.206 1.00 0.00 H new ATOM 1056 N LYS A 66 7.842 18.957 19.704 1.00 0.00 N ATOM 1057 CA LYS A 66 7.611 20.403 19.731 1.00 0.00 C ATOM 1058 C LYS A 66 7.145 20.975 21.081 1.00 0.00 C ATOM 1059 O LYS A 66 6.790 22.149 21.175 1.00 0.00 O ATOM 1060 CB LYS A 66 6.512 20.624 18.669 1.00 0.00 C ATOM 1061 CG LYS A 66 6.996 21.438 17.489 1.00 0.00 C ATOM 1062 CD LYS A 66 8.146 20.842 16.671 1.00 0.00 C ATOM 1063 CE LYS A 66 8.430 21.734 15.457 1.00 0.00 C ATOM 1064 NZ LYS A 66 9.704 21.366 14.793 1.00 0.00 N ATOM 0 H LYS A 66 7.161 18.508 19.092 1.00 0.00 H new ATOM 0 HA LYS A 66 8.551 20.921 19.543 1.00 0.00 H new ATOM 0 HB2 LYS A 66 6.154 19.657 18.316 1.00 0.00 H new ATOM 0 HB3 LYS A 66 5.663 21.129 19.130 1.00 0.00 H new ATOM 0 HG2 LYS A 66 6.152 21.603 16.820 1.00 0.00 H new ATOM 0 HG3 LYS A 66 7.309 22.416 17.855 1.00 0.00 H new ATOM 0 HD2 LYS A 66 9.040 20.757 17.289 1.00 0.00 H new ATOM 0 HD3 LYS A 66 7.888 19.835 16.343 1.00 0.00 H new ATOM 0 HE2 LYS A 66 7.610 21.650 14.744 1.00 0.00 H new ATOM 0 HE3 LYS A 66 8.472 22.776 15.773 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 9.931 22.071 14.063 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 10.468 21.339 15.498 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 9.607 20.429 14.351 1.00 0.00 H new ATOM 1078 N GLU A 67 7.030 20.131 22.096 1.00 0.00 N ATOM 1079 CA GLU A 67 5.874 19.966 22.919 1.00 0.00 C ATOM 1080 C GLU A 67 6.261 18.949 23.924 1.00 0.00 C ATOM 1081 O GLU A 67 7.383 18.415 23.908 1.00 0.00 O ATOM 1082 CB GLU A 67 4.760 19.335 22.090 1.00 0.00 C ATOM 1083 CG GLU A 67 3.594 20.208 21.709 1.00 0.00 C ATOM 1084 CD GLU A 67 3.016 21.168 22.772 1.00 0.00 C ATOM 1085 OE1 GLU A 67 3.645 22.209 23.075 1.00 0.00 O ATOM 1086 OE2 GLU A 67 1.896 20.911 23.276 1.00 0.00 O ATOM 0 H GLU A 67 7.794 19.514 22.371 1.00 0.00 H new ATOM 0 HA GLU A 67 5.546 20.915 23.344 1.00 0.00 H new ATOM 0 HB2 GLU A 67 5.203 18.947 21.173 1.00 0.00 H new ATOM 0 HB3 GLU A 67 4.372 18.480 22.644 1.00 0.00 H new ATOM 0 HG2 GLU A 67 3.895 20.807 20.849 1.00 0.00 H new ATOM 0 HG3 GLU A 67 2.786 19.556 21.376 1.00 0.00 H new ATOM 1093 N PRO A 68 5.354 18.725 24.878 1.00 0.00 N ATOM 1094 CA PRO A 68 5.863 18.362 26.152 1.00 0.00 C ATOM 1095 C PRO A 68 6.301 16.925 26.280 1.00 0.00 C ATOM 1096 O PRO A 68 6.666 16.423 27.348 1.00 0.00 O ATOM 1097 CB PRO A 68 4.749 18.677 27.118 1.00 0.00 C ATOM 1098 CG PRO A 68 3.566 18.356 26.228 1.00 0.00 C ATOM 1099 CD PRO A 68 3.965 19.113 25.013 1.00 0.00 C ATOM 0 HA PRO A 68 6.780 18.917 26.348 1.00 0.00 H new ATOM 0 HB2 PRO A 68 4.782 18.058 28.015 1.00 0.00 H new ATOM 0 HB3 PRO A 68 4.758 19.716 27.447 1.00 0.00 H new ATOM 0 HG2 PRO A 68 3.460 17.288 26.040 1.00 0.00 H new ATOM 0 HG3 PRO A 68 2.621 18.702 26.646 1.00 0.00 H new ATOM 0 HD2 PRO A 68 3.374 18.832 24.142 1.00 0.00 H new ATOM 0 HD3 PRO A 68 3.850 20.189 25.143 1.00 0.00 H new ATOM 1107 N ARG A 69 6.147 16.271 25.144 1.00 0.00 N ATOM 1108 CA ARG A 69 6.172 14.876 24.927 1.00 0.00 C ATOM 1109 C ARG A 69 5.363 14.151 25.981 1.00 0.00 C ATOM 1110 O ARG A 69 5.797 13.227 26.669 1.00 0.00 O ATOM 1111 CB ARG A 69 7.648 14.570 24.726 1.00 0.00 C ATOM 1112 CG ARG A 69 8.012 14.602 23.247 1.00 0.00 C ATOM 1113 CD ARG A 69 7.027 13.814 22.372 1.00 0.00 C ATOM 1114 NE ARG A 69 7.509 13.587 20.998 1.00 0.00 N ATOM 1115 CZ ARG A 69 8.156 12.541 20.517 1.00 0.00 C ATOM 1116 NH1 ARG A 69 8.542 11.556 21.276 1.00 0.00 N ATOM 1117 NH2 ARG A 69 8.433 12.465 19.245 1.00 0.00 N ATOM 0 H ARG A 69 5.986 16.777 24.273 1.00 0.00 H new ATOM 0 HA ARG A 69 5.657 14.497 24.044 1.00 0.00 H new ATOM 0 HB2 ARG A 69 8.252 15.297 25.269 1.00 0.00 H new ATOM 0 HB3 ARG A 69 7.880 13.589 25.141 1.00 0.00 H new ATOM 0 HG2 ARG A 69 8.043 15.637 22.908 1.00 0.00 H new ATOM 0 HG3 ARG A 69 9.014 14.193 23.116 1.00 0.00 H new ATOM 0 HD2 ARG A 69 6.827 12.851 22.842 1.00 0.00 H new ATOM 0 HD3 ARG A 69 6.080 14.352 22.332 1.00 0.00 H new ATOM 0 HE ARG A 69 7.318 14.335 20.332 1.00 0.00 H new ATOM 0 HH11 ARG A 69 8.347 11.577 22.277 1.00 0.00 H new ATOM 0 HH12 ARG A 69 9.040 10.764 20.870 1.00 0.00 H new ATOM 0 HH21 ARG A 69 8.150 13.216 18.616 1.00 0.00 H new ATOM 0 HH22 ARG A 69 8.933 11.655 18.879 1.00 0.00 H new ATOM 1131 N ASN A 70 4.136 14.657 26.046 1.00 0.00 N ATOM 1132 CA ASN A 70 3.054 14.084 26.833 1.00 0.00 C ATOM 1133 C ASN A 70 2.592 12.734 26.273 1.00 0.00 C ATOM 1134 O ASN A 70 2.023 11.919 27.000 1.00 0.00 O ATOM 1135 CB ASN A 70 1.891 15.088 26.936 1.00 0.00 C ATOM 1136 CG ASN A 70 0.721 14.526 27.733 1.00 0.00 C ATOM 1137 OD1 ASN A 70 0.810 14.297 28.932 1.00 0.00 O ATOM 1138 ND2 ASN A 70 -0.397 14.272 27.091 1.00 0.00 N ATOM 0 H ASN A 70 3.861 15.498 25.539 1.00 0.00 H new ATOM 0 HA ASN A 70 3.429 13.887 27.837 1.00 0.00 H new ATOM 0 HB2 ASN A 70 2.244 16.005 27.408 1.00 0.00 H new ATOM 0 HB3 ASN A 70 1.553 15.355 25.935 1.00 0.00 H new ATOM 0 HD21 ASN A 70 -1.196 13.882 27.592 1.00 0.00 H new ATOM 0 HD22 ASN A 70 -0.466 14.465 26.092 1.00 0.00 H new ATOM 1145 N GLU A 71 2.885 12.485 24.997 1.00 0.00 N ATOM 1146 CA GLU A 71 2.990 11.186 24.364 1.00 0.00 C ATOM 1147 C GLU A 71 1.632 10.558 23.997 1.00 0.00 C ATOM 1148 O GLU A 71 1.550 9.707 23.114 1.00 0.00 O ATOM 1149 CB GLU A 71 3.927 10.333 25.233 1.00 0.00 C ATOM 1150 CG GLU A 71 4.558 9.229 24.414 1.00 0.00 C ATOM 1151 CD GLU A 71 5.434 8.302 25.278 1.00 0.00 C ATOM 1152 OE1 GLU A 71 4.893 7.368 25.919 1.00 0.00 O ATOM 1153 OE2 GLU A 71 6.675 8.491 25.313 1.00 0.00 O ATOM 0 H GLU A 71 3.066 13.243 24.339 1.00 0.00 H new ATOM 0 HA GLU A 71 3.436 11.272 23.373 1.00 0.00 H new ATOM 0 HB2 GLU A 71 4.705 10.963 25.664 1.00 0.00 H new ATOM 0 HB3 GLU A 71 3.369 9.902 26.064 1.00 0.00 H new ATOM 0 HG2 GLU A 71 3.776 8.643 23.931 1.00 0.00 H new ATOM 0 HG3 GLU A 71 5.165 9.666 23.621 1.00 0.00 H new ATOM 1160 N GLU A 72 0.531 11.029 24.584 1.00 0.00 N ATOM 1161 CA GLU A 72 -0.823 10.628 24.218 1.00 0.00 C ATOM 1162 C GLU A 72 -1.193 11.073 22.798 1.00 0.00 C ATOM 1163 O GLU A 72 -1.935 10.367 22.115 1.00 0.00 O ATOM 1164 CB GLU A 72 -1.818 11.222 25.225 1.00 0.00 C ATOM 1165 CG GLU A 72 -1.705 10.579 26.611 1.00 0.00 C ATOM 1166 CD GLU A 72 -2.637 11.276 27.622 1.00 0.00 C ATOM 1167 OE1 GLU A 72 -2.355 12.434 28.017 1.00 0.00 O ATOM 1168 OE2 GLU A 72 -3.659 10.670 28.031 1.00 0.00 O ATOM 0 H GLU A 72 0.559 11.712 25.341 1.00 0.00 H new ATOM 0 HA GLU A 72 -0.867 9.539 24.240 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -1.646 12.295 25.311 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -2.833 11.091 24.849 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -1.959 9.521 26.547 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -0.674 10.639 26.960 1.00 0.00 H new ATOM 1175 N LYS A 73 -0.710 12.238 22.338 1.00 0.00 N ATOM 1176 CA LYS A 73 -1.200 12.862 21.099 1.00 0.00 C ATOM 1177 C LYS A 73 -0.538 12.282 19.847 1.00 0.00 C ATOM 1178 O LYS A 73 -1.218 12.039 18.851 1.00 0.00 O ATOM 1179 CB LYS A 73 -1.090 14.394 21.135 1.00 0.00 C ATOM 1180 CG LYS A 73 -1.385 15.091 22.474 1.00 0.00 C ATOM 1181 CD LYS A 73 -2.674 14.710 23.219 1.00 0.00 C ATOM 1182 CE LYS A 73 -3.934 14.610 22.353 1.00 0.00 C ATOM 1183 NZ LYS A 73 -4.330 15.919 21.764 1.00 0.00 N ATOM 0 H LYS A 73 0.023 12.769 22.808 1.00 0.00 H new ATOM 0 HA LYS A 73 -2.260 12.616 21.039 1.00 0.00 H new ATOM 0 HB2 LYS A 73 -0.080 14.667 20.828 1.00 0.00 H new ATOM 0 HB3 LYS A 73 -1.771 14.799 20.387 1.00 0.00 H new ATOM 0 HG2 LYS A 73 -0.545 14.900 23.142 1.00 0.00 H new ATOM 0 HG3 LYS A 73 -1.410 16.165 22.292 1.00 0.00 H new ATOM 0 HD2 LYS A 73 -2.517 13.751 23.713 1.00 0.00 H new ATOM 0 HD3 LYS A 73 -2.851 15.447 24.003 1.00 0.00 H new ATOM 0 HE2 LYS A 73 -3.763 13.892 21.551 1.00 0.00 H new ATOM 0 HE3 LYS A 73 -4.755 14.224 22.957 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 -5.187 15.795 21.188 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 -4.521 16.600 22.527 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 -3.559 16.278 21.165 1.00 0.00 H new ATOM 1197 N VAL A 74 0.762 11.986 19.904 1.00 0.00 N ATOM 1198 CA VAL A 74 1.468 11.222 18.857 1.00 0.00 C ATOM 1199 C VAL A 74 0.821 9.845 18.640 1.00 0.00 C ATOM 1200 O VAL A 74 0.586 9.438 17.500 1.00 0.00 O ATOM 1201 CB VAL A 74 2.992 11.175 19.079 1.00 0.00 C ATOM 1202 CG1 VAL A 74 3.349 10.524 20.401 1.00 0.00 C ATOM 1203 CG2 VAL A 74 3.751 10.445 17.966 1.00 0.00 C ATOM 0 H VAL A 74 1.363 12.268 20.678 1.00 0.00 H new ATOM 0 HA VAL A 74 1.350 11.761 17.917 1.00 0.00 H new ATOM 0 HB VAL A 74 3.300 12.220 19.077 1.00 0.00 H new ATOM 0 HG11 VAL A 74 4.433 10.511 20.519 1.00 0.00 H new ATOM 0 HG12 VAL A 74 2.902 11.090 21.218 1.00 0.00 H new ATOM 0 HG13 VAL A 74 2.970 9.502 20.418 1.00 0.00 H new ATOM 0 HG21 VAL A 74 4.818 10.451 18.189 1.00 0.00 H new ATOM 0 HG22 VAL A 74 3.400 9.415 17.901 1.00 0.00 H new ATOM 0 HG23 VAL A 74 3.576 10.949 17.015 1.00 0.00 H new ATOM 1213 N LYS A 75 0.443 9.156 19.727 1.00 0.00 N ATOM 1214 CA LYS A 75 -0.256 7.859 19.685 1.00 0.00 C ATOM 1215 C LYS A 75 -1.703 7.961 19.213 1.00 0.00 C ATOM 1216 O LYS A 75 -2.135 7.144 18.405 1.00 0.00 O ATOM 1217 CB LYS A 75 -0.184 7.200 21.069 1.00 0.00 C ATOM 1218 CG LYS A 75 1.258 6.865 21.485 1.00 0.00 C ATOM 1219 CD LYS A 75 2.079 6.035 20.487 1.00 0.00 C ATOM 1220 CE LYS A 75 1.339 4.777 20.022 1.00 0.00 C ATOM 1221 NZ LYS A 75 2.252 3.865 19.280 1.00 0.00 N ATOM 0 H LYS A 75 0.616 9.488 20.676 1.00 0.00 H new ATOM 0 HA LYS A 75 0.254 7.242 18.945 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -0.627 7.866 21.809 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -0.779 6.287 21.065 1.00 0.00 H new ATOM 0 HG2 LYS A 75 1.787 7.800 21.669 1.00 0.00 H new ATOM 0 HG3 LYS A 75 1.224 6.326 22.432 1.00 0.00 H new ATOM 0 HD2 LYS A 75 2.322 6.651 19.621 1.00 0.00 H new ATOM 0 HD3 LYS A 75 3.023 5.747 20.949 1.00 0.00 H new ATOM 0 HE2 LYS A 75 0.921 4.257 20.884 1.00 0.00 H new ATOM 0 HE3 LYS A 75 0.502 5.058 19.383 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 1.727 3.020 18.976 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 2.631 4.357 18.445 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 3.037 3.580 19.900 1.00 0.00 H new ATOM 1235 N GLN A 76 -2.435 8.982 19.652 1.00 0.00 N ATOM 1236 CA GLN A 76 -3.781 9.301 19.167 1.00 0.00 C ATOM 1237 C GLN A 76 -3.829 9.482 17.646 1.00 0.00 C ATOM 1238 O GLN A 76 -4.787 9.039 17.007 1.00 0.00 O ATOM 1239 CB GLN A 76 -4.254 10.588 19.851 1.00 0.00 C ATOM 1240 CG GLN A 76 -5.631 11.072 19.368 1.00 0.00 C ATOM 1241 CD GLN A 76 -6.772 10.107 19.686 1.00 0.00 C ATOM 1242 OE1 GLN A 76 -7.343 10.106 20.769 1.00 0.00 O ATOM 1243 NE2 GLN A 76 -7.152 9.256 18.757 1.00 0.00 N ATOM 0 H GLN A 76 -2.104 9.626 20.370 1.00 0.00 H new ATOM 0 HA GLN A 76 -4.435 8.464 19.410 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -4.293 10.424 20.928 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -3.520 11.374 19.675 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -5.847 12.038 19.825 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -5.592 11.231 18.290 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -6.684 9.248 17.851 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -7.915 8.605 18.943 1.00 0.00 H new ATOM 1252 N ALA A 77 -2.812 10.118 17.060 1.00 0.00 N ATOM 1253 CA ALA A 77 -2.771 10.308 15.608 1.00 0.00 C ATOM 1254 C ALA A 77 -2.676 8.946 14.915 1.00 0.00 C ATOM 1255 O ALA A 77 -3.457 8.646 14.008 1.00 0.00 O ATOM 1256 CB ALA A 77 -1.622 11.241 15.231 1.00 0.00 C ATOM 0 H ALA A 77 -2.014 10.507 17.562 1.00 0.00 H new ATOM 0 HA ALA A 77 -3.690 10.785 15.267 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -1.602 11.375 14.149 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -1.765 12.208 15.713 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -0.678 10.807 15.561 1.00 0.00 H new ATOM 1262 N LYS A 78 -1.796 8.075 15.429 1.00 0.00 N ATOM 1263 CA LYS A 78 -1.722 6.676 15.016 1.00 0.00 C ATOM 1264 C LYS A 78 -3.003 5.876 15.280 1.00 0.00 C ATOM 1265 O LYS A 78 -3.209 4.894 14.582 1.00 0.00 O ATOM 1266 CB LYS A 78 -0.493 5.981 15.620 1.00 0.00 C ATOM 1267 CG LYS A 78 0.005 4.853 14.691 1.00 0.00 C ATOM 1268 CD LYS A 78 0.267 3.522 15.406 1.00 0.00 C ATOM 1269 CE LYS A 78 -1.059 2.853 15.799 1.00 0.00 C ATOM 1270 NZ LYS A 78 -0.861 1.475 16.319 1.00 0.00 N ATOM 0 H LYS A 78 -1.115 8.327 16.145 1.00 0.00 H new ATOM 0 HA LYS A 78 -1.612 6.697 13.932 1.00 0.00 H new ATOM 0 HB2 LYS A 78 0.303 6.709 15.776 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -0.745 5.570 16.598 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -0.733 4.692 13.905 1.00 0.00 H new ATOM 0 HG3 LYS A 78 0.924 5.178 14.203 1.00 0.00 H new ATOM 0 HD2 LYS A 78 0.837 2.859 14.755 1.00 0.00 H new ATOM 0 HD3 LYS A 78 0.873 3.693 16.296 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -1.558 3.457 16.557 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -1.719 2.821 14.932 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -1.774 1.088 16.634 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -0.471 0.873 15.566 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -0.199 1.498 17.121 1.00 0.00 H new ATOM 1284 N ALA A 79 -3.875 6.241 16.227 1.00 0.00 N ATOM 1285 CA ALA A 79 -5.116 5.489 16.463 1.00 0.00 C ATOM 1286 C ALA A 79 -6.137 5.650 15.316 1.00 0.00 C ATOM 1287 O ALA A 79 -6.841 4.705 14.954 1.00 0.00 O ATOM 1288 CB ALA A 79 -5.706 5.896 17.817 1.00 0.00 C ATOM 0 H ALA A 79 -3.747 7.047 16.839 1.00 0.00 H new ATOM 0 HA ALA A 79 -4.872 4.427 16.487 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -6.626 5.340 17.995 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -4.989 5.674 18.608 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -5.922 6.964 17.813 1.00 0.00 H new ATOM 1294 N GLU A 80 -6.187 6.829 14.692 1.00 0.00 N ATOM 1295 CA GLU A 80 -7.034 7.074 13.517 1.00 0.00 C ATOM 1296 C GLU A 80 -6.518 6.296 12.322 1.00 0.00 C ATOM 1297 O GLU A 80 -7.264 5.566 11.671 1.00 0.00 O ATOM 1298 CB GLU A 80 -7.052 8.575 13.204 1.00 0.00 C ATOM 1299 CG GLU A 80 -8.151 8.921 12.193 1.00 0.00 C ATOM 1300 CD GLU A 80 -8.309 10.446 12.040 1.00 0.00 C ATOM 1301 OE1 GLU A 80 -7.628 11.048 11.175 1.00 0.00 O ATOM 1302 OE2 GLU A 80 -9.126 11.052 12.776 1.00 0.00 O ATOM 0 H GLU A 80 -5.643 7.641 14.984 1.00 0.00 H new ATOM 0 HA GLU A 80 -8.049 6.739 13.733 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -7.211 9.138 14.124 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -6.083 8.878 12.808 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -7.911 8.479 11.226 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -9.096 8.486 12.517 1.00 0.00 H new ATOM 1309 N VAL A 81 -5.218 6.396 12.058 1.00 0.00 N ATOM 1310 CA VAL A 81 -4.619 5.594 11.004 1.00 0.00 C ATOM 1311 C VAL A 81 -4.445 4.111 11.358 1.00 0.00 C ATOM 1312 O VAL A 81 -4.200 3.315 10.464 1.00 0.00 O ATOM 1313 CB VAL A 81 -3.364 6.238 10.432 1.00 0.00 C ATOM 1314 CG1 VAL A 81 -3.713 7.510 9.653 1.00 0.00 C ATOM 1315 CG2 VAL A 81 -2.273 6.506 11.460 1.00 0.00 C ATOM 0 H VAL A 81 -4.572 7.013 12.551 1.00 0.00 H new ATOM 0 HA VAL A 81 -5.351 5.582 10.196 1.00 0.00 H new ATOM 0 HB VAL A 81 -2.940 5.502 9.748 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -2.801 7.954 9.253 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -4.386 7.261 8.832 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -4.201 8.222 10.319 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -1.415 6.965 10.969 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -2.654 7.179 12.228 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -1.967 5.566 11.920 1.00 0.00 H new ATOM 1325 N GLU A 82 -4.678 3.679 12.598 1.00 0.00 N ATOM 1326 CA GLU A 82 -4.910 2.260 12.922 1.00 0.00 C ATOM 1327 C GLU A 82 -6.242 1.759 12.332 1.00 0.00 C ATOM 1328 O GLU A 82 -6.336 0.602 11.915 1.00 0.00 O ATOM 1329 CB GLU A 82 -4.835 2.009 14.438 1.00 0.00 C ATOM 1330 CG GLU A 82 -4.803 0.515 14.786 1.00 0.00 C ATOM 1331 CD GLU A 82 -4.549 0.306 16.290 1.00 0.00 C ATOM 1332 OE1 GLU A 82 -3.368 0.369 16.711 1.00 0.00 O ATOM 1333 OE2 GLU A 82 -5.517 0.074 17.054 1.00 0.00 O ATOM 0 H GLU A 82 -4.712 4.297 13.409 1.00 0.00 H new ATOM 0 HA GLU A 82 -4.110 1.684 12.457 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -3.944 2.491 14.839 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -5.694 2.473 14.923 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -5.749 0.052 14.505 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -4.022 0.020 14.209 1.00 0.00 H new ATOM 1340 N SER A 83 -7.256 2.627 12.199 1.00 0.00 N ATOM 1341 CA SER A 83 -8.466 2.290 11.432 1.00 0.00 C ATOM 1342 C SER A 83 -8.116 2.136 9.947 1.00 0.00 C ATOM 1343 O SER A 83 -8.582 1.212 9.281 1.00 0.00 O ATOM 1344 CB SER A 83 -9.570 3.340 11.633 1.00 0.00 C ATOM 1345 OG SER A 83 -9.925 3.441 13.005 1.00 0.00 O ATOM 0 H SER A 83 -7.264 3.561 12.609 1.00 0.00 H new ATOM 0 HA SER A 83 -8.854 1.341 11.802 1.00 0.00 H new ATOM 0 HB2 SER A 83 -9.228 4.309 11.269 1.00 0.00 H new ATOM 0 HB3 SER A 83 -10.447 3.070 11.045 1.00 0.00 H new ATOM 0 HG SER A 83 -10.628 4.116 13.112 1.00 0.00 H new ATOM 1351 N LYS A 84 -7.225 2.997 9.435 1.00 0.00 N ATOM 1352 CA LYS A 84 -6.711 2.932 8.052 1.00 0.00 C ATOM 1353 C LYS A 84 -5.777 1.739 7.792 1.00 0.00 C ATOM 1354 O LYS A 84 -5.837 1.155 6.714 1.00 0.00 O ATOM 1355 CB LYS A 84 -6.050 4.257 7.649 1.00 0.00 C ATOM 1356 CG LYS A 84 -7.061 5.375 7.346 1.00 0.00 C ATOM 1357 CD LYS A 84 -7.920 5.950 8.486 1.00 0.00 C ATOM 1358 CE LYS A 84 -9.008 6.867 7.909 1.00 0.00 C ATOM 1359 NZ LYS A 84 -10.176 6.093 7.403 1.00 0.00 N ATOM 0 H LYS A 84 -6.834 3.770 9.974 1.00 0.00 H new ATOM 0 HA LYS A 84 -7.581 2.766 7.416 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -5.388 4.583 8.451 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -5.428 4.092 6.770 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -6.508 6.204 6.904 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -7.742 5.001 6.581 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -8.378 5.139 9.052 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -7.292 6.508 9.180 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -9.340 7.564 8.678 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -8.588 7.463 7.098 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -10.679 6.653 6.685 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -9.845 5.203 6.979 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -10.821 5.882 8.191 1.00 0.00 H new ATOM 1373 N LYS A 85 -4.985 1.300 8.777 1.00 0.00 N ATOM 1374 CA LYS A 85 -4.270 0.008 8.775 1.00 0.00 C ATOM 1375 C LYS A 85 -5.259 -1.139 8.580 1.00 0.00 C ATOM 1376 O LYS A 85 -5.030 -1.999 7.733 1.00 0.00 O ATOM 1377 CB LYS A 85 -3.453 -0.146 10.077 1.00 0.00 C ATOM 1378 CG LYS A 85 -2.887 -1.554 10.348 1.00 0.00 C ATOM 1379 CD LYS A 85 -1.787 -2.018 9.383 1.00 0.00 C ATOM 1380 CE LYS A 85 -0.438 -1.389 9.753 1.00 0.00 C ATOM 1381 NZ LYS A 85 0.662 -1.947 8.930 1.00 0.00 N ATOM 0 H LYS A 85 -4.816 1.845 9.623 1.00 0.00 H new ATOM 0 HA LYS A 85 -3.568 -0.020 7.941 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -2.623 0.560 10.049 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -4.086 0.139 10.917 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -2.490 -1.579 11.363 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -3.707 -2.271 10.309 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -1.707 -3.105 9.411 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -2.053 -1.744 8.362 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -0.488 -0.309 9.613 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -0.230 -1.565 10.808 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 1.570 -1.792 9.413 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 0.512 -2.967 8.795 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 0.677 -1.474 8.004 1.00 0.00 H new ATOM 1395 N ALA A 86 -6.372 -1.135 9.317 1.00 0.00 N ATOM 1396 CA ALA A 86 -7.416 -2.139 9.160 1.00 0.00 C ATOM 1397 C ALA A 86 -8.081 -2.071 7.777 1.00 0.00 C ATOM 1398 O ALA A 86 -8.450 -3.110 7.244 1.00 0.00 O ATOM 1399 CB ALA A 86 -8.423 -2.030 10.312 1.00 0.00 C ATOM 0 H ALA A 86 -6.570 -0.438 10.035 1.00 0.00 H new ATOM 0 HA ALA A 86 -6.958 -3.127 9.211 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -9.201 -2.784 10.188 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -7.910 -2.191 11.260 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -8.875 -1.038 10.308 1.00 0.00 H new ATOM 1405 N GLU A 87 -8.230 -0.892 7.162 1.00 0.00 N ATOM 1406 CA GLU A 87 -8.593 -0.781 5.737 1.00 0.00 C ATOM 1407 C GLU A 87 -7.538 -1.434 4.833 1.00 0.00 C ATOM 1408 O GLU A 87 -7.842 -2.440 4.205 1.00 0.00 O ATOM 1409 CB GLU A 87 -8.870 0.674 5.321 1.00 0.00 C ATOM 1410 CG GLU A 87 -10.116 1.205 6.028 1.00 0.00 C ATOM 1411 CD GLU A 87 -10.512 2.604 5.518 1.00 0.00 C ATOM 1412 OE1 GLU A 87 -11.269 2.699 4.521 1.00 0.00 O ATOM 1413 OE2 GLU A 87 -10.084 3.619 6.123 1.00 0.00 O ATOM 0 H GLU A 87 -8.105 0.006 7.629 1.00 0.00 H new ATOM 0 HA GLU A 87 -9.524 -1.331 5.605 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -8.011 1.299 5.567 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -9.006 0.730 4.241 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -10.944 0.514 5.872 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -9.934 1.248 7.102 1.00 0.00 H new ATOM 1420 N ALA A 88 -6.296 -0.943 4.813 1.00 0.00 N ATOM 1421 CA ALA A 88 -5.158 -1.478 4.047 1.00 0.00 C ATOM 1422 C ALA A 88 -5.036 -3.010 4.125 1.00 0.00 C ATOM 1423 O ALA A 88 -4.818 -3.692 3.126 1.00 0.00 O ATOM 1424 CB ALA A 88 -3.870 -0.819 4.566 1.00 0.00 C ATOM 0 H ALA A 88 -6.040 -0.119 5.357 1.00 0.00 H new ATOM 0 HA ALA A 88 -5.325 -1.243 2.996 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -3.015 -1.203 4.010 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -3.934 0.261 4.432 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -3.746 -1.046 5.625 1.00 0.00 H new ATOM 1430 N THR A 89 -5.193 -3.559 5.325 1.00 0.00 N ATOM 1431 CA THR A 89 -5.117 -5.002 5.593 1.00 0.00 C ATOM 1432 C THR A 89 -6.427 -5.760 5.265 1.00 0.00 C ATOM 1433 O THR A 89 -6.386 -6.940 4.906 1.00 0.00 O ATOM 1434 CB THR A 89 -4.599 -5.190 7.024 1.00 0.00 C ATOM 1435 OG1 THR A 89 -3.333 -4.545 7.119 1.00 0.00 O ATOM 1436 CG2 THR A 89 -4.384 -6.651 7.418 1.00 0.00 C ATOM 0 H THR A 89 -5.381 -3.006 6.161 1.00 0.00 H new ATOM 0 HA THR A 89 -4.408 -5.470 4.910 1.00 0.00 H new ATOM 0 HB THR A 89 -5.355 -4.774 7.690 1.00 0.00 H new ATOM 0 HG1 THR A 89 -3.464 -3.593 7.312 1.00 0.00 H new ATOM 0 HG21 THR A 89 -4.017 -6.701 8.443 1.00 0.00 H new ATOM 0 HG22 THR A 89 -5.328 -7.191 7.344 1.00 0.00 H new ATOM 0 HG23 THR A 89 -3.653 -7.105 6.749 1.00 0.00 H new ATOM 1444 N ARG A 90 -7.595 -5.096 5.251 1.00 0.00 N ATOM 1445 CA ARG A 90 -8.817 -5.606 4.585 1.00 0.00 C ATOM 1446 C ARG A 90 -8.722 -5.578 3.054 1.00 0.00 C ATOM 1447 O ARG A 90 -9.249 -6.484 2.411 1.00 0.00 O ATOM 1448 CB ARG A 90 -10.080 -4.874 5.070 1.00 0.00 C ATOM 1449 CG ARG A 90 -10.545 -5.418 6.432 1.00 0.00 C ATOM 1450 CD ARG A 90 -11.728 -4.625 7.004 1.00 0.00 C ATOM 1451 NE ARG A 90 -11.317 -3.271 7.421 1.00 0.00 N ATOM 1452 CZ ARG A 90 -12.091 -2.321 7.915 1.00 0.00 C ATOM 1453 NH1 ARG A 90 -13.372 -2.491 8.080 1.00 0.00 N ATOM 1454 NH2 ARG A 90 -11.592 -1.168 8.260 1.00 0.00 N ATOM 0 H ARG A 90 -7.724 -4.189 5.700 1.00 0.00 H new ATOM 0 HA ARG A 90 -8.899 -6.653 4.876 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -9.877 -3.806 5.151 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -10.877 -4.992 4.336 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -10.830 -6.464 6.324 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -9.714 -5.385 7.137 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -12.516 -4.553 6.254 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -12.147 -5.159 7.857 1.00 0.00 H new ATOM 0 HE ARG A 90 -10.328 -3.044 7.317 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -13.806 -3.378 7.825 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -13.941 -1.737 8.464 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -10.594 -0.991 8.150 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -12.200 -0.442 8.640 1.00 0.00 H new ATOM 1468 N LEU A 91 -8.004 -4.624 2.450 1.00 0.00 N ATOM 1469 CA LEU A 91 -7.626 -4.731 1.032 1.00 0.00 C ATOM 1470 C LEU A 91 -6.759 -5.977 0.784 1.00 0.00 C ATOM 1471 O LEU A 91 -6.866 -6.566 -0.284 1.00 0.00 O ATOM 1472 CB LEU A 91 -6.915 -3.484 0.463 1.00 0.00 C ATOM 1473 CG LEU A 91 -7.699 -2.204 0.154 1.00 0.00 C ATOM 1474 CD1 LEU A 91 -8.907 -2.469 -0.723 1.00 0.00 C ATOM 1475 CD2 LEU A 91 -8.190 -1.479 1.386 1.00 0.00 C ATOM 0 H LEU A 91 -7.675 -3.777 2.913 1.00 0.00 H new ATOM 0 HA LEU A 91 -8.572 -4.818 0.497 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -6.128 -3.215 1.168 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -6.424 -3.789 -0.461 1.00 0.00 H new ATOM 0 HG LEU A 91 -6.976 -1.575 -0.366 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -9.430 -1.532 -0.914 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -8.582 -2.903 -1.669 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -9.579 -3.163 -0.217 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -8.736 -0.584 1.088 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -8.850 -2.134 1.955 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -7.339 -1.196 2.005 1.00 0.00 H new ATOM 1487 N GLU A 92 -5.944 -6.432 1.744 1.00 0.00 N ATOM 1488 CA GLU A 92 -5.162 -7.675 1.608 1.00 0.00 C ATOM 1489 C GLU A 92 -6.038 -8.915 1.357 1.00 0.00 C ATOM 1490 O GLU A 92 -5.793 -9.664 0.405 1.00 0.00 O ATOM 1491 CB GLU A 92 -4.210 -7.884 2.801 1.00 0.00 C ATOM 1492 CG GLU A 92 -2.748 -7.881 2.353 1.00 0.00 C ATOM 1493 CD GLU A 92 -1.807 -8.265 3.511 1.00 0.00 C ATOM 1494 OE1 GLU A 92 -1.610 -9.480 3.758 1.00 0.00 O ATOM 1495 OE2 GLU A 92 -1.245 -7.360 4.172 1.00 0.00 O ATOM 0 H GLU A 92 -5.806 -5.954 2.634 1.00 0.00 H new ATOM 0 HA GLU A 92 -4.550 -7.550 0.714 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -4.368 -7.096 3.538 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -4.440 -8.830 3.291 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -2.617 -8.581 1.528 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -2.482 -6.893 1.978 1.00 0.00 H new ATOM 1502 N LYS A 93 -7.114 -9.117 2.132 1.00 0.00 N ATOM 1503 CA LYS A 93 -8.092 -10.177 1.832 1.00 0.00 C ATOM 1504 C LYS A 93 -8.898 -9.941 0.539 1.00 0.00 C ATOM 1505 O LYS A 93 -9.478 -10.886 0.007 1.00 0.00 O ATOM 1506 CB LYS A 93 -8.968 -10.487 3.056 1.00 0.00 C ATOM 1507 CG LYS A 93 -9.887 -9.348 3.514 1.00 0.00 C ATOM 1508 CD LYS A 93 -10.825 -9.744 4.665 1.00 0.00 C ATOM 1509 CE LYS A 93 -11.877 -10.776 4.233 1.00 0.00 C ATOM 1510 NZ LYS A 93 -12.808 -11.107 5.344 1.00 0.00 N ATOM 0 H LYS A 93 -7.329 -8.567 2.964 1.00 0.00 H new ATOM 0 HA LYS A 93 -7.517 -11.077 1.615 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -9.583 -11.358 2.830 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -8.318 -10.762 3.886 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -9.276 -8.502 3.828 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -10.485 -9.011 2.667 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -10.236 -10.152 5.487 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -11.327 -8.854 5.044 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -12.443 -10.387 3.387 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -11.379 -11.684 3.893 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -13.505 -11.806 5.017 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -12.270 -11.501 6.142 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -13.302 -10.245 5.652 1.00 0.00 H new ATOM 1524 N ILE A 94 -8.892 -8.721 -0.012 1.00 0.00 N ATOM 1525 CA ILE A 94 -9.532 -8.367 -1.293 1.00 0.00 C ATOM 1526 C ILE A 94 -8.606 -8.569 -2.511 1.00 0.00 C ATOM 1527 O ILE A 94 -9.061 -9.130 -3.509 1.00 0.00 O ATOM 1528 CB ILE A 94 -10.261 -7.000 -1.170 1.00 0.00 C ATOM 1529 CG1 ILE A 94 -11.784 -7.160 -1.367 1.00 0.00 C ATOM 1530 CG2 ILE A 94 -9.749 -5.884 -2.074 1.00 0.00 C ATOM 1531 CD1 ILE A 94 -12.275 -7.469 -2.790 1.00 0.00 C ATOM 0 H ILE A 94 -8.429 -7.927 0.431 1.00 0.00 H new ATOM 0 HA ILE A 94 -10.325 -9.081 -1.515 1.00 0.00 H new ATOM 0 HB ILE A 94 -10.030 -6.681 -0.154 1.00 0.00 H new ATOM 0 HG12 ILE A 94 -12.129 -7.958 -0.709 1.00 0.00 H new ATOM 0 HG13 ILE A 94 -12.267 -6.241 -1.034 1.00 0.00 H new ATOM 0 HG21 ILE A 94 -10.332 -4.979 -1.901 1.00 0.00 H new ATOM 0 HG22 ILE A 94 -8.700 -5.688 -1.851 1.00 0.00 H new ATOM 0 HG23 ILE A 94 -9.848 -6.186 -3.117 1.00 0.00 H new ATOM 0 HD11 ILE A 94 -13.361 -7.556 -2.789 1.00 0.00 H new ATOM 0 HD12 ILE A 94 -11.976 -6.664 -3.461 1.00 0.00 H new ATOM 0 HD13 ILE A 94 -11.836 -8.407 -3.131 1.00 0.00 H new ATOM 1543 N LYS A 95 -7.290 -8.298 -2.426 1.00 0.00 N ATOM 1544 CA LYS A 95 -6.322 -8.874 -3.396 1.00 0.00 C ATOM 1545 C LYS A 95 -6.331 -10.411 -3.386 1.00 0.00 C ATOM 1546 O LYS A 95 -6.132 -11.034 -4.425 1.00 0.00 O ATOM 1547 CB LYS A 95 -4.889 -8.301 -3.291 1.00 0.00 C ATOM 1548 CG LYS A 95 -3.981 -8.913 -2.208 1.00 0.00 C ATOM 1549 CD LYS A 95 -2.482 -8.657 -2.438 1.00 0.00 C ATOM 1550 CE LYS A 95 -1.925 -9.535 -3.570 1.00 0.00 C ATOM 1551 NZ LYS A 95 -0.440 -9.465 -3.646 1.00 0.00 N ATOM 0 H LYS A 95 -6.873 -7.698 -1.714 1.00 0.00 H new ATOM 0 HA LYS A 95 -6.683 -8.549 -4.372 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -4.400 -8.427 -4.257 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -4.963 -7.229 -3.108 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -4.265 -8.507 -1.237 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -4.154 -9.988 -2.167 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -2.325 -7.606 -2.681 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -1.933 -8.857 -1.518 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -2.232 -10.569 -3.412 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -2.353 -9.217 -4.521 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -0.103 -10.071 -4.422 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -0.147 -8.483 -3.822 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -0.031 -9.793 -2.748 1.00 0.00 H new ATOM 1565 N THR A 96 -6.600 -11.031 -2.235 1.00 0.00 N ATOM 1566 CA THR A 96 -6.760 -12.495 -2.119 1.00 0.00 C ATOM 1567 C THR A 96 -8.022 -13.000 -2.839 1.00 0.00 C ATOM 1568 O THR A 96 -8.009 -14.091 -3.408 1.00 0.00 O ATOM 1569 CB THR A 96 -6.744 -12.950 -0.649 1.00 0.00 C ATOM 1570 OG1 THR A 96 -5.565 -12.496 -0.013 1.00 0.00 O ATOM 1571 CG2 THR A 96 -6.744 -14.472 -0.488 1.00 0.00 C ATOM 0 H THR A 96 -6.715 -10.537 -1.350 1.00 0.00 H new ATOM 0 HA THR A 96 -5.902 -12.944 -2.619 1.00 0.00 H new ATOM 0 HB THR A 96 -7.650 -12.534 -0.208 1.00 0.00 H new ATOM 0 HG1 THR A 96 -5.632 -11.532 0.150 1.00 0.00 H new ATOM 0 HG21 THR A 96 -6.732 -14.726 0.572 1.00 0.00 H new ATOM 0 HG22 THR A 96 -7.640 -14.887 -0.951 1.00 0.00 H new ATOM 0 HG23 THR A 96 -5.860 -14.889 -0.971 1.00 0.00 H new ATOM 1579 N ASP A 97 -9.096 -12.203 -2.904 1.00 0.00 N ATOM 1580 CA ASP A 97 -10.289 -12.535 -3.695 1.00 0.00 C ATOM 1581 C ASP A 97 -9.973 -12.458 -5.197 1.00 0.00 C ATOM 1582 O ASP A 97 -10.384 -13.325 -5.969 1.00 0.00 O ATOM 1583 CB ASP A 97 -11.449 -11.607 -3.314 1.00 0.00 C ATOM 1584 CG ASP A 97 -12.758 -12.029 -4.002 1.00 0.00 C ATOM 1585 OD1 ASP A 97 -13.363 -13.043 -3.578 1.00 0.00 O ATOM 1586 OD2 ASP A 97 -13.196 -11.338 -4.953 1.00 0.00 O ATOM 0 H ASP A 97 -9.163 -11.312 -2.412 1.00 0.00 H new ATOM 0 HA ASP A 97 -10.592 -13.558 -3.474 1.00 0.00 H new ATOM 0 HB2 ASP A 97 -11.585 -11.618 -2.233 1.00 0.00 H new ATOM 0 HB3 ASP A 97 -11.204 -10.582 -3.594 1.00 0.00 H new ATOM 1591 N ARG A 98 -9.150 -11.476 -5.592 1.00 0.00 N ATOM 1592 CA ARG A 98 -8.530 -11.387 -6.923 1.00 0.00 C ATOM 1593 C ARG A 98 -7.724 -12.644 -7.269 1.00 0.00 C ATOM 1594 O ARG A 98 -7.958 -13.260 -8.307 1.00 0.00 O ATOM 1595 CB ARG A 98 -7.641 -10.131 -6.997 1.00 0.00 C ATOM 1596 CG ARG A 98 -7.858 -9.377 -8.309 1.00 0.00 C ATOM 1597 CD ARG A 98 -6.683 -8.443 -8.628 1.00 0.00 C ATOM 1598 NE ARG A 98 -5.473 -9.216 -8.976 1.00 0.00 N ATOM 1599 CZ ARG A 98 -4.206 -8.902 -8.792 1.00 0.00 C ATOM 1600 NH1 ARG A 98 -3.821 -7.789 -8.240 1.00 0.00 N ATOM 1601 NH2 ARG A 98 -3.296 -9.742 -9.170 1.00 0.00 N ATOM 0 H ARG A 98 -8.890 -10.702 -4.980 1.00 0.00 H new ATOM 0 HA ARG A 98 -9.328 -11.311 -7.662 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -7.864 -9.474 -6.156 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -6.593 -10.418 -6.908 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -7.986 -10.091 -9.122 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -8.778 -8.796 -8.247 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -6.950 -7.786 -9.456 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -6.477 -7.805 -7.769 1.00 0.00 H new ATOM 0 HE ARG A 98 -5.641 -10.118 -9.421 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -4.514 -7.109 -7.926 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -2.826 -7.596 -8.122 1.00 0.00 H new ATOM 0 HH21 ARG A 98 -3.566 -10.626 -9.601 1.00 0.00 H new ATOM 0 HH22 ARG A 98 -2.310 -9.519 -9.037 1.00 0.00 H new ATOM 1615 N LYS A 99 -6.817 -13.062 -6.376 1.00 0.00 N ATOM 1616 CA LYS A 99 -5.998 -14.282 -6.505 1.00 0.00 C ATOM 1617 C LYS A 99 -6.855 -15.539 -6.710 1.00 0.00 C ATOM 1618 O LYS A 99 -6.535 -16.361 -7.569 1.00 0.00 O ATOM 1619 CB LYS A 99 -5.064 -14.398 -5.286 1.00 0.00 C ATOM 1620 CG LYS A 99 -4.016 -15.509 -5.451 1.00 0.00 C ATOM 1621 CD LYS A 99 -3.070 -15.556 -4.243 1.00 0.00 C ATOM 1622 CE LYS A 99 -2.035 -16.674 -4.429 1.00 0.00 C ATOM 1623 NZ LYS A 99 -1.099 -16.751 -3.276 1.00 0.00 N ATOM 0 H LYS A 99 -6.625 -12.547 -5.517 1.00 0.00 H new ATOM 0 HA LYS A 99 -5.387 -14.201 -7.404 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -4.557 -13.446 -5.129 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -5.659 -14.594 -4.394 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -4.515 -16.471 -5.564 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -3.441 -15.339 -6.361 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -2.565 -14.597 -4.129 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -3.641 -15.726 -3.330 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -2.547 -17.629 -4.547 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -1.471 -16.500 -5.345 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -0.414 -17.517 -3.436 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -0.592 -15.848 -3.179 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -1.635 -16.942 -2.406 1.00 0.00 H new ATOM 1637 N LYS A 100 -7.968 -15.670 -5.975 1.00 0.00 N ATOM 1638 CA LYS A 100 -8.982 -16.715 -6.193 1.00 0.00 C ATOM 1639 C LYS A 100 -9.681 -16.609 -7.552 1.00 0.00 C ATOM 1640 O LYS A 100 -9.769 -17.610 -8.257 1.00 0.00 O ATOM 1641 CB LYS A 100 -9.996 -16.717 -5.034 1.00 0.00 C ATOM 1642 CG LYS A 100 -9.511 -17.461 -3.774 1.00 0.00 C ATOM 1643 CD LYS A 100 -9.088 -18.929 -3.991 1.00 0.00 C ATOM 1644 CE LYS A 100 -10.093 -19.717 -4.847 1.00 0.00 C ATOM 1645 NZ LYS A 100 -9.652 -21.115 -5.090 1.00 0.00 N ATOM 0 H LYS A 100 -8.194 -15.045 -5.201 1.00 0.00 H new ATOM 0 HA LYS A 100 -8.458 -17.671 -6.210 1.00 0.00 H new ATOM 0 HB2 LYS A 100 -10.228 -15.686 -4.767 1.00 0.00 H new ATOM 0 HB3 LYS A 100 -10.924 -17.174 -5.378 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -8.666 -16.916 -3.354 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -10.307 -17.437 -3.030 1.00 0.00 H new ATOM 0 HD2 LYS A 100 -8.110 -18.953 -4.472 1.00 0.00 H new ATOM 0 HD3 LYS A 100 -8.980 -19.418 -3.023 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -11.063 -19.726 -4.349 1.00 0.00 H new ATOM 0 HE3 LYS A 100 -10.229 -19.210 -5.802 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 -10.361 -21.607 -5.671 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 -8.739 -21.109 -5.589 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 -9.547 -21.609 -4.181 1.00 0.00 H new ATOM 1812 N GLU A 111 -8.752 -27.052 -23.393 1.00 0.00 N ATOM 1813 CA GLU A 111 -8.850 -26.140 -24.527 1.00 0.00 C ATOM 1814 C GLU A 111 -7.486 -25.532 -24.891 1.00 0.00 C ATOM 1815 O GLU A 111 -7.158 -25.414 -26.071 1.00 0.00 O ATOM 1816 CB GLU A 111 -9.880 -25.070 -24.134 1.00 0.00 C ATOM 1817 CG GLU A 111 -10.250 -24.200 -25.319 1.00 0.00 C ATOM 1818 CD GLU A 111 -11.384 -23.216 -24.972 1.00 0.00 C ATOM 1819 OE1 GLU A 111 -11.097 -22.109 -24.453 1.00 0.00 O ATOM 1820 OE2 GLU A 111 -12.571 -23.535 -25.229 1.00 0.00 O ATOM 0 HA GLU A 111 -9.171 -26.667 -25.426 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -10.775 -25.551 -23.740 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -9.475 -24.448 -23.336 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -9.373 -23.643 -25.649 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -10.559 -24.832 -26.152 1.00 0.00 H new ATOM 1827 N GLU A 112 -6.645 -25.222 -23.895 1.00 0.00 N ATOM 1828 CA GLU A 112 -5.249 -24.793 -24.090 1.00 0.00 C ATOM 1829 C GLU A 112 -4.449 -25.758 -24.988 1.00 0.00 C ATOM 1830 O GLU A 112 -3.654 -25.330 -25.826 1.00 0.00 O ATOM 1831 CB GLU A 112 -4.582 -24.613 -22.717 1.00 0.00 C ATOM 1832 CG GLU A 112 -3.157 -24.050 -22.808 1.00 0.00 C ATOM 1833 CD GLU A 112 -2.575 -23.789 -21.405 1.00 0.00 C ATOM 1834 OE1 GLU A 112 -2.083 -24.747 -20.760 1.00 0.00 O ATOM 1835 OE2 GLU A 112 -2.594 -22.622 -20.942 1.00 0.00 O ATOM 0 H GLU A 112 -6.918 -25.262 -22.913 1.00 0.00 H new ATOM 0 HA GLU A 112 -5.255 -23.840 -24.618 1.00 0.00 H new ATOM 0 HB2 GLU A 112 -5.192 -23.945 -22.108 1.00 0.00 H new ATOM 0 HB3 GLU A 112 -4.554 -25.575 -22.205 1.00 0.00 H new ATOM 0 HG2 GLU A 112 -2.519 -24.751 -23.346 1.00 0.00 H new ATOM 0 HG3 GLU A 112 -3.165 -23.123 -23.381 1.00 0.00 H new ATOM 1842 N ASP A 113 -4.713 -27.063 -24.867 1.00 0.00 N ATOM 1843 CA ASP A 113 -4.121 -28.120 -25.698 1.00 0.00 C ATOM 1844 C ASP A 113 -4.444 -27.983 -27.199 1.00 0.00 C ATOM 1845 O ASP A 113 -3.716 -28.512 -28.039 1.00 0.00 O ATOM 1846 CB ASP A 113 -4.581 -29.486 -25.170 1.00 0.00 C ATOM 1847 CG ASP A 113 -3.867 -30.654 -25.874 1.00 0.00 C ATOM 1848 OD1 ASP A 113 -2.624 -30.757 -25.745 1.00 0.00 O ATOM 1849 OD2 ASP A 113 -4.549 -31.463 -26.550 1.00 0.00 O ATOM 0 H ASP A 113 -5.363 -27.425 -24.169 1.00 0.00 H new ATOM 0 HA ASP A 113 -3.038 -28.023 -25.622 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -4.393 -29.541 -24.098 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -5.658 -29.584 -25.310 1.00 0.00 H new ATOM 1854 N LYS A 114 -5.533 -27.290 -27.559 1.00 0.00 N ATOM 1855 CA LYS A 114 -5.879 -26.922 -28.936 1.00 0.00 C ATOM 1856 C LYS A 114 -5.232 -25.581 -29.294 1.00 0.00 C ATOM 1857 O LYS A 114 -4.509 -25.472 -30.285 1.00 0.00 O ATOM 1858 CB LYS A 114 -7.412 -26.850 -29.086 1.00 0.00 C ATOM 1859 CG LYS A 114 -8.254 -28.006 -28.510 1.00 0.00 C ATOM 1860 CD LYS A 114 -7.954 -29.423 -29.032 1.00 0.00 C ATOM 1861 CE LYS A 114 -6.730 -30.026 -28.334 1.00 0.00 C ATOM 1862 NZ LYS A 114 -6.578 -31.486 -28.540 1.00 0.00 N ATOM 0 H LYS A 114 -6.217 -26.961 -26.878 1.00 0.00 H new ATOM 0 HA LYS A 114 -5.500 -27.680 -29.622 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -7.750 -25.926 -28.617 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -7.639 -26.770 -30.149 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -8.126 -28.011 -27.428 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -9.304 -27.789 -28.706 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -8.821 -30.064 -28.869 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -7.781 -29.388 -30.108 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -5.833 -29.523 -28.696 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -6.798 -29.825 -27.265 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -5.836 -31.850 -27.908 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -7.478 -31.962 -28.328 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -6.313 -31.671 -29.528 1.00 0.00 H new ATOM 1876 N VAL A 115 -5.451 -24.577 -28.441 1.00 0.00 N ATOM 1877 CA VAL A 115 -5.002 -23.176 -28.595 1.00 0.00 C ATOM 1878 C VAL A 115 -3.490 -23.035 -28.819 1.00 0.00 C ATOM 1879 O VAL A 115 -3.069 -22.145 -29.560 1.00 0.00 O ATOM 1880 CB VAL A 115 -5.487 -22.326 -27.400 1.00 0.00 C ATOM 1881 CG1 VAL A 115 -4.946 -20.890 -27.377 1.00 0.00 C ATOM 1882 CG2 VAL A 115 -7.019 -22.221 -27.402 1.00 0.00 C ATOM 0 H VAL A 115 -5.973 -24.719 -27.576 1.00 0.00 H new ATOM 0 HA VAL A 115 -5.460 -22.796 -29.508 1.00 0.00 H new ATOM 0 HB VAL A 115 -5.105 -22.849 -26.523 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -5.338 -20.367 -26.505 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -3.857 -20.912 -27.328 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -5.258 -20.369 -28.282 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -7.344 -21.619 -26.553 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -7.350 -21.751 -28.328 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -7.452 -23.218 -27.326 1.00 0.00 H new ATOM 1892 N LYS A 116 -2.669 -23.929 -28.248 1.00 0.00 N ATOM 1893 CA LYS A 116 -1.205 -23.964 -28.426 1.00 0.00 C ATOM 1894 C LYS A 116 -0.736 -24.028 -29.893 1.00 0.00 C ATOM 1895 O LYS A 116 0.361 -23.562 -30.201 1.00 0.00 O ATOM 1896 CB LYS A 116 -0.619 -25.110 -27.580 1.00 0.00 C ATOM 1897 CG LYS A 116 -0.963 -26.502 -28.133 1.00 0.00 C ATOM 1898 CD LYS A 116 -0.404 -27.643 -27.274 1.00 0.00 C ATOM 1899 CE LYS A 116 -0.542 -28.965 -28.042 1.00 0.00 C ATOM 1900 NZ LYS A 116 -0.312 -30.147 -27.174 1.00 0.00 N ATOM 0 H LYS A 116 -3.011 -24.668 -27.633 1.00 0.00 H new ATOM 0 HA LYS A 116 -0.819 -23.008 -28.072 1.00 0.00 H new ATOM 0 HB2 LYS A 116 0.465 -25.002 -27.533 1.00 0.00 H new ATOM 0 HB3 LYS A 116 -0.992 -25.028 -26.559 1.00 0.00 H new ATOM 0 HG2 LYS A 116 -2.046 -26.603 -28.200 1.00 0.00 H new ATOM 0 HG3 LYS A 116 -0.571 -26.592 -29.146 1.00 0.00 H new ATOM 0 HD2 LYS A 116 0.643 -27.455 -27.034 1.00 0.00 H new ATOM 0 HD3 LYS A 116 -0.942 -27.700 -26.328 1.00 0.00 H new ATOM 0 HE2 LYS A 116 -1.539 -29.026 -28.479 1.00 0.00 H new ATOM 0 HE3 LYS A 116 0.170 -28.979 -28.868 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 -0.264 -31.004 -27.761 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 0.583 -30.030 -26.658 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 -1.094 -30.236 -26.494 1.00 0.00 H new ATOM 1914 N GLU A 117 -1.555 -24.589 -30.789 1.00 0.00 N ATOM 1915 CA GLU A 117 -1.291 -24.697 -32.237 1.00 0.00 C ATOM 1916 C GLU A 117 -2.399 -24.077 -33.110 1.00 0.00 C ATOM 1917 O GLU A 117 -2.105 -23.547 -34.185 1.00 0.00 O ATOM 1918 CB GLU A 117 -1.065 -26.170 -32.622 1.00 0.00 C ATOM 1919 CG GLU A 117 0.323 -26.676 -32.207 1.00 0.00 C ATOM 1920 CD GLU A 117 0.495 -28.169 -32.546 1.00 0.00 C ATOM 1921 OE1 GLU A 117 0.860 -28.496 -33.703 1.00 0.00 O ATOM 1922 OE2 GLU A 117 0.277 -29.027 -31.656 1.00 0.00 O ATOM 0 H GLU A 117 -2.452 -24.996 -30.522 1.00 0.00 H new ATOM 0 HA GLU A 117 -0.389 -24.119 -32.435 1.00 0.00 H new ATOM 0 HB2 GLU A 117 -1.830 -26.787 -32.151 1.00 0.00 H new ATOM 0 HB3 GLU A 117 -1.183 -26.283 -33.700 1.00 0.00 H new ATOM 0 HG2 GLU A 117 1.092 -26.094 -32.715 1.00 0.00 H new ATOM 0 HG3 GLU A 117 0.463 -26.525 -31.137 1.00 0.00 H new ATOM 1929 N LYS A 118 -3.662 -24.119 -32.660 1.00 0.00 N ATOM 1930 CA LYS A 118 -4.843 -23.583 -33.348 1.00 0.00 C ATOM 1931 C LYS A 118 -5.648 -22.645 -32.419 1.00 0.00 C ATOM 1932 O LYS A 118 -6.647 -23.077 -31.833 1.00 0.00 O ATOM 1933 CB LYS A 118 -5.654 -24.771 -33.905 1.00 0.00 C ATOM 1934 CG LYS A 118 -6.831 -24.372 -34.812 1.00 0.00 C ATOM 1935 CD LYS A 118 -6.463 -23.475 -36.004 1.00 0.00 C ATOM 1936 CE LYS A 118 -5.401 -24.108 -36.915 1.00 0.00 C ATOM 1937 NZ LYS A 118 -5.118 -23.255 -38.100 1.00 0.00 N ATOM 0 H LYS A 118 -3.897 -24.548 -31.765 1.00 0.00 H new ATOM 0 HA LYS A 118 -4.555 -22.954 -34.191 1.00 0.00 H new ATOM 0 HB2 LYS A 118 -4.983 -25.421 -34.467 1.00 0.00 H new ATOM 0 HB3 LYS A 118 -6.038 -25.356 -33.069 1.00 0.00 H new ATOM 0 HG2 LYS A 118 -7.300 -25.280 -35.192 1.00 0.00 H new ATOM 0 HG3 LYS A 118 -7.577 -23.857 -34.207 1.00 0.00 H new ATOM 0 HD2 LYS A 118 -7.360 -23.267 -36.588 1.00 0.00 H new ATOM 0 HD3 LYS A 118 -6.095 -22.518 -35.634 1.00 0.00 H new ATOM 0 HE2 LYS A 118 -4.482 -24.263 -36.350 1.00 0.00 H new ATOM 0 HE3 LYS A 118 -5.742 -25.089 -37.245 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 -4.397 -23.713 -38.693 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 -5.990 -23.127 -38.652 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 -4.769 -22.327 -37.785 1.00 0.00 H new