USER MOD reduce.3.24.130724 H: found=0, std=0, add=949, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 947 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 113 SER OG : rot 51:sc= 0.679! USER MOD Set 1.2: A 116 HIS : no HE2:sc= -11! C(o=-10!,f=-26!) USER MOD Set 2.1: A 88 TYR OH : rot -81:sc= 0.488 USER MOD Set 2.2: A 90 SER OG : rot -128:sc= 1.43 USER MOD Set 3.1: A 72 SER OG : rot -61:sc= -1.21! USER MOD Set 3.2: A 75 THR OG1 : rot 180:sc= 0.201! USER MOD Single : A 26 LYS NZ :NH3+ 147:sc= -6.3 (180deg=-9.04!) USER MOD Single : A 29 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 CYS SG : rot 57:sc= 0.704 USER MOD Single : A 31 SER OG : rot 130:sc= -2.25 USER MOD Single : A 35 HIS : no HE2:sc= -8.75! C(o=-8.7!,f=-13!) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 THR OG1 : rot -50:sc= -5.5! USER MOD Single : A 52 SER OG : rot 65:sc= 1.17 USER MOD Single : A 54 GLN : amide:sc= -2.03 X(o=-2,f=-1.9) USER MOD Single : A 55 HIS : no HE2:sc= -6.88! K(o=-6.9!,f=-4.6) USER MOD Single : A 57 GLN : amide:sc= -2.82 K(o=-2.8,f=-15!) USER MOD Single : A 59 GLN : amide:sc= -1.64! K(o=-1.6!,f=-0.71) USER MOD Single : A 61 SER OG : rot -64:sc= 0.991 USER MOD Single : A 64 SER OG : rot 72:sc= 1.13 USER MOD Single : A 69 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= -1.5! (180deg=-1.5!) USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 78 TYR OH : rot 180:sc= 0 USER MOD Single : A 81 MET CE :methyl 150:sc= -5.64! (180deg=-8.65!) USER MOD Single : A 83 THR OG1 : rot 180:sc= -1.03 USER MOD Single : A 91 GLN : amide:sc= 0.852 K(o=0.85,f=-0.88) USER MOD Single : A 92 THR OG1 : rot 2:sc= 0.818 USER MOD Single : A 94 ASN : amide:sc= -6.13! C(o=-6.1!,f=-3.5!) USER MOD Single : A 97 CYS SG : rot 161:sc= -0.735 USER MOD Single : A 106 ASN : amide:sc= -2.31! C(o=-2.3!,f=-7.1!) USER MOD Single : A 107 HIS : no HD1:sc= -4.09! C(o=-4.1!,f=-3.3!) USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 109 ASN : amide:sc= -0.578 X(o=-0.58,f=-0.22) USER MOD Single : A 110 THR OG1 : rot 59:sc= -0.518! USER MOD Single : A 111 TYR OH : rot 70:sc= -1.1 USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 LYS NZ :NH3+ 163:sc= -0.0037 (180deg=-0.0811) USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 ASN : amide:sc= -0.363 X(o=-0.36,f=0) USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 ASN : amide:sc= -0.489 K(o=-0.49,f=-3.1!) USER MOD Single : A 130 SER OG : rot 44:sc= 1.11 USER MOD Single : A 131 CYS SG : rot 180:sc= -1.94 USER MOD Single : A 132 LYS NZ :NH3+ 166:sc= -2.54 (180deg=-3.69!) USER MOD Single : A 137 THR OG1 : rot 90:sc= -0.929 USER MOD Single : A 138 HIS : no HD1:sc= -8.97! C(o=-9!,f=-7.4!) USER MOD Single : A 139 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 37 N LYS A 26 -7.943 -6.397 9.101 1.00 0.00 N ATOM 38 CA LYS A 26 -6.959 -6.700 8.075 1.00 0.00 C ATOM 39 C LYS A 26 -5.568 -6.305 8.576 1.00 0.00 C ATOM 40 O LYS A 26 -5.431 -5.374 9.368 1.00 0.00 O ATOM 41 CB LYS A 26 -7.346 -6.041 6.750 1.00 0.00 C ATOM 42 CG LYS A 26 -6.536 -6.624 5.591 1.00 0.00 C ATOM 43 CD LYS A 26 -5.712 -5.537 4.897 1.00 0.00 C ATOM 44 CE LYS A 26 -4.350 -5.367 5.573 1.00 0.00 C ATOM 45 NZ LYS A 26 -4.428 -4.355 6.649 1.00 0.00 N ATOM 0 HA LYS A 26 -6.934 -7.771 7.876 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -8.410 -6.187 6.564 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -7.178 -4.966 6.812 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -5.874 -7.406 5.962 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -7.208 -7.091 4.871 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -5.571 -5.796 3.848 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -6.255 -4.592 4.922 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -4.021 -6.321 5.986 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -3.606 -5.065 4.835 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -3.775 -4.613 7.416 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -4.165 -3.423 6.269 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -5.399 -4.316 7.019 1.00 0.00 H new ATOM 59 N LEU A 27 -4.572 -7.032 8.093 1.00 0.00 N ATOM 60 CA LEU A 27 -3.197 -6.769 8.481 1.00 0.00 C ATOM 61 C LEU A 27 -2.260 -7.207 7.353 1.00 0.00 C ATOM 62 O LEU A 27 -1.970 -8.393 7.207 1.00 0.00 O ATOM 63 CB LEU A 27 -2.885 -7.424 9.828 1.00 0.00 C ATOM 64 CG LEU A 27 -1.810 -8.513 9.812 1.00 0.00 C ATOM 65 CD1 LEU A 27 -0.478 -7.960 9.302 1.00 0.00 C ATOM 66 CD2 LEU A 27 -1.671 -9.166 11.188 1.00 0.00 C ATOM 0 H LEU A 27 -4.690 -7.803 7.436 1.00 0.00 H new ATOM 0 HA LEU A 27 -3.041 -5.700 8.629 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -2.575 -6.645 10.525 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -3.805 -7.856 10.221 1.00 0.00 H new ATOM 0 HG LEU A 27 -2.122 -9.292 9.117 1.00 0.00 H new ATOM 0 HD11 LEU A 27 0.269 -8.754 9.301 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -0.606 -7.580 8.288 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -0.147 -7.151 9.953 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -0.901 -9.936 11.149 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -1.392 -8.411 11.923 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -2.621 -9.617 11.474 1.00 0.00 H new ATOM 78 N LEU A 28 -1.813 -6.225 6.583 1.00 0.00 N ATOM 79 CA LEU A 28 -0.915 -6.495 5.473 1.00 0.00 C ATOM 80 C LEU A 28 0.426 -6.992 6.016 1.00 0.00 C ATOM 81 O LEU A 28 0.686 -6.901 7.215 1.00 0.00 O ATOM 82 CB LEU A 28 -0.795 -5.265 4.571 1.00 0.00 C ATOM 83 CG LEU A 28 -1.201 -5.463 3.109 1.00 0.00 C ATOM 84 CD1 LEU A 28 -1.023 -4.170 2.311 1.00 0.00 C ATOM 85 CD2 LEU A 28 -0.441 -6.633 2.482 1.00 0.00 C ATOM 0 H LEU A 28 -2.056 -5.242 6.706 1.00 0.00 H new ATOM 0 HA LEU A 28 -1.317 -7.288 4.842 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -1.408 -4.468 4.993 1.00 0.00 H new ATOM 0 HB3 LEU A 28 0.238 -4.920 4.597 1.00 0.00 H new ATOM 0 HG LEU A 28 -2.261 -5.716 3.080 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -1.318 -4.338 1.275 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -1.646 -3.387 2.744 1.00 0.00 H new ATOM 0 HD13 LEU A 28 0.022 -3.863 2.345 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -0.749 -6.752 1.443 1.00 0.00 H new ATOM 0 HD22 LEU A 28 0.630 -6.435 2.523 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -0.662 -7.547 3.033 1.00 0.00 H new ATOM 97 N TYR A 29 1.241 -7.508 5.108 1.00 0.00 N ATOM 98 CA TYR A 29 2.549 -8.020 5.481 1.00 0.00 C ATOM 99 C TYR A 29 3.472 -8.106 4.264 1.00 0.00 C ATOM 100 O TYR A 29 3.135 -8.745 3.268 1.00 0.00 O ATOM 101 CB TYR A 29 2.310 -9.430 6.025 1.00 0.00 C ATOM 102 CG TYR A 29 3.592 -10.190 6.369 1.00 0.00 C ATOM 103 CD1 TYR A 29 4.304 -9.864 7.505 1.00 0.00 C ATOM 104 CD2 TYR A 29 4.038 -11.202 5.543 1.00 0.00 C ATOM 105 CE1 TYR A 29 5.511 -10.579 7.829 1.00 0.00 C ATOM 106 CE2 TYR A 29 5.245 -11.917 5.867 1.00 0.00 C ATOM 107 CZ TYR A 29 5.922 -11.570 6.994 1.00 0.00 C ATOM 108 OH TYR A 29 7.062 -12.246 7.300 1.00 0.00 O ATOM 0 H TYR A 29 1.021 -7.583 4.115 1.00 0.00 H new ATOM 0 HA TYR A 29 3.024 -7.364 6.211 1.00 0.00 H new ATOM 0 HB2 TYR A 29 1.689 -9.363 6.918 1.00 0.00 H new ATOM 0 HB3 TYR A 29 1.747 -10.002 5.287 1.00 0.00 H new ATOM 0 HD1 TYR A 29 3.956 -9.072 8.152 1.00 0.00 H new ATOM 0 HD2 TYR A 29 3.481 -11.458 4.653 1.00 0.00 H new ATOM 0 HE1 TYR A 29 6.077 -10.334 8.715 1.00 0.00 H new ATOM 0 HE2 TYR A 29 5.605 -12.711 5.229 1.00 0.00 H new ATOM 0 HH TYR A 29 7.233 -12.926 6.616 1.00 0.00 H new ATOM 118 N CYS A 30 4.618 -7.453 4.383 1.00 0.00 N ATOM 119 CA CYS A 30 5.592 -7.447 3.305 1.00 0.00 C ATOM 120 C CYS A 30 6.363 -8.768 3.347 1.00 0.00 C ATOM 121 O CYS A 30 6.647 -9.291 4.423 1.00 0.00 O ATOM 122 CB CYS A 30 6.526 -6.238 3.393 1.00 0.00 C ATOM 123 SG CYS A 30 6.447 -5.272 1.841 1.00 0.00 S ATOM 0 H CYS A 30 4.894 -6.924 5.210 1.00 0.00 H new ATOM 0 HA CYS A 30 5.078 -7.357 2.348 1.00 0.00 H new ATOM 0 HB2 CYS A 30 6.242 -5.609 4.237 1.00 0.00 H new ATOM 0 HB3 CYS A 30 7.548 -6.570 3.573 1.00 0.00 H new ATOM 0 HG CYS A 30 5.219 -4.907 1.619 1.00 0.00 H new ATOM 129 N SER A 31 6.679 -9.269 2.162 1.00 0.00 N ATOM 130 CA SER A 31 7.411 -10.519 2.049 1.00 0.00 C ATOM 131 C SER A 31 8.745 -10.414 2.792 1.00 0.00 C ATOM 132 O SER A 31 8.816 -10.690 3.989 1.00 0.00 O ATOM 133 CB SER A 31 7.648 -10.889 0.584 1.00 0.00 C ATOM 134 OG SER A 31 8.267 -9.830 -0.141 1.00 0.00 O ATOM 0 H SER A 31 6.441 -8.832 1.272 1.00 0.00 H new ATOM 0 HA SER A 31 6.811 -11.308 2.502 1.00 0.00 H new ATOM 0 HB2 SER A 31 8.275 -11.779 0.532 1.00 0.00 H new ATOM 0 HB3 SER A 31 6.697 -11.141 0.115 1.00 0.00 H new ATOM 0 HG SER A 31 9.042 -10.177 -0.629 1.00 0.00 H new ATOM 168 N HIS A 35 7.681 -5.883 6.671 1.00 0.00 N ATOM 169 CA HIS A 35 7.096 -4.696 7.271 1.00 0.00 C ATOM 170 C HIS A 35 5.572 -4.755 7.144 1.00 0.00 C ATOM 171 O HIS A 35 5.044 -5.473 6.296 1.00 0.00 O ATOM 172 CB HIS A 35 7.693 -3.427 6.660 1.00 0.00 C ATOM 173 CG HIS A 35 9.087 -3.108 7.146 1.00 0.00 C ATOM 174 ND1 HIS A 35 10.082 -4.064 7.250 1.00 0.00 N ATOM 175 CD2 HIS A 35 9.640 -1.930 7.556 1.00 0.00 C ATOM 176 CE1 HIS A 35 11.180 -3.477 7.702 1.00 0.00 C ATOM 177 NE2 HIS A 35 10.904 -2.155 7.892 1.00 0.00 N ATOM 0 HA HIS A 35 7.337 -4.665 8.334 1.00 0.00 H new ATOM 0 HB2 HIS A 35 7.713 -3.533 5.575 1.00 0.00 H new ATOM 0 HB3 HIS A 35 7.039 -2.585 6.886 1.00 0.00 H new ATOM 0 HD1 HIS A 35 9.986 -5.053 7.018 1.00 0.00 H new ATOM 0 HD2 HIS A 35 9.135 -0.976 7.600 1.00 0.00 H new ATOM 0 HE1 HIS A 35 12.128 -3.961 7.888 1.00 0.00 H new ATOM 185 N PHE A 36 4.909 -3.991 7.999 1.00 0.00 N ATOM 186 CA PHE A 36 3.457 -3.947 7.994 1.00 0.00 C ATOM 187 C PHE A 36 2.952 -2.526 7.732 1.00 0.00 C ATOM 188 O PHE A 36 2.875 -1.712 8.650 1.00 0.00 O ATOM 189 CB PHE A 36 2.991 -4.393 9.381 1.00 0.00 C ATOM 190 CG PHE A 36 3.390 -5.826 9.740 1.00 0.00 C ATOM 191 CD1 PHE A 36 4.650 -6.091 10.178 1.00 0.00 C ATOM 192 CD2 PHE A 36 2.485 -6.834 9.622 1.00 0.00 C ATOM 193 CE1 PHE A 36 5.021 -7.420 10.512 1.00 0.00 C ATOM 194 CE2 PHE A 36 2.856 -8.163 9.956 1.00 0.00 C ATOM 195 CZ PHE A 36 4.116 -8.428 10.394 1.00 0.00 C ATOM 0 H PHE A 36 5.351 -3.397 8.701 1.00 0.00 H new ATOM 0 HA PHE A 36 3.068 -4.593 7.207 1.00 0.00 H new ATOM 0 HB2 PHE A 36 3.403 -3.714 10.127 1.00 0.00 H new ATOM 0 HB3 PHE A 36 1.906 -4.305 9.434 1.00 0.00 H new ATOM 0 HD1 PHE A 36 5.369 -5.290 10.272 1.00 0.00 H new ATOM 0 HD2 PHE A 36 1.484 -6.624 9.274 1.00 0.00 H new ATOM 0 HE1 PHE A 36 6.022 -7.630 10.860 1.00 0.00 H new ATOM 0 HE2 PHE A 36 2.137 -8.964 9.862 1.00 0.00 H new ATOM 0 HZ PHE A 36 4.398 -9.439 10.648 1.00 0.00 H new ATOM 205 N LEU A 37 2.623 -2.273 6.474 1.00 0.00 N ATOM 206 CA LEU A 37 2.128 -0.965 6.079 1.00 0.00 C ATOM 207 C LEU A 37 1.176 -0.438 7.156 1.00 0.00 C ATOM 208 O LEU A 37 0.444 -1.210 7.773 1.00 0.00 O ATOM 209 CB LEU A 37 1.504 -1.027 4.684 1.00 0.00 C ATOM 210 CG LEU A 37 2.199 -0.199 3.601 1.00 0.00 C ATOM 211 CD1 LEU A 37 1.896 -0.754 2.208 1.00 0.00 C ATOM 212 CD2 LEU A 37 1.830 1.281 3.720 1.00 0.00 C ATOM 0 H LEU A 37 2.689 -2.951 5.715 1.00 0.00 H new ATOM 0 HA LEU A 37 2.950 -0.253 6.004 1.00 0.00 H new ATOM 0 HB2 LEU A 37 1.486 -2.068 4.362 1.00 0.00 H new ATOM 0 HB3 LEU A 37 0.468 -0.697 4.756 1.00 0.00 H new ATOM 0 HG LEU A 37 3.276 -0.275 3.752 1.00 0.00 H new ATOM 0 HD11 LEU A 37 2.402 -0.147 1.457 1.00 0.00 H new ATOM 0 HD12 LEU A 37 2.249 -1.783 2.142 1.00 0.00 H new ATOM 0 HD13 LEU A 37 0.821 -0.727 2.032 1.00 0.00 H new ATOM 0 HD21 LEU A 37 2.338 1.846 2.938 1.00 0.00 H new ATOM 0 HD22 LEU A 37 0.752 1.397 3.610 1.00 0.00 H new ATOM 0 HD23 LEU A 37 2.137 1.655 4.696 1.00 0.00 H new ATOM 224 N ARG A 38 1.218 0.872 7.347 1.00 0.00 N ATOM 225 CA ARG A 38 0.369 1.511 8.338 1.00 0.00 C ATOM 226 C ARG A 38 -0.187 2.828 7.792 1.00 0.00 C ATOM 227 O ARG A 38 0.517 3.564 7.102 1.00 0.00 O ATOM 228 CB ARG A 38 1.141 1.788 9.629 1.00 0.00 C ATOM 229 CG ARG A 38 2.288 2.770 9.382 1.00 0.00 C ATOM 230 CD ARG A 38 2.867 3.282 10.703 1.00 0.00 C ATOM 231 NE ARG A 38 3.293 2.141 11.544 1.00 0.00 N ATOM 232 CZ ARG A 38 3.978 2.266 12.689 1.00 0.00 C ATOM 233 NH1 ARG A 38 4.320 3.483 13.135 1.00 0.00 N ATOM 234 NH2 ARG A 38 4.323 1.176 13.386 1.00 0.00 N ATOM 0 H ARG A 38 1.827 1.509 6.832 1.00 0.00 H new ATOM 0 HA ARG A 38 -0.453 0.830 8.559 1.00 0.00 H new ATOM 0 HB2 ARG A 38 0.465 2.195 10.381 1.00 0.00 H new ATOM 0 HB3 ARG A 38 1.537 0.854 10.028 1.00 0.00 H new ATOM 0 HG2 ARG A 38 3.071 2.281 8.803 1.00 0.00 H new ATOM 0 HG3 ARG A 38 1.930 3.611 8.788 1.00 0.00 H new ATOM 0 HD2 ARG A 38 3.716 3.938 10.508 1.00 0.00 H new ATOM 0 HD3 ARG A 38 2.121 3.875 11.231 1.00 0.00 H new ATOM 0 HE ARG A 38 3.050 1.201 11.233 1.00 0.00 H new ATOM 0 HH11 ARG A 38 4.059 4.313 12.603 1.00 0.00 H new ATOM 0 HH12 ARG A 38 4.841 3.579 14.006 1.00 0.00 H new ATOM 0 HH21 ARG A 38 4.064 0.250 13.045 1.00 0.00 H new ATOM 0 HH22 ARG A 38 4.844 1.272 14.257 1.00 0.00 H new ATOM 248 N ILE A 39 -1.445 3.084 8.121 1.00 0.00 N ATOM 249 CA ILE A 39 -2.103 4.299 7.671 1.00 0.00 C ATOM 250 C ILE A 39 -2.551 5.111 8.888 1.00 0.00 C ATOM 251 O ILE A 39 -3.328 4.627 9.710 1.00 0.00 O ATOM 252 CB ILE A 39 -3.239 3.966 6.702 1.00 0.00 C ATOM 253 CG1 ILE A 39 -3.382 5.051 5.632 1.00 0.00 C ATOM 254 CG2 ILE A 39 -4.549 3.726 7.455 1.00 0.00 C ATOM 255 CD1 ILE A 39 -3.675 4.434 4.263 1.00 0.00 C ATOM 0 H ILE A 39 -2.026 2.471 8.693 1.00 0.00 H new ATOM 0 HA ILE A 39 -1.408 4.923 7.109 1.00 0.00 H new ATOM 0 HB ILE A 39 -2.989 3.038 6.188 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -4.186 5.734 5.907 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -2.466 5.640 5.581 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -5.340 3.491 6.743 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -4.424 2.893 8.146 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -4.818 4.623 8.013 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -3.772 5.226 3.520 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -2.858 3.770 3.981 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -4.604 3.866 4.311 1.00 0.00 H new ATOM 267 N LEU A 40 -2.041 6.331 8.966 1.00 0.00 N ATOM 268 CA LEU A 40 -2.379 7.215 10.068 1.00 0.00 C ATOM 269 C LEU A 40 -3.555 8.105 9.661 1.00 0.00 C ATOM 270 O LEU A 40 -3.599 8.606 8.539 1.00 0.00 O ATOM 271 CB LEU A 40 -1.146 7.996 10.526 1.00 0.00 C ATOM 272 CG LEU A 40 0.205 7.318 10.288 1.00 0.00 C ATOM 273 CD1 LEU A 40 1.321 8.354 10.144 1.00 0.00 C ATOM 274 CD2 LEU A 40 0.507 6.298 11.387 1.00 0.00 C ATOM 0 H LEU A 40 -1.396 6.728 8.283 1.00 0.00 H new ATOM 0 HA LEU A 40 -2.702 6.637 10.934 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -1.141 8.960 10.017 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -1.245 8.200 11.592 1.00 0.00 H new ATOM 0 HG LEU A 40 0.152 6.771 9.347 1.00 0.00 H new ATOM 0 HD11 LEU A 40 2.270 7.845 9.976 1.00 0.00 H new ATOM 0 HD12 LEU A 40 1.104 9.007 9.299 1.00 0.00 H new ATOM 0 HD13 LEU A 40 1.385 8.949 11.055 1.00 0.00 H new ATOM 0 HD21 LEU A 40 1.473 5.831 11.194 1.00 0.00 H new ATOM 0 HD22 LEU A 40 0.534 6.802 12.353 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -0.270 5.534 11.398 1.00 0.00 H new ATOM 286 N PRO A 41 -4.503 8.280 10.620 1.00 0.00 N ATOM 287 CA PRO A 41 -5.676 9.101 10.373 1.00 0.00 C ATOM 288 C PRO A 41 -5.321 10.588 10.405 1.00 0.00 C ATOM 289 O PRO A 41 -6.206 11.442 10.407 1.00 0.00 O ATOM 290 CB PRO A 41 -6.669 8.704 11.453 1.00 0.00 C ATOM 291 CG PRO A 41 -5.854 8.020 12.538 1.00 0.00 C ATOM 292 CD PRO A 41 -4.484 7.702 11.961 1.00 0.00 C ATOM 0 HA PRO A 41 -6.100 8.940 9.382 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -7.188 9.578 11.847 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -7.431 8.033 11.056 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -5.760 8.667 13.410 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -6.350 7.108 12.870 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -3.689 8.135 12.568 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -4.309 6.627 11.926 1.00 0.00 H new ATOM 300 N ASP A 42 -4.023 10.854 10.429 1.00 0.00 N ATOM 301 CA ASP A 42 -3.539 12.223 10.461 1.00 0.00 C ATOM 302 C ASP A 42 -3.264 12.696 9.032 1.00 0.00 C ATOM 303 O ASP A 42 -3.352 13.888 8.741 1.00 0.00 O ATOM 304 CB ASP A 42 -2.235 12.329 11.253 1.00 0.00 C ATOM 305 CG ASP A 42 -2.381 12.893 12.668 1.00 0.00 C ATOM 306 OD1 ASP A 42 -2.429 14.137 12.781 1.00 0.00 O ATOM 307 OD2 ASP A 42 -2.441 12.068 13.605 1.00 0.00 O ATOM 0 H ASP A 42 -3.291 10.143 10.427 1.00 0.00 H new ATOM 0 HA ASP A 42 -4.301 12.838 10.939 1.00 0.00 H new ATOM 0 HB2 ASP A 42 -1.785 11.338 11.318 1.00 0.00 H new ATOM 0 HB3 ASP A 42 -1.540 12.959 10.697 1.00 0.00 H new ATOM 312 N GLY A 43 -2.936 11.737 8.179 1.00 0.00 N ATOM 313 CA GLY A 43 -2.648 12.041 6.787 1.00 0.00 C ATOM 314 C GLY A 43 -1.221 11.628 6.421 1.00 0.00 C ATOM 315 O GLY A 43 -0.652 12.137 5.456 1.00 0.00 O ATOM 0 H GLY A 43 -2.863 10.750 8.424 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -3.358 11.521 6.143 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -2.779 13.108 6.609 1.00 0.00 H new ATOM 319 N THR A 44 -0.683 10.709 7.210 1.00 0.00 N ATOM 320 CA THR A 44 0.666 10.222 6.981 1.00 0.00 C ATOM 321 C THR A 44 0.667 8.699 6.844 1.00 0.00 C ATOM 322 O THR A 44 -0.077 8.009 7.538 1.00 0.00 O ATOM 323 CB THR A 44 1.552 10.730 8.120 1.00 0.00 C ATOM 324 OG1 THR A 44 1.760 12.106 7.811 1.00 0.00 O ATOM 325 CG2 THR A 44 2.957 10.124 8.085 1.00 0.00 C ATOM 0 H THR A 44 -1.158 10.289 8.009 1.00 0.00 H new ATOM 0 HA THR A 44 1.069 10.602 6.042 1.00 0.00 H new ATOM 0 HB THR A 44 1.081 10.500 9.076 1.00 0.00 H new ATOM 0 HG1 THR A 44 2.324 12.514 8.500 1.00 0.00 H new ATOM 0 HG21 THR A 44 3.544 10.518 8.915 1.00 0.00 H new ATOM 0 HG22 THR A 44 2.888 9.040 8.172 1.00 0.00 H new ATOM 0 HG23 THR A 44 3.441 10.382 7.143 1.00 0.00 H new ATOM 333 N VAL A 45 1.512 8.218 5.943 1.00 0.00 N ATOM 334 CA VAL A 45 1.620 6.789 5.706 1.00 0.00 C ATOM 335 C VAL A 45 3.076 6.355 5.881 1.00 0.00 C ATOM 336 O VAL A 45 3.977 7.192 5.913 1.00 0.00 O ATOM 337 CB VAL A 45 1.055 6.443 4.326 1.00 0.00 C ATOM 338 CG1 VAL A 45 0.545 5.001 4.288 1.00 0.00 C ATOM 339 CG2 VAL A 45 -0.047 7.425 3.923 1.00 0.00 C ATOM 0 H VAL A 45 2.128 8.793 5.369 1.00 0.00 H new ATOM 0 HA VAL A 45 1.027 6.236 6.434 1.00 0.00 H new ATOM 0 HB VAL A 45 1.864 6.531 3.601 1.00 0.00 H new ATOM 0 HG11 VAL A 45 0.149 4.781 3.297 1.00 0.00 H new ATOM 0 HG12 VAL A 45 1.366 4.319 4.510 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -0.243 4.874 5.030 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -0.431 7.157 2.939 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -0.856 7.383 4.652 1.00 0.00 H new ATOM 0 HG23 VAL A 45 0.360 8.436 3.890 1.00 0.00 H new ATOM 349 N ASP A 46 3.263 5.048 5.989 1.00 0.00 N ATOM 350 CA ASP A 46 4.595 4.493 6.161 1.00 0.00 C ATOM 351 C ASP A 46 4.486 2.991 6.428 1.00 0.00 C ATOM 352 O ASP A 46 3.407 2.412 6.312 1.00 0.00 O ATOM 353 CB ASP A 46 5.310 5.135 7.351 1.00 0.00 C ATOM 354 CG ASP A 46 4.418 5.980 8.263 1.00 0.00 C ATOM 355 OD1 ASP A 46 3.279 5.531 8.517 1.00 0.00 O ATOM 356 OD2 ASP A 46 4.894 7.056 8.684 1.00 0.00 O ATOM 0 H ASP A 46 2.514 4.357 5.961 1.00 0.00 H new ATOM 0 HA ASP A 46 5.162 4.690 5.251 1.00 0.00 H new ATOM 0 HB2 ASP A 46 5.770 4.347 7.947 1.00 0.00 H new ATOM 0 HB3 ASP A 46 6.117 5.763 6.975 1.00 0.00 H new ATOM 361 N GLY A 47 5.619 2.402 6.782 1.00 0.00 N ATOM 362 CA GLY A 47 5.666 0.978 7.067 1.00 0.00 C ATOM 363 C GLY A 47 6.310 0.712 8.429 1.00 0.00 C ATOM 364 O GLY A 47 6.927 1.602 9.012 1.00 0.00 O ATOM 0 H GLY A 47 6.512 2.886 6.878 1.00 0.00 H new ATOM 0 HA2 GLY A 47 4.657 0.567 7.052 1.00 0.00 H new ATOM 0 HA3 GLY A 47 6.231 0.466 6.288 1.00 0.00 H new ATOM 368 N THR A 48 6.144 -0.517 8.896 1.00 0.00 N ATOM 369 CA THR A 48 6.702 -0.911 10.179 1.00 0.00 C ATOM 370 C THR A 48 7.212 -2.352 10.118 1.00 0.00 C ATOM 371 O THR A 48 6.460 -3.267 9.784 1.00 0.00 O ATOM 372 CB THR A 48 5.630 -0.690 11.248 1.00 0.00 C ATOM 373 OG1 THR A 48 5.275 0.682 11.105 1.00 0.00 O ATOM 374 CG2 THR A 48 6.192 -0.784 12.668 1.00 0.00 C ATOM 0 H THR A 48 5.631 -1.253 8.409 1.00 0.00 H new ATOM 0 HA THR A 48 7.569 -0.303 10.437 1.00 0.00 H new ATOM 0 HB THR A 48 4.835 -1.425 11.123 1.00 0.00 H new ATOM 0 HG1 THR A 48 6.087 1.231 11.097 1.00 0.00 H new ATOM 0 HG21 THR A 48 5.390 -0.620 13.388 1.00 0.00 H new ATOM 0 HG22 THR A 48 6.623 -1.773 12.824 1.00 0.00 H new ATOM 0 HG23 THR A 48 6.964 -0.026 12.805 1.00 0.00 H new ATOM 382 N ARG A 49 8.486 -2.509 10.445 1.00 0.00 N ATOM 383 CA ARG A 49 9.105 -3.824 10.432 1.00 0.00 C ATOM 384 C ARG A 49 8.189 -4.849 11.102 1.00 0.00 C ATOM 385 O ARG A 49 8.267 -6.041 10.810 1.00 0.00 O ATOM 386 CB ARG A 49 10.453 -3.805 11.156 1.00 0.00 C ATOM 387 CG ARG A 49 11.456 -4.736 10.473 1.00 0.00 C ATOM 388 CD ARG A 49 11.908 -5.848 11.422 1.00 0.00 C ATOM 389 NE ARG A 49 13.373 -6.032 11.325 1.00 0.00 N ATOM 390 CZ ARG A 49 14.012 -7.162 11.658 1.00 0.00 C ATOM 391 NH1 ARG A 49 13.318 -8.215 12.112 1.00 0.00 N ATOM 392 NH2 ARG A 49 15.344 -7.239 11.538 1.00 0.00 N ATOM 0 H ARG A 49 9.107 -1.748 10.721 1.00 0.00 H new ATOM 0 HA ARG A 49 9.268 -4.103 9.391 1.00 0.00 H new ATOM 0 HB2 ARG A 49 10.847 -2.789 11.172 1.00 0.00 H new ATOM 0 HB3 ARG A 49 10.317 -4.110 12.194 1.00 0.00 H new ATOM 0 HG2 ARG A 49 11.003 -5.174 9.584 1.00 0.00 H new ATOM 0 HG3 ARG A 49 12.321 -4.163 10.141 1.00 0.00 H new ATOM 0 HD2 ARG A 49 11.632 -5.598 12.446 1.00 0.00 H new ATOM 0 HD3 ARG A 49 11.399 -6.779 11.173 1.00 0.00 H new ATOM 0 HE ARG A 49 13.931 -5.250 10.983 1.00 0.00 H new ATOM 0 HH11 ARG A 49 12.304 -8.156 12.204 1.00 0.00 H new ATOM 0 HH12 ARG A 49 13.804 -9.075 12.366 1.00 0.00 H new ATOM 0 HH21 ARG A 49 15.872 -6.437 11.193 1.00 0.00 H new ATOM 0 HH22 ARG A 49 15.830 -8.099 11.792 1.00 0.00 H new ATOM 406 N ASP A 50 7.340 -4.348 11.988 1.00 0.00 N ATOM 407 CA ASP A 50 6.410 -5.205 12.702 1.00 0.00 C ATOM 408 C ASP A 50 5.203 -4.379 13.152 1.00 0.00 C ATOM 409 O ASP A 50 5.363 -3.326 13.768 1.00 0.00 O ATOM 410 CB ASP A 50 7.061 -5.808 13.948 1.00 0.00 C ATOM 411 CG ASP A 50 7.524 -7.259 13.798 1.00 0.00 C ATOM 412 OD1 ASP A 50 8.090 -7.566 12.726 1.00 0.00 O ATOM 413 OD2 ASP A 50 7.302 -8.028 14.758 1.00 0.00 O ATOM 0 H ASP A 50 7.277 -3.358 12.227 1.00 0.00 H new ATOM 0 HA ASP A 50 6.108 -6.007 12.029 1.00 0.00 H new ATOM 0 HB2 ASP A 50 7.919 -5.195 14.224 1.00 0.00 H new ATOM 0 HB3 ASP A 50 6.351 -5.752 14.773 1.00 0.00 H new ATOM 418 N ARG A 51 4.024 -4.886 12.826 1.00 0.00 N ATOM 419 CA ARG A 51 2.791 -4.208 13.189 1.00 0.00 C ATOM 420 C ARG A 51 2.813 -3.823 14.670 1.00 0.00 C ATOM 421 O ARG A 51 2.408 -4.609 15.525 1.00 0.00 O ATOM 422 CB ARG A 51 1.574 -5.095 12.918 1.00 0.00 C ATOM 423 CG ARG A 51 1.670 -6.410 13.693 1.00 0.00 C ATOM 424 CD ARG A 51 1.672 -7.608 12.742 1.00 0.00 C ATOM 425 NE ARG A 51 2.921 -8.385 12.908 1.00 0.00 N ATOM 426 CZ ARG A 51 3.042 -9.686 12.609 1.00 0.00 C ATOM 427 NH1 ARG A 51 1.992 -10.363 12.126 1.00 0.00 N ATOM 428 NH2 ARG A 51 4.214 -10.309 12.792 1.00 0.00 N ATOM 0 H ARG A 51 3.896 -5.759 12.314 1.00 0.00 H new ATOM 0 HA ARG A 51 2.715 -3.309 12.577 1.00 0.00 H new ATOM 0 HB2 ARG A 51 0.664 -4.567 13.203 1.00 0.00 H new ATOM 0 HB3 ARG A 51 1.501 -5.303 11.850 1.00 0.00 H new ATOM 0 HG2 ARG A 51 2.579 -6.417 14.294 1.00 0.00 H new ATOM 0 HG3 ARG A 51 0.831 -6.491 14.384 1.00 0.00 H new ATOM 0 HD2 ARG A 51 0.809 -8.243 12.943 1.00 0.00 H new ATOM 0 HD3 ARG A 51 1.582 -7.265 11.711 1.00 0.00 H new ATOM 0 HE ARG A 51 3.741 -7.900 13.273 1.00 0.00 H new ATOM 0 HH11 ARG A 51 1.100 -9.889 11.986 1.00 0.00 H new ATOM 0 HH12 ARG A 51 2.084 -11.353 11.899 1.00 0.00 H new ATOM 0 HH21 ARG A 51 5.014 -9.793 13.159 1.00 0.00 H new ATOM 0 HH22 ARG A 51 4.306 -11.299 12.565 1.00 0.00 H new ATOM 442 N SER A 52 3.290 -2.614 14.927 1.00 0.00 N ATOM 443 CA SER A 52 3.371 -2.116 16.290 1.00 0.00 C ATOM 444 C SER A 52 2.889 -0.665 16.345 1.00 0.00 C ATOM 445 O SER A 52 3.534 0.184 16.959 1.00 0.00 O ATOM 446 CB SER A 52 4.797 -2.223 16.832 1.00 0.00 C ATOM 447 OG SER A 52 5.578 -1.074 16.512 1.00 0.00 O ATOM 0 H SER A 52 3.624 -1.965 14.215 1.00 0.00 H new ATOM 0 HA SER A 52 2.726 -2.731 16.918 1.00 0.00 H new ATOM 0 HB2 SER A 52 4.765 -2.350 17.914 1.00 0.00 H new ATOM 0 HB3 SER A 52 5.275 -3.112 16.421 1.00 0.00 H new ATOM 0 HG SER A 52 5.204 -0.288 16.963 1.00 0.00 H new ATOM 453 N ASP A 53 1.760 -0.424 15.695 1.00 0.00 N ATOM 454 CA ASP A 53 1.184 0.909 15.663 1.00 0.00 C ATOM 455 C ASP A 53 -0.212 0.873 16.287 1.00 0.00 C ATOM 456 O ASP A 53 -0.613 -0.138 16.861 1.00 0.00 O ATOM 457 CB ASP A 53 1.046 1.415 14.226 1.00 0.00 C ATOM 458 CG ASP A 53 1.527 2.849 13.996 1.00 0.00 C ATOM 459 OD1 ASP A 53 2.430 3.273 14.749 1.00 0.00 O ATOM 460 OD2 ASP A 53 0.981 3.490 13.072 1.00 0.00 O ATOM 0 H ASP A 53 1.228 -1.130 15.186 1.00 0.00 H new ATOM 0 HA ASP A 53 1.845 1.574 16.218 1.00 0.00 H new ATOM 0 HB2 ASP A 53 1.605 0.750 13.568 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -0.001 1.348 13.932 1.00 0.00 H new ATOM 465 N GLN A 54 -0.914 1.989 16.155 1.00 0.00 N ATOM 466 CA GLN A 54 -2.257 2.097 16.699 1.00 0.00 C ATOM 467 C GLN A 54 -3.278 1.536 15.708 1.00 0.00 C ATOM 468 O GLN A 54 -4.233 0.870 16.106 1.00 0.00 O ATOM 469 CB GLN A 54 -2.586 3.547 17.063 1.00 0.00 C ATOM 470 CG GLN A 54 -2.019 4.515 16.023 1.00 0.00 C ATOM 471 CD GLN A 54 -0.633 5.015 16.437 1.00 0.00 C ATOM 472 OE1 GLN A 54 -0.370 5.309 17.592 1.00 0.00 O ATOM 473 NE2 GLN A 54 0.236 5.094 15.433 1.00 0.00 N ATOM 0 H GLN A 54 -0.578 2.826 15.679 1.00 0.00 H new ATOM 0 HA GLN A 54 -2.306 1.507 17.614 1.00 0.00 H new ATOM 0 HB2 GLN A 54 -3.667 3.673 17.131 1.00 0.00 H new ATOM 0 HB3 GLN A 54 -2.176 3.781 18.045 1.00 0.00 H new ATOM 0 HG2 GLN A 54 -1.956 4.018 15.055 1.00 0.00 H new ATOM 0 HG3 GLN A 54 -2.694 5.362 15.903 1.00 0.00 H new ATOM 0 HE21 GLN A 54 -0.050 4.832 14.489 1.00 0.00 H new ATOM 0 HE22 GLN A 54 1.188 5.416 15.607 1.00 0.00 H new ATOM 482 N HIS A 55 -3.042 1.824 14.436 1.00 0.00 N ATOM 483 CA HIS A 55 -3.929 1.356 13.385 1.00 0.00 C ATOM 484 C HIS A 55 -3.165 1.286 12.062 1.00 0.00 C ATOM 485 O HIS A 55 -2.976 2.302 11.395 1.00 0.00 O ATOM 486 CB HIS A 55 -5.181 2.231 13.302 1.00 0.00 C ATOM 487 CG HIS A 55 -4.986 3.634 13.823 1.00 0.00 C ATOM 488 ND1 HIS A 55 -3.968 4.463 13.383 1.00 0.00 N ATOM 489 CD2 HIS A 55 -5.688 4.346 14.752 1.00 0.00 C ATOM 490 CE1 HIS A 55 -4.063 5.618 14.025 1.00 0.00 C ATOM 491 NE2 HIS A 55 -5.128 5.544 14.873 1.00 0.00 N ATOM 0 H HIS A 55 -2.249 2.376 14.110 1.00 0.00 H new ATOM 0 HA HIS A 55 -4.275 0.349 13.617 1.00 0.00 H new ATOM 0 HB2 HIS A 55 -5.507 2.282 12.263 1.00 0.00 H new ATOM 0 HB3 HIS A 55 -5.983 1.754 13.865 1.00 0.00 H new ATOM 0 HD1 HIS A 55 -3.265 4.225 12.684 1.00 0.00 H new ATOM 0 HD2 HIS A 55 -6.552 3.995 15.296 1.00 0.00 H new ATOM 0 HE1 HIS A 55 -3.411 6.469 13.899 1.00 0.00 H new ATOM 499 N ILE A 56 -2.746 0.076 11.721 1.00 0.00 N ATOM 500 CA ILE A 56 -2.006 -0.140 10.489 1.00 0.00 C ATOM 501 C ILE A 56 -2.847 -0.994 9.537 1.00 0.00 C ATOM 502 O ILE A 56 -2.320 -1.578 8.592 1.00 0.00 O ATOM 503 CB ILE A 56 -0.627 -0.729 10.788 1.00 0.00 C ATOM 504 CG1 ILE A 56 -0.685 -2.257 10.851 1.00 0.00 C ATOM 505 CG2 ILE A 56 -0.037 -0.126 12.065 1.00 0.00 C ATOM 506 CD1 ILE A 56 -1.722 -2.725 11.874 1.00 0.00 C ATOM 0 H ILE A 56 -2.905 -0.765 12.276 1.00 0.00 H new ATOM 0 HA ILE A 56 -1.819 0.809 9.986 1.00 0.00 H new ATOM 0 HB ILE A 56 0.041 -0.465 9.968 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -0.934 -2.656 9.868 1.00 0.00 H new ATOM 0 HG13 ILE A 56 0.296 -2.651 11.116 1.00 0.00 H new ATOM 0 HG21 ILE A 56 0.944 -0.562 12.254 1.00 0.00 H new ATOM 0 HG22 ILE A 56 0.063 0.953 11.946 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -0.697 -0.338 12.906 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -1.743 -3.815 11.899 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -1.457 -2.345 12.861 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -2.706 -2.350 11.593 1.00 0.00 H new ATOM 518 N GLN A 57 -4.140 -1.039 9.821 1.00 0.00 N ATOM 519 CA GLN A 57 -5.059 -1.812 9.002 1.00 0.00 C ATOM 520 C GLN A 57 -5.169 -1.199 7.605 1.00 0.00 C ATOM 521 O GLN A 57 -4.733 -0.070 7.382 1.00 0.00 O ATOM 522 CB GLN A 57 -6.433 -1.913 9.666 1.00 0.00 C ATOM 523 CG GLN A 57 -6.321 -2.507 11.072 1.00 0.00 C ATOM 524 CD GLN A 57 -6.430 -1.416 12.139 1.00 0.00 C ATOM 525 OE1 GLN A 57 -5.724 -0.421 12.121 1.00 0.00 O ATOM 526 NE2 GLN A 57 -7.352 -1.657 13.067 1.00 0.00 N ATOM 0 H GLN A 57 -4.573 -0.553 10.606 1.00 0.00 H new ATOM 0 HA GLN A 57 -4.664 -2.823 8.904 1.00 0.00 H new ATOM 0 HB2 GLN A 57 -6.888 -0.924 9.720 1.00 0.00 H new ATOM 0 HB3 GLN A 57 -7.090 -2.533 9.057 1.00 0.00 H new ATOM 0 HG2 GLN A 57 -7.107 -3.247 11.222 1.00 0.00 H new ATOM 0 HG3 GLN A 57 -5.369 -3.028 11.176 1.00 0.00 H new ATOM 0 HE21 GLN A 57 -7.909 -2.510 13.023 1.00 0.00 H new ATOM 0 HE22 GLN A 57 -7.502 -0.988 13.823 1.00 0.00 H new ATOM 535 N LEU A 58 -5.755 -1.969 6.700 1.00 0.00 N ATOM 536 CA LEU A 58 -5.929 -1.515 5.330 1.00 0.00 C ATOM 537 C LEU A 58 -7.098 -2.268 4.692 1.00 0.00 C ATOM 538 O LEU A 58 -7.769 -3.057 5.356 1.00 0.00 O ATOM 539 CB LEU A 58 -4.617 -1.644 4.553 1.00 0.00 C ATOM 540 CG LEU A 58 -3.412 -0.910 5.145 1.00 0.00 C ATOM 541 CD1 LEU A 58 -2.121 -1.305 4.424 1.00 0.00 C ATOM 542 CD2 LEU A 58 -3.633 0.604 5.137 1.00 0.00 C ATOM 0 H LEU A 58 -6.115 -2.904 6.888 1.00 0.00 H new ATOM 0 HA LEU A 58 -6.183 -0.455 5.309 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -4.369 -2.702 4.471 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -4.780 -1.276 3.540 1.00 0.00 H new ATOM 0 HG LEU A 58 -3.305 -1.214 6.186 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -1.280 -0.769 4.864 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -1.961 -2.378 4.526 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -2.201 -1.049 3.368 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -2.762 1.101 5.563 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -3.780 0.945 4.112 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -4.515 0.846 5.730 1.00 0.00 H new ATOM 554 N GLN A 59 -7.306 -1.998 3.412 1.00 0.00 N ATOM 555 CA GLN A 59 -8.382 -2.640 2.677 1.00 0.00 C ATOM 556 C GLN A 59 -8.296 -2.285 1.191 1.00 0.00 C ATOM 557 O GLN A 59 -8.136 -1.118 0.837 1.00 0.00 O ATOM 558 CB GLN A 59 -9.746 -2.256 3.254 1.00 0.00 C ATOM 559 CG GLN A 59 -10.809 -3.293 2.886 1.00 0.00 C ATOM 560 CD GLN A 59 -11.710 -3.604 4.083 1.00 0.00 C ATOM 561 OE1 GLN A 59 -12.808 -3.089 4.216 1.00 0.00 O ATOM 562 NE2 GLN A 59 -11.187 -4.473 4.942 1.00 0.00 N ATOM 0 H GLN A 59 -6.747 -1.343 2.865 1.00 0.00 H new ATOM 0 HA GLN A 59 -8.272 -3.720 2.780 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -9.675 -2.172 4.338 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -10.042 -1.277 2.877 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -11.413 -2.921 2.058 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -10.326 -4.208 2.543 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -10.262 -4.866 4.770 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -11.711 -4.747 5.773 1.00 0.00 H new ATOM 571 N LEU A 60 -8.406 -3.313 0.362 1.00 0.00 N ATOM 572 CA LEU A 60 -8.343 -3.124 -1.077 1.00 0.00 C ATOM 573 C LEU A 60 -9.762 -3.106 -1.648 1.00 0.00 C ATOM 574 O LEU A 60 -10.702 -3.559 -0.997 1.00 0.00 O ATOM 575 CB LEU A 60 -7.436 -4.178 -1.716 1.00 0.00 C ATOM 576 CG LEU A 60 -6.348 -4.763 -0.814 1.00 0.00 C ATOM 577 CD1 LEU A 60 -5.869 -6.117 -1.341 1.00 0.00 C ATOM 578 CD2 LEU A 60 -5.193 -3.775 -0.638 1.00 0.00 C ATOM 0 H LEU A 60 -8.538 -4.280 0.660 1.00 0.00 H new ATOM 0 HA LEU A 60 -7.892 -2.161 -1.315 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -8.060 -4.996 -2.076 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -6.957 -3.735 -2.589 1.00 0.00 H new ATOM 0 HG LEU A 60 -6.778 -4.935 0.173 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -5.096 -6.511 -0.682 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -6.708 -6.812 -1.373 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -5.462 -5.993 -2.345 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -4.433 -4.215 0.007 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -4.756 -3.549 -1.611 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -5.566 -2.856 -0.185 1.00 0.00 H new ATOM 590 N SER A 61 -9.873 -2.577 -2.857 1.00 0.00 N ATOM 591 CA SER A 61 -11.162 -2.493 -3.523 1.00 0.00 C ATOM 592 C SER A 61 -10.982 -2.657 -5.033 1.00 0.00 C ATOM 593 O SER A 61 -11.440 -1.821 -5.811 1.00 0.00 O ATOM 594 CB SER A 61 -11.857 -1.167 -3.212 1.00 0.00 C ATOM 595 OG SER A 61 -12.878 -0.864 -4.159 1.00 0.00 O ATOM 0 H SER A 61 -9.091 -2.202 -3.394 1.00 0.00 H new ATOM 0 HA SER A 61 -11.793 -3.299 -3.149 1.00 0.00 H new ATOM 0 HB2 SER A 61 -12.291 -1.211 -2.213 1.00 0.00 H new ATOM 0 HB3 SER A 61 -11.120 -0.364 -3.205 1.00 0.00 H new ATOM 0 HG SER A 61 -12.476 -0.738 -5.044 1.00 0.00 H new ATOM 601 N ALA A 62 -10.315 -3.740 -5.404 1.00 0.00 N ATOM 602 CA ALA A 62 -10.069 -4.025 -6.807 1.00 0.00 C ATOM 603 C ALA A 62 -11.319 -3.678 -7.620 1.00 0.00 C ATOM 604 O ALA A 62 -12.416 -4.137 -7.304 1.00 0.00 O ATOM 605 CB ALA A 62 -9.658 -5.490 -6.967 1.00 0.00 C ATOM 0 H ALA A 62 -9.937 -4.431 -4.756 1.00 0.00 H new ATOM 0 HA ALA A 62 -9.249 -3.414 -7.184 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -9.474 -5.703 -8.020 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -8.750 -5.678 -6.394 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -10.457 -6.134 -6.601 1.00 0.00 H new ATOM 611 N GLU A 63 -11.111 -2.872 -8.650 1.00 0.00 N ATOM 612 CA GLU A 63 -12.207 -2.459 -9.510 1.00 0.00 C ATOM 613 C GLU A 63 -11.936 -2.881 -10.955 1.00 0.00 C ATOM 614 O GLU A 63 -12.738 -2.607 -11.847 1.00 0.00 O ATOM 615 CB GLU A 63 -12.440 -0.949 -9.415 1.00 0.00 C ATOM 616 CG GLU A 63 -11.228 -0.174 -9.935 1.00 0.00 C ATOM 617 CD GLU A 63 -11.484 0.362 -11.345 1.00 0.00 C ATOM 618 OE1 GLU A 63 -12.670 0.613 -11.650 1.00 0.00 O ATOM 619 OE2 GLU A 63 -10.488 0.507 -12.087 1.00 0.00 O ATOM 0 H GLU A 63 -10.200 -2.494 -8.909 1.00 0.00 H new ATOM 0 HA GLU A 63 -13.116 -2.956 -9.171 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -13.325 -0.677 -9.991 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -12.636 -0.672 -8.379 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -11.005 0.654 -9.262 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -10.352 -0.823 -9.942 1.00 0.00 H new ATOM 626 N SER A 64 -10.803 -3.542 -11.142 1.00 0.00 N ATOM 627 CA SER A 64 -10.417 -4.006 -12.464 1.00 0.00 C ATOM 628 C SER A 64 -8.915 -4.294 -12.499 1.00 0.00 C ATOM 629 O SER A 64 -8.104 -3.421 -12.193 1.00 0.00 O ATOM 630 CB SER A 64 -10.785 -2.979 -13.537 1.00 0.00 C ATOM 631 OG SER A 64 -12.019 -3.295 -14.176 1.00 0.00 O ATOM 0 H SER A 64 -10.140 -3.767 -10.400 1.00 0.00 H new ATOM 0 HA SER A 64 -10.962 -4.925 -12.677 1.00 0.00 H new ATOM 0 HB2 SER A 64 -10.854 -1.990 -13.084 1.00 0.00 H new ATOM 0 HB3 SER A 64 -9.991 -2.933 -14.283 1.00 0.00 H new ATOM 0 HG SER A 64 -12.760 -3.129 -13.557 1.00 0.00 H new ATOM 637 N VAL A 65 -8.589 -5.522 -12.874 1.00 0.00 N ATOM 638 CA VAL A 65 -7.198 -5.937 -12.953 1.00 0.00 C ATOM 639 C VAL A 65 -6.353 -4.772 -13.473 1.00 0.00 C ATOM 640 O VAL A 65 -6.827 -3.961 -14.266 1.00 0.00 O ATOM 641 CB VAL A 65 -7.075 -7.196 -13.814 1.00 0.00 C ATOM 642 CG1 VAL A 65 -7.182 -8.458 -12.956 1.00 0.00 C ATOM 643 CG2 VAL A 65 -8.122 -7.201 -14.930 1.00 0.00 C ATOM 0 H VAL A 65 -9.264 -6.244 -13.127 1.00 0.00 H new ATOM 0 HA VAL A 65 -6.820 -6.198 -11.965 1.00 0.00 H new ATOM 0 HB VAL A 65 -6.089 -7.190 -14.280 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -7.092 -9.339 -13.592 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -6.384 -8.462 -12.214 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -8.147 -8.473 -12.450 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -8.013 -8.106 -15.527 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -9.120 -7.173 -14.493 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -7.980 -6.327 -15.566 1.00 0.00 H new ATOM 653 N GLY A 66 -5.114 -4.727 -13.003 1.00 0.00 N ATOM 654 CA GLY A 66 -4.198 -3.676 -13.411 1.00 0.00 C ATOM 655 C GLY A 66 -4.620 -2.325 -12.829 1.00 0.00 C ATOM 656 O GLY A 66 -4.072 -1.287 -13.199 1.00 0.00 O ATOM 0 H GLY A 66 -4.724 -5.401 -12.344 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -3.189 -3.919 -13.080 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -4.170 -3.615 -14.499 1.00 0.00 H new ATOM 660 N GLU A 67 -5.589 -2.382 -11.928 1.00 0.00 N ATOM 661 CA GLU A 67 -6.091 -1.176 -11.291 1.00 0.00 C ATOM 662 C GLU A 67 -7.070 -1.534 -10.172 1.00 0.00 C ATOM 663 O GLU A 67 -8.202 -1.937 -10.437 1.00 0.00 O ATOM 664 CB GLU A 67 -6.745 -0.246 -12.315 1.00 0.00 C ATOM 665 CG GLU A 67 -6.313 1.205 -12.093 1.00 0.00 C ATOM 666 CD GLU A 67 -7.143 2.161 -12.953 1.00 0.00 C ATOM 667 OE1 GLU A 67 -7.621 1.702 -14.013 1.00 0.00 O ATOM 668 OE2 GLU A 67 -7.281 3.329 -12.530 1.00 0.00 O ATOM 0 H GLU A 67 -6.040 -3.245 -11.624 1.00 0.00 H new ATOM 0 HA GLU A 67 -5.247 -0.643 -10.852 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -6.473 -0.560 -13.323 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -7.830 -0.322 -12.240 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -6.426 1.465 -11.041 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -5.256 1.315 -12.337 1.00 0.00 H new ATOM 675 N VAL A 68 -6.599 -1.376 -8.943 1.00 0.00 N ATOM 676 CA VAL A 68 -7.420 -1.678 -7.783 1.00 0.00 C ATOM 677 C VAL A 68 -7.429 -0.471 -6.842 1.00 0.00 C ATOM 678 O VAL A 68 -6.614 0.439 -6.986 1.00 0.00 O ATOM 679 CB VAL A 68 -6.921 -2.958 -7.109 1.00 0.00 C ATOM 680 CG1 VAL A 68 -7.093 -4.166 -8.031 1.00 0.00 C ATOM 681 CG2 VAL A 68 -5.465 -2.811 -6.663 1.00 0.00 C ATOM 0 H VAL A 68 -5.660 -1.043 -8.726 1.00 0.00 H new ATOM 0 HA VAL A 68 -8.451 -1.864 -8.082 1.00 0.00 H new ATOM 0 HB VAL A 68 -7.528 -3.127 -6.220 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -6.731 -5.062 -7.528 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -8.148 -4.289 -8.277 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -6.523 -4.009 -8.947 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -5.135 -3.735 -6.187 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -4.838 -2.606 -7.530 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -5.383 -1.988 -5.953 1.00 0.00 H new ATOM 691 N TYR A 69 -8.360 -0.503 -5.900 1.00 0.00 N ATOM 692 CA TYR A 69 -8.485 0.577 -4.936 1.00 0.00 C ATOM 693 C TYR A 69 -8.061 0.117 -3.539 1.00 0.00 C ATOM 694 O TYR A 69 -7.941 -1.080 -3.286 1.00 0.00 O ATOM 695 CB TYR A 69 -9.970 0.947 -4.908 1.00 0.00 C ATOM 696 CG TYR A 69 -10.368 2.001 -5.944 1.00 0.00 C ATOM 697 CD1 TYR A 69 -9.793 3.255 -5.908 1.00 0.00 C ATOM 698 CD2 TYR A 69 -11.301 1.697 -6.914 1.00 0.00 C ATOM 699 CE1 TYR A 69 -10.168 4.247 -6.883 1.00 0.00 C ATOM 700 CE2 TYR A 69 -11.675 2.688 -7.889 1.00 0.00 C ATOM 701 CZ TYR A 69 -11.090 3.914 -7.825 1.00 0.00 C ATOM 702 OH TYR A 69 -11.443 4.851 -8.746 1.00 0.00 O ATOM 0 H TYR A 69 -9.035 -1.259 -5.784 1.00 0.00 H new ATOM 0 HA TYR A 69 -7.849 1.417 -5.216 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -10.562 0.047 -5.075 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -10.224 1.315 -3.914 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -9.062 3.493 -5.149 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -11.751 0.716 -6.942 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -9.727 5.233 -6.866 1.00 0.00 H new ATOM 0 HE2 TYR A 69 -12.404 2.463 -8.654 1.00 0.00 H new ATOM 0 HH TYR A 69 -12.110 4.474 -9.357 1.00 0.00 H new ATOM 712 N ILE A 70 -7.845 1.094 -2.670 1.00 0.00 N ATOM 713 CA ILE A 70 -7.437 0.805 -1.306 1.00 0.00 C ATOM 714 C ILE A 70 -8.079 1.821 -0.360 1.00 0.00 C ATOM 715 O ILE A 70 -7.955 3.028 -0.562 1.00 0.00 O ATOM 716 CB ILE A 70 -5.911 0.748 -1.204 1.00 0.00 C ATOM 717 CG1 ILE A 70 -5.353 -0.447 -1.980 1.00 0.00 C ATOM 718 CG2 ILE A 70 -5.459 0.745 0.258 1.00 0.00 C ATOM 719 CD1 ILE A 70 -3.830 -0.518 -1.856 1.00 0.00 C ATOM 0 H ILE A 70 -7.945 2.086 -2.884 1.00 0.00 H new ATOM 0 HA ILE A 70 -7.791 -0.181 -1.003 1.00 0.00 H new ATOM 0 HB ILE A 70 -5.504 1.648 -1.665 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -5.796 -1.369 -1.603 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -5.633 -0.366 -3.030 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -4.371 0.704 0.302 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -5.808 1.654 0.749 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -5.876 -0.125 0.766 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -3.459 -1.376 -2.417 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -3.389 0.395 -2.256 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -3.555 -0.624 -0.807 1.00 0.00 H new ATOM 731 N LYS A 71 -8.752 1.295 0.654 1.00 0.00 N ATOM 732 CA LYS A 71 -9.414 2.141 1.632 1.00 0.00 C ATOM 733 C LYS A 71 -8.945 1.753 3.036 1.00 0.00 C ATOM 734 O LYS A 71 -9.030 0.589 3.423 1.00 0.00 O ATOM 735 CB LYS A 71 -10.932 2.081 1.452 1.00 0.00 C ATOM 736 CG LYS A 71 -11.595 3.363 1.960 1.00 0.00 C ATOM 737 CD LYS A 71 -12.479 3.078 3.176 1.00 0.00 C ATOM 738 CE LYS A 71 -11.632 2.881 4.435 1.00 0.00 C ATOM 739 NZ LYS A 71 -10.864 4.109 4.740 1.00 0.00 N ATOM 0 H LYS A 71 -8.853 0.293 0.819 1.00 0.00 H new ATOM 0 HA LYS A 71 -9.139 3.185 1.481 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -11.172 1.936 0.399 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -11.332 1.222 1.991 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -10.829 4.092 2.225 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -12.195 3.806 1.165 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -13.174 3.904 3.326 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -13.079 2.186 2.993 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -12.276 2.629 5.278 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -10.949 2.043 4.294 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -10.295 3.958 5.597 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -10.236 4.333 3.942 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -11.521 4.900 4.896 1.00 0.00 H new ATOM 753 N SER A 72 -8.460 2.751 3.760 1.00 0.00 N ATOM 754 CA SER A 72 -7.978 2.529 5.112 1.00 0.00 C ATOM 755 C SER A 72 -9.145 2.161 6.031 1.00 0.00 C ATOM 756 O SER A 72 -9.551 2.960 6.874 1.00 0.00 O ATOM 757 CB SER A 72 -7.250 3.764 5.647 1.00 0.00 C ATOM 758 OG SER A 72 -7.245 3.806 7.072 1.00 0.00 O ATOM 0 H SER A 72 -8.391 3.715 3.435 1.00 0.00 H new ATOM 0 HA SER A 72 -7.267 1.703 5.090 1.00 0.00 H new ATOM 0 HB2 SER A 72 -6.223 3.767 5.281 1.00 0.00 H new ATOM 0 HB3 SER A 72 -7.729 4.663 5.260 1.00 0.00 H new ATOM 0 HG SER A 72 -8.167 3.848 7.401 1.00 0.00 H new ATOM 764 N THR A 73 -9.651 0.953 5.836 1.00 0.00 N ATOM 765 CA THR A 73 -10.764 0.470 6.636 1.00 0.00 C ATOM 766 C THR A 73 -10.447 0.605 8.127 1.00 0.00 C ATOM 767 O THR A 73 -9.905 -0.316 8.736 1.00 0.00 O ATOM 768 CB THR A 73 -11.066 -0.967 6.207 1.00 0.00 C ATOM 769 OG1 THR A 73 -12.289 -1.278 6.870 1.00 0.00 O ATOM 770 CG2 THR A 73 -10.066 -1.973 6.781 1.00 0.00 C ATOM 0 H THR A 73 -9.311 0.294 5.136 1.00 0.00 H new ATOM 0 HA THR A 73 -11.659 1.069 6.470 1.00 0.00 H new ATOM 0 HB THR A 73 -11.059 -1.029 5.119 1.00 0.00 H new ATOM 0 HG1 THR A 73 -12.559 -2.193 6.646 1.00 0.00 H new ATOM 0 HG21 THR A 73 -10.327 -2.977 6.446 1.00 0.00 H new ATOM 0 HG22 THR A 73 -9.062 -1.725 6.437 1.00 0.00 H new ATOM 0 HG23 THR A 73 -10.096 -1.935 7.870 1.00 0.00 H new ATOM 778 N GLU A 74 -10.798 1.761 8.671 1.00 0.00 N ATOM 779 CA GLU A 74 -10.558 2.028 10.079 1.00 0.00 C ATOM 780 C GLU A 74 -10.857 3.494 10.399 1.00 0.00 C ATOM 781 O GLU A 74 -11.492 3.796 11.408 1.00 0.00 O ATOM 782 CB GLU A 74 -9.125 1.663 10.470 1.00 0.00 C ATOM 783 CG GLU A 74 -9.110 0.680 11.643 1.00 0.00 C ATOM 784 CD GLU A 74 -9.945 -0.563 11.328 1.00 0.00 C ATOM 785 OE1 GLU A 74 -9.363 -1.504 10.747 1.00 0.00 O ATOM 786 OE2 GLU A 74 -11.145 -0.543 11.676 1.00 0.00 O ATOM 0 H GLU A 74 -11.246 2.523 8.162 1.00 0.00 H new ATOM 0 HA GLU A 74 -11.230 1.403 10.667 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -8.612 1.222 9.615 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -8.577 2.566 10.740 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -8.084 0.387 11.863 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -9.500 1.168 12.536 1.00 0.00 H new ATOM 793 N THR A 75 -10.384 4.367 9.521 1.00 0.00 N ATOM 794 CA THR A 75 -10.592 5.794 9.698 1.00 0.00 C ATOM 795 C THR A 75 -11.698 6.291 8.764 1.00 0.00 C ATOM 796 O THR A 75 -12.881 6.095 9.039 1.00 0.00 O ATOM 797 CB THR A 75 -9.252 6.498 9.480 1.00 0.00 C ATOM 798 OG1 THR A 75 -8.916 6.196 8.128 1.00 0.00 O ATOM 799 CG2 THR A 75 -8.120 5.868 10.294 1.00 0.00 C ATOM 0 H THR A 75 -9.857 4.113 8.685 1.00 0.00 H new ATOM 0 HA THR A 75 -10.935 6.022 10.707 1.00 0.00 H new ATOM 0 HB THR A 75 -9.348 7.551 9.746 1.00 0.00 H new ATOM 0 HG1 THR A 75 -8.060 6.616 7.902 1.00 0.00 H new ATOM 0 HG21 THR A 75 -7.191 6.406 10.102 1.00 0.00 H new ATOM 0 HG22 THR A 75 -8.360 5.925 11.356 1.00 0.00 H new ATOM 0 HG23 THR A 75 -8.001 4.824 10.005 1.00 0.00 H new ATOM 807 N GLY A 76 -11.274 6.924 7.681 1.00 0.00 N ATOM 808 CA GLY A 76 -12.214 7.450 6.705 1.00 0.00 C ATOM 809 C GLY A 76 -11.479 8.077 5.519 1.00 0.00 C ATOM 810 O GLY A 76 -11.946 9.059 4.943 1.00 0.00 O ATOM 0 H GLY A 76 -10.292 7.085 7.457 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -12.864 6.649 6.352 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -12.854 8.196 7.176 1.00 0.00 H new ATOM 814 N GLN A 77 -10.340 7.485 5.189 1.00 0.00 N ATOM 815 CA GLN A 77 -9.536 7.973 4.082 1.00 0.00 C ATOM 816 C GLN A 77 -9.259 6.843 3.088 1.00 0.00 C ATOM 817 O GLN A 77 -9.859 5.773 3.176 1.00 0.00 O ATOM 818 CB GLN A 77 -8.231 8.595 4.584 1.00 0.00 C ATOM 819 CG GLN A 77 -7.998 9.967 3.950 1.00 0.00 C ATOM 820 CD GLN A 77 -7.944 11.062 5.017 1.00 0.00 C ATOM 821 OE1 GLN A 77 -6.903 11.625 5.314 1.00 0.00 O ATOM 822 NE2 GLN A 77 -9.121 11.332 5.575 1.00 0.00 N ATOM 0 H GLN A 77 -9.955 6.672 5.669 1.00 0.00 H new ATOM 0 HA GLN A 77 -10.097 8.753 3.567 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -8.265 8.693 5.669 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -7.396 7.935 4.349 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -7.065 9.957 3.386 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -8.797 10.184 3.241 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -9.954 10.823 5.280 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -9.190 12.048 6.298 1.00 0.00 H new ATOM 831 N TYR A 78 -8.349 7.120 2.165 1.00 0.00 N ATOM 832 CA TYR A 78 -7.985 6.139 1.156 1.00 0.00 C ATOM 833 C TYR A 78 -6.470 6.109 0.943 1.00 0.00 C ATOM 834 O TYR A 78 -5.760 7.012 1.382 1.00 0.00 O ATOM 835 CB TYR A 78 -8.661 6.595 -0.138 1.00 0.00 C ATOM 836 CG TYR A 78 -10.134 6.193 -0.246 1.00 0.00 C ATOM 837 CD1 TYR A 78 -11.110 6.993 0.312 1.00 0.00 C ATOM 838 CD2 TYR A 78 -10.485 5.030 -0.900 1.00 0.00 C ATOM 839 CE1 TYR A 78 -12.496 6.614 0.210 1.00 0.00 C ATOM 840 CE2 TYR A 78 -11.870 4.651 -1.002 1.00 0.00 C ATOM 841 CZ TYR A 78 -12.808 5.462 -0.441 1.00 0.00 C ATOM 842 OH TYR A 78 -14.116 5.104 -0.537 1.00 0.00 O ATOM 0 H TYR A 78 -7.853 8.009 2.095 1.00 0.00 H new ATOM 0 HA TYR A 78 -8.297 5.140 1.461 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -8.585 7.680 -0.213 1.00 0.00 H new ATOM 0 HB3 TYR A 78 -8.118 6.178 -0.986 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -10.835 7.903 0.825 1.00 0.00 H new ATOM 0 HD2 TYR A 78 -9.720 4.404 -1.336 1.00 0.00 H new ATOM 0 HE1 TYR A 78 -13.270 7.231 0.641 1.00 0.00 H new ATOM 0 HE2 TYR A 78 -12.158 3.744 -1.512 1.00 0.00 H new ATOM 0 HH TYR A 78 -14.189 4.260 -1.029 1.00 0.00 H new ATOM 852 N LEU A 79 -6.020 5.061 0.269 1.00 0.00 N ATOM 853 CA LEU A 79 -4.603 4.901 -0.008 1.00 0.00 C ATOM 854 C LEU A 79 -4.320 5.320 -1.452 1.00 0.00 C ATOM 855 O LEU A 79 -5.053 4.946 -2.366 1.00 0.00 O ATOM 856 CB LEU A 79 -4.150 3.477 0.319 1.00 0.00 C ATOM 857 CG LEU A 79 -2.641 3.270 0.466 1.00 0.00 C ATOM 858 CD1 LEU A 79 -2.053 4.238 1.494 1.00 0.00 C ATOM 859 CD2 LEU A 79 -2.318 1.812 0.801 1.00 0.00 C ATOM 0 H LEU A 79 -6.612 4.314 -0.094 1.00 0.00 H new ATOM 0 HA LEU A 79 -4.013 5.554 0.636 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -4.631 3.168 1.247 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -4.513 2.812 -0.465 1.00 0.00 H new ATOM 0 HG LEU A 79 -2.170 3.492 -0.492 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -0.979 4.070 1.579 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -2.235 5.264 1.174 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -2.525 4.071 2.462 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -1.239 1.692 0.900 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -2.801 1.539 1.739 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -2.683 1.166 0.003 1.00 0.00 H new ATOM 871 N ALA A 80 -3.254 6.090 -1.613 1.00 0.00 N ATOM 872 CA ALA A 80 -2.865 6.564 -2.930 1.00 0.00 C ATOM 873 C ALA A 80 -1.360 6.839 -2.945 1.00 0.00 C ATOM 874 O ALA A 80 -0.638 6.407 -2.047 1.00 0.00 O ATOM 875 CB ALA A 80 -3.687 7.802 -3.292 1.00 0.00 C ATOM 0 H ALA A 80 -2.647 6.397 -0.853 1.00 0.00 H new ATOM 0 HA ALA A 80 -3.069 5.805 -3.685 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -3.394 8.157 -4.280 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -4.747 7.546 -3.297 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -3.507 8.586 -2.557 1.00 0.00 H new ATOM 881 N MET A 81 -0.931 7.555 -3.974 1.00 0.00 N ATOM 882 CA MET A 81 0.475 7.892 -4.117 1.00 0.00 C ATOM 883 C MET A 81 0.651 9.178 -4.927 1.00 0.00 C ATOM 884 O MET A 81 0.796 9.132 -6.148 1.00 0.00 O ATOM 885 CB MET A 81 1.207 6.745 -4.815 1.00 0.00 C ATOM 886 CG MET A 81 2.355 6.219 -3.949 1.00 0.00 C ATOM 887 SD MET A 81 3.804 5.950 -4.955 1.00 0.00 S ATOM 888 CE MET A 81 3.811 4.166 -5.017 1.00 0.00 C ATOM 0 H MET A 81 -1.533 7.911 -4.717 1.00 0.00 H new ATOM 0 HA MET A 81 0.894 8.050 -3.123 1.00 0.00 H new ATOM 0 HB2 MET A 81 0.507 5.937 -5.026 1.00 0.00 H new ATOM 0 HB3 MET A 81 1.597 7.088 -5.773 1.00 0.00 H new ATOM 0 HG2 MET A 81 2.580 6.932 -3.156 1.00 0.00 H new ATOM 0 HG3 MET A 81 2.060 5.288 -3.466 1.00 0.00 H new ATOM 0 HE1 MET A 81 4.254 3.836 -5.957 1.00 0.00 H new ATOM 0 HE2 MET A 81 4.395 3.775 -4.184 1.00 0.00 H new ATOM 0 HE3 MET A 81 2.788 3.796 -4.949 1.00 0.00 H new ATOM 898 N ASP A 82 0.631 10.296 -4.215 1.00 0.00 N ATOM 899 CA ASP A 82 0.787 11.592 -4.853 1.00 0.00 C ATOM 900 C ASP A 82 1.997 11.554 -5.789 1.00 0.00 C ATOM 901 O ASP A 82 2.708 10.552 -5.848 1.00 0.00 O ATOM 902 CB ASP A 82 1.025 12.691 -3.816 1.00 0.00 C ATOM 903 CG ASP A 82 -0.099 12.871 -2.794 1.00 0.00 C ATOM 904 OD1 ASP A 82 -1.239 13.118 -3.242 1.00 0.00 O ATOM 905 OD2 ASP A 82 0.208 12.757 -1.588 1.00 0.00 O ATOM 0 H ASP A 82 0.509 10.331 -3.203 1.00 0.00 H new ATOM 0 HA ASP A 82 -0.128 11.808 -5.404 1.00 0.00 H new ATOM 0 HB2 ASP A 82 1.949 12.471 -3.282 1.00 0.00 H new ATOM 0 HB3 ASP A 82 1.175 13.636 -4.338 1.00 0.00 H new ATOM 910 N THR A 83 2.193 12.656 -6.496 1.00 0.00 N ATOM 911 CA THR A 83 3.305 12.762 -7.426 1.00 0.00 C ATOM 912 C THR A 83 4.636 12.651 -6.680 1.00 0.00 C ATOM 913 O THR A 83 5.685 12.473 -7.297 1.00 0.00 O ATOM 914 CB THR A 83 3.150 14.071 -8.201 1.00 0.00 C ATOM 915 OG1 THR A 83 2.073 13.818 -9.099 1.00 0.00 O ATOM 916 CG2 THR A 83 4.342 14.352 -9.119 1.00 0.00 C ATOM 0 H THR A 83 1.600 13.485 -6.444 1.00 0.00 H new ATOM 0 HA THR A 83 3.301 11.941 -8.143 1.00 0.00 H new ATOM 0 HB THR A 83 3.029 14.896 -7.499 1.00 0.00 H new ATOM 0 HG1 THR A 83 1.904 14.617 -9.640 1.00 0.00 H new ATOM 0 HG21 THR A 83 4.182 15.293 -9.646 1.00 0.00 H new ATOM 0 HG22 THR A 83 5.252 14.420 -8.523 1.00 0.00 H new ATOM 0 HG23 THR A 83 4.442 13.543 -9.843 1.00 0.00 H new ATOM 924 N ASP A 84 4.550 12.761 -5.362 1.00 0.00 N ATOM 925 CA ASP A 84 5.735 12.675 -4.525 1.00 0.00 C ATOM 926 C ASP A 84 5.966 11.217 -4.123 1.00 0.00 C ATOM 927 O ASP A 84 6.636 10.942 -3.129 1.00 0.00 O ATOM 928 CB ASP A 84 5.566 13.497 -3.246 1.00 0.00 C ATOM 929 CG ASP A 84 6.713 14.463 -2.942 1.00 0.00 C ATOM 930 OD1 ASP A 84 7.818 14.217 -3.473 1.00 0.00 O ATOM 931 OD2 ASP A 84 6.460 15.425 -2.186 1.00 0.00 O ATOM 0 H ASP A 84 3.678 12.909 -4.853 1.00 0.00 H new ATOM 0 HA ASP A 84 6.579 13.063 -5.095 1.00 0.00 H new ATOM 0 HB2 ASP A 84 4.640 14.067 -3.318 1.00 0.00 H new ATOM 0 HB3 ASP A 84 5.454 12.813 -2.405 1.00 0.00 H new ATOM 936 N GLY A 85 5.398 10.321 -4.917 1.00 0.00 N ATOM 937 CA GLY A 85 5.533 8.898 -4.656 1.00 0.00 C ATOM 938 C GLY A 85 5.483 8.608 -3.154 1.00 0.00 C ATOM 939 O GLY A 85 6.088 7.647 -2.683 1.00 0.00 O ATOM 0 H GLY A 85 4.843 10.553 -5.741 1.00 0.00 H new ATOM 0 HA2 GLY A 85 4.735 8.355 -5.162 1.00 0.00 H new ATOM 0 HA3 GLY A 85 6.475 8.537 -5.068 1.00 0.00 H new ATOM 943 N LEU A 86 4.755 9.458 -2.445 1.00 0.00 N ATOM 944 CA LEU A 86 4.617 9.305 -1.006 1.00 0.00 C ATOM 945 C LEU A 86 3.206 8.810 -0.683 1.00 0.00 C ATOM 946 O LEU A 86 2.242 9.570 -0.771 1.00 0.00 O ATOM 947 CB LEU A 86 4.992 10.605 -0.291 1.00 0.00 C ATOM 948 CG LEU A 86 5.402 10.469 1.176 1.00 0.00 C ATOM 949 CD1 LEU A 86 5.818 11.822 1.757 1.00 0.00 C ATOM 950 CD2 LEU A 86 4.293 9.809 1.997 1.00 0.00 C ATOM 0 H LEU A 86 4.255 10.255 -2.839 1.00 0.00 H new ATOM 0 HA LEU A 86 5.312 8.552 -0.634 1.00 0.00 H new ATOM 0 HB2 LEU A 86 5.813 11.072 -0.835 1.00 0.00 H new ATOM 0 HB3 LEU A 86 4.143 11.286 -0.349 1.00 0.00 H new ATOM 0 HG LEU A 86 6.273 9.815 1.228 1.00 0.00 H new ATOM 0 HD11 LEU A 86 6.105 11.697 2.801 1.00 0.00 H new ATOM 0 HD12 LEU A 86 6.664 12.216 1.193 1.00 0.00 H new ATOM 0 HD13 LEU A 86 4.982 12.519 1.691 1.00 0.00 H new ATOM 0 HD21 LEU A 86 4.611 9.725 3.036 1.00 0.00 H new ATOM 0 HD22 LEU A 86 3.389 10.416 1.942 1.00 0.00 H new ATOM 0 HD23 LEU A 86 4.088 8.815 1.599 1.00 0.00 H new ATOM 962 N LEU A 87 3.129 7.539 -0.316 1.00 0.00 N ATOM 963 CA LEU A 87 1.852 6.934 0.021 1.00 0.00 C ATOM 964 C LEU A 87 1.010 7.937 0.812 1.00 0.00 C ATOM 965 O LEU A 87 1.367 8.308 1.930 1.00 0.00 O ATOM 966 CB LEU A 87 2.064 5.603 0.744 1.00 0.00 C ATOM 967 CG LEU A 87 2.671 4.474 -0.092 1.00 0.00 C ATOM 968 CD1 LEU A 87 4.191 4.619 -0.187 1.00 0.00 C ATOM 969 CD2 LEU A 87 2.258 3.105 0.453 1.00 0.00 C ATOM 0 H LEU A 87 3.930 6.912 -0.245 1.00 0.00 H new ATOM 0 HA LEU A 87 1.294 6.693 -0.884 1.00 0.00 H new ATOM 0 HB2 LEU A 87 2.710 5.779 1.604 1.00 0.00 H new ATOM 0 HB3 LEU A 87 1.103 5.265 1.131 1.00 0.00 H new ATOM 0 HG LEU A 87 2.277 4.549 -1.105 1.00 0.00 H new ATOM 0 HD11 LEU A 87 4.597 3.804 -0.786 1.00 0.00 H new ATOM 0 HD12 LEU A 87 4.437 5.572 -0.656 1.00 0.00 H new ATOM 0 HD13 LEU A 87 4.623 4.584 0.813 1.00 0.00 H new ATOM 0 HD21 LEU A 87 2.703 2.320 -0.159 1.00 0.00 H new ATOM 0 HD22 LEU A 87 2.605 3.003 1.481 1.00 0.00 H new ATOM 0 HD23 LEU A 87 1.172 3.015 0.425 1.00 0.00 H new ATOM 981 N TYR A 88 -0.093 8.347 0.203 1.00 0.00 N ATOM 982 CA TYR A 88 -0.988 9.300 0.837 1.00 0.00 C ATOM 983 C TYR A 88 -2.450 8.965 0.532 1.00 0.00 C ATOM 984 O TYR A 88 -2.733 8.128 -0.324 1.00 0.00 O ATOM 985 CB TYR A 88 -0.653 10.663 0.228 1.00 0.00 C ATOM 986 CG TYR A 88 -1.675 11.155 -0.798 1.00 0.00 C ATOM 987 CD1 TYR A 88 -1.755 10.552 -2.037 1.00 0.00 C ATOM 988 CD2 TYR A 88 -2.519 12.202 -0.485 1.00 0.00 C ATOM 989 CE1 TYR A 88 -2.717 11.015 -3.003 1.00 0.00 C ATOM 990 CE2 TYR A 88 -3.481 12.665 -1.451 1.00 0.00 C ATOM 991 CZ TYR A 88 -3.533 12.048 -2.662 1.00 0.00 C ATOM 992 OH TYR A 88 -4.442 12.486 -3.574 1.00 0.00 O ATOM 0 H TYR A 88 -0.387 8.037 -0.723 1.00 0.00 H new ATOM 0 HA TYR A 88 -0.862 9.283 1.920 1.00 0.00 H new ATOM 0 HB2 TYR A 88 -0.575 11.398 1.029 1.00 0.00 H new ATOM 0 HB3 TYR A 88 0.326 10.606 -0.248 1.00 0.00 H new ATOM 0 HD1 TYR A 88 -1.096 9.732 -2.282 1.00 0.00 H new ATOM 0 HD2 TYR A 88 -2.458 12.674 0.485 1.00 0.00 H new ATOM 0 HE1 TYR A 88 -2.789 10.552 -3.976 1.00 0.00 H new ATOM 0 HE2 TYR A 88 -4.146 13.484 -1.219 1.00 0.00 H new ATOM 0 HH TYR A 88 -4.003 13.088 -4.210 1.00 0.00 H new ATOM 1002 N GLY A 89 -3.339 9.635 1.250 1.00 0.00 N ATOM 1003 CA GLY A 89 -4.764 9.418 1.068 1.00 0.00 C ATOM 1004 C GLY A 89 -5.467 10.713 0.652 1.00 0.00 C ATOM 1005 O GLY A 89 -4.985 11.806 0.945 1.00 0.00 O ATOM 0 H GLY A 89 -3.100 10.328 1.959 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -4.925 8.653 0.309 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -5.200 9.045 1.995 1.00 0.00 H new ATOM 1009 N SER A 90 -6.594 10.546 -0.023 1.00 0.00 N ATOM 1010 CA SER A 90 -7.368 11.687 -0.482 1.00 0.00 C ATOM 1011 C SER A 90 -8.849 11.315 -0.566 1.00 0.00 C ATOM 1012 O SER A 90 -9.194 10.137 -0.650 1.00 0.00 O ATOM 1013 CB SER A 90 -6.866 12.182 -1.840 1.00 0.00 C ATOM 1014 OG SER A 90 -6.281 11.134 -2.607 1.00 0.00 O ATOM 0 H SER A 90 -6.990 9.637 -0.263 1.00 0.00 H new ATOM 0 HA SER A 90 -7.244 12.496 0.237 1.00 0.00 H new ATOM 0 HB2 SER A 90 -7.696 12.619 -2.396 1.00 0.00 H new ATOM 0 HB3 SER A 90 -6.132 12.974 -1.689 1.00 0.00 H new ATOM 0 HG SER A 90 -5.389 11.407 -2.907 1.00 0.00 H new ATOM 1020 N GLN A 91 -9.686 12.342 -0.540 1.00 0.00 N ATOM 1021 CA GLN A 91 -11.123 12.138 -0.613 1.00 0.00 C ATOM 1022 C GLN A 91 -11.586 12.132 -2.071 1.00 0.00 C ATOM 1023 O GLN A 91 -12.652 12.655 -2.390 1.00 0.00 O ATOM 1024 CB GLN A 91 -11.870 13.202 0.195 1.00 0.00 C ATOM 1025 CG GLN A 91 -13.375 12.926 0.206 1.00 0.00 C ATOM 1026 CD GLN A 91 -14.164 14.176 -0.190 1.00 0.00 C ATOM 1027 OE1 GLN A 91 -14.891 14.758 0.598 1.00 0.00 O ATOM 1028 NE2 GLN A 91 -13.980 14.554 -1.452 1.00 0.00 N ATOM 0 H GLN A 91 -9.397 13.318 -0.469 1.00 0.00 H new ATOM 0 HA GLN A 91 -11.354 11.167 -0.175 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -11.492 13.219 1.217 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -11.680 14.187 -0.231 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -13.604 12.113 -0.483 1.00 0.00 H new ATOM 0 HG3 GLN A 91 -13.681 12.598 1.199 1.00 0.00 H new ATOM 0 HE21 GLN A 91 -13.357 14.021 -2.058 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -14.462 15.377 -1.813 1.00 0.00 H new ATOM 1037 N THR A 92 -10.761 11.534 -2.918 1.00 0.00 N ATOM 1038 CA THR A 92 -11.071 11.453 -4.335 1.00 0.00 C ATOM 1039 C THR A 92 -10.602 10.114 -4.908 1.00 0.00 C ATOM 1040 O THR A 92 -9.449 9.980 -5.315 1.00 0.00 O ATOM 1041 CB THR A 92 -10.444 12.664 -5.027 1.00 0.00 C ATOM 1042 OG1 THR A 92 -9.057 12.345 -5.095 1.00 0.00 O ATOM 1043 CG2 THR A 92 -10.494 13.925 -4.160 1.00 0.00 C ATOM 0 H THR A 92 -9.877 11.101 -2.650 1.00 0.00 H new ATOM 0 HA THR A 92 -12.147 11.485 -4.507 1.00 0.00 H new ATOM 0 HB THR A 92 -10.959 12.851 -5.969 1.00 0.00 H new ATOM 0 HG1 THR A 92 -8.908 11.452 -4.720 1.00 0.00 H new ATOM 0 HG21 THR A 92 -10.036 14.755 -4.698 1.00 0.00 H new ATOM 0 HG22 THR A 92 -11.532 14.169 -3.932 1.00 0.00 H new ATOM 0 HG23 THR A 92 -9.950 13.750 -3.232 1.00 0.00 H new ATOM 1051 N PRO A 93 -11.543 9.133 -4.923 1.00 0.00 N ATOM 1052 CA PRO A 93 -11.237 7.810 -5.440 1.00 0.00 C ATOM 1053 C PRO A 93 -11.174 7.820 -6.969 1.00 0.00 C ATOM 1054 O PRO A 93 -12.205 7.885 -7.636 1.00 0.00 O ATOM 1055 CB PRO A 93 -12.337 6.912 -4.897 1.00 0.00 C ATOM 1056 CG PRO A 93 -13.468 7.840 -4.485 1.00 0.00 C ATOM 1057 CD PRO A 93 -12.919 9.257 -4.450 1.00 0.00 C ATOM 0 HA PRO A 93 -10.257 7.452 -5.126 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -12.671 6.202 -5.654 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -11.981 6.329 -4.048 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -14.296 7.769 -5.190 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -13.857 7.557 -3.507 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -13.499 9.922 -5.089 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -12.956 9.671 -3.442 1.00 0.00 H new ATOM 1065 N ASN A 94 -9.953 7.754 -7.479 1.00 0.00 N ATOM 1066 CA ASN A 94 -9.741 7.754 -8.916 1.00 0.00 C ATOM 1067 C ASN A 94 -8.407 7.076 -9.231 1.00 0.00 C ATOM 1068 O ASN A 94 -7.810 6.440 -8.364 1.00 0.00 O ATOM 1069 CB ASN A 94 -9.687 9.182 -9.464 1.00 0.00 C ATOM 1070 CG ASN A 94 -10.892 9.997 -8.991 1.00 0.00 C ATOM 1071 OD1 ASN A 94 -11.832 10.248 -9.727 1.00 0.00 O ATOM 1072 ND2 ASN A 94 -10.811 10.396 -7.725 1.00 0.00 N ATOM 0 H ASN A 94 -9.100 7.700 -6.922 1.00 0.00 H new ATOM 0 HA ASN A 94 -10.571 7.220 -9.379 1.00 0.00 H new ATOM 0 HB2 ASN A 94 -8.766 9.666 -9.138 1.00 0.00 H new ATOM 0 HB3 ASN A 94 -9.666 9.157 -10.553 1.00 0.00 H new ATOM 0 HD21 ASN A 94 -11.565 10.947 -7.315 1.00 0.00 H new ATOM 0 HD22 ASN A 94 -9.995 10.151 -7.164 1.00 0.00 H new ATOM 1079 N GLU A 95 -7.978 7.235 -10.475 1.00 0.00 N ATOM 1080 CA GLU A 95 -6.724 6.645 -10.915 1.00 0.00 C ATOM 1081 C GLU A 95 -5.674 6.742 -9.807 1.00 0.00 C ATOM 1082 O GLU A 95 -4.966 5.775 -9.531 1.00 0.00 O ATOM 1083 CB GLU A 95 -6.228 7.309 -12.201 1.00 0.00 C ATOM 1084 CG GLU A 95 -6.977 6.770 -13.421 1.00 0.00 C ATOM 1085 CD GLU A 95 -6.240 7.121 -14.715 1.00 0.00 C ATOM 1086 OE1 GLU A 95 -4.999 7.255 -14.644 1.00 0.00 O ATOM 1087 OE2 GLU A 95 -6.935 7.248 -15.747 1.00 0.00 O ATOM 0 H GLU A 95 -8.476 7.763 -11.192 1.00 0.00 H new ATOM 0 HA GLU A 95 -6.897 5.591 -11.133 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -6.365 8.388 -12.133 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -5.159 7.130 -12.318 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -7.081 5.688 -13.340 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -7.984 7.186 -13.447 1.00 0.00 H new ATOM 1094 N GLU A 96 -5.607 7.919 -9.200 1.00 0.00 N ATOM 1095 CA GLU A 96 -4.655 8.155 -8.128 1.00 0.00 C ATOM 1096 C GLU A 96 -4.849 7.128 -7.011 1.00 0.00 C ATOM 1097 O GLU A 96 -4.039 6.216 -6.853 1.00 0.00 O ATOM 1098 CB GLU A 96 -4.778 9.581 -7.590 1.00 0.00 C ATOM 1099 CG GLU A 96 -3.618 9.914 -6.650 1.00 0.00 C ATOM 1100 CD GLU A 96 -3.284 11.407 -6.698 1.00 0.00 C ATOM 1101 OE1 GLU A 96 -4.159 12.169 -7.160 1.00 0.00 O ATOM 1102 OE2 GLU A 96 -2.160 11.751 -6.272 1.00 0.00 O ATOM 0 H GLU A 96 -6.197 8.719 -9.431 1.00 0.00 H new ATOM 0 HA GLU A 96 -3.648 8.040 -8.530 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -4.792 10.287 -8.420 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -5.724 9.693 -7.060 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -3.878 9.628 -5.631 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -2.740 9.332 -6.930 1.00 0.00 H new ATOM 1109 N CYS A 97 -5.927 7.311 -6.263 1.00 0.00 N ATOM 1110 CA CYS A 97 -6.238 6.412 -5.165 1.00 0.00 C ATOM 1111 C CYS A 97 -5.991 4.977 -5.634 1.00 0.00 C ATOM 1112 O CYS A 97 -5.418 4.172 -4.903 1.00 0.00 O ATOM 1113 CB CYS A 97 -7.669 6.610 -4.660 1.00 0.00 C ATOM 1114 SG CYS A 97 -8.114 5.267 -3.499 1.00 0.00 S ATOM 0 H CYS A 97 -6.596 8.069 -6.396 1.00 0.00 H new ATOM 0 HA CYS A 97 -5.590 6.632 -4.317 1.00 0.00 H new ATOM 0 HB2 CYS A 97 -7.758 7.576 -4.163 1.00 0.00 H new ATOM 0 HB3 CYS A 97 -8.362 6.620 -5.501 1.00 0.00 H new ATOM 0 HG CYS A 97 -9.136 5.633 -2.783 1.00 0.00 H new ATOM 1120 N LEU A 98 -6.437 4.701 -6.850 1.00 0.00 N ATOM 1121 CA LEU A 98 -6.272 3.377 -7.426 1.00 0.00 C ATOM 1122 C LEU A 98 -4.806 2.954 -7.308 1.00 0.00 C ATOM 1123 O LEU A 98 -3.955 3.753 -6.920 1.00 0.00 O ATOM 1124 CB LEU A 98 -6.808 3.344 -8.858 1.00 0.00 C ATOM 1125 CG LEU A 98 -8.173 2.679 -9.048 1.00 0.00 C ATOM 1126 CD1 LEU A 98 -8.960 3.353 -10.174 1.00 0.00 C ATOM 1127 CD2 LEU A 98 -8.021 1.173 -9.276 1.00 0.00 C ATOM 0 H LEU A 98 -6.913 5.372 -7.453 1.00 0.00 H new ATOM 0 HA LEU A 98 -6.862 2.645 -6.874 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -6.871 4.368 -9.225 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -6.083 2.825 -9.484 1.00 0.00 H new ATOM 0 HG LEU A 98 -8.748 2.810 -8.131 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -9.926 2.861 -10.288 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -9.115 4.404 -9.931 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -8.401 3.275 -11.106 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -9.005 0.724 -9.408 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -7.420 0.999 -10.168 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -7.529 0.722 -8.414 1.00 0.00 H new ATOM 1139 N PHE A 99 -4.556 1.699 -7.650 1.00 0.00 N ATOM 1140 CA PHE A 99 -3.208 1.161 -7.588 1.00 0.00 C ATOM 1141 C PHE A 99 -3.020 0.034 -8.607 1.00 0.00 C ATOM 1142 O PHE A 99 -3.412 -1.105 -8.358 1.00 0.00 O ATOM 1143 CB PHE A 99 -3.017 0.595 -6.180 1.00 0.00 C ATOM 1144 CG PHE A 99 -1.929 1.301 -5.368 1.00 0.00 C ATOM 1145 CD1 PHE A 99 -0.786 1.715 -5.978 1.00 0.00 C ATOM 1146 CD2 PHE A 99 -2.105 1.516 -4.037 1.00 0.00 C ATOM 1147 CE1 PHE A 99 0.223 2.371 -5.225 1.00 0.00 C ATOM 1148 CE2 PHE A 99 -1.095 2.171 -3.283 1.00 0.00 C ATOM 1149 CZ PHE A 99 0.048 2.585 -3.893 1.00 0.00 C ATOM 0 H PHE A 99 -5.264 1.039 -7.971 1.00 0.00 H new ATOM 0 HA PHE A 99 -2.484 1.944 -7.814 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -3.961 0.664 -5.640 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -2.770 -0.464 -6.256 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -0.646 1.545 -7.035 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -3.013 1.189 -3.553 1.00 0.00 H new ATOM 0 HE1 PHE A 99 1.130 2.700 -5.710 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -1.235 2.340 -2.226 1.00 0.00 H new ATOM 0 HZ PHE A 99 0.816 3.083 -3.320 1.00 0.00 H new ATOM 1159 N LEU A 100 -2.420 0.392 -9.733 1.00 0.00 N ATOM 1160 CA LEU A 100 -2.175 -0.574 -10.790 1.00 0.00 C ATOM 1161 C LEU A 100 -1.746 -1.905 -10.169 1.00 0.00 C ATOM 1162 O LEU A 100 -0.576 -2.093 -9.842 1.00 0.00 O ATOM 1163 CB LEU A 100 -1.174 -0.017 -11.803 1.00 0.00 C ATOM 1164 CG LEU A 100 -1.707 0.209 -13.219 1.00 0.00 C ATOM 1165 CD1 LEU A 100 -0.999 1.387 -13.890 1.00 0.00 C ATOM 1166 CD2 LEU A 100 -1.608 -1.070 -14.053 1.00 0.00 C ATOM 0 H LEU A 100 -2.096 1.338 -9.936 1.00 0.00 H new ATOM 0 HA LEU A 100 -3.089 -0.764 -11.352 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -0.794 0.931 -11.424 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -0.327 -0.700 -11.860 1.00 0.00 H new ATOM 0 HG LEU A 100 -2.764 0.466 -13.149 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -1.397 1.526 -14.895 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -1.165 2.292 -13.306 1.00 0.00 H new ATOM 0 HD13 LEU A 100 0.070 1.184 -13.948 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -1.993 -0.882 -15.055 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -0.566 -1.382 -14.118 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -2.194 -1.858 -13.581 1.00 0.00 H new ATOM 1178 N GLU A 101 -2.718 -2.795 -10.026 1.00 0.00 N ATOM 1179 CA GLU A 101 -2.455 -4.103 -9.450 1.00 0.00 C ATOM 1180 C GLU A 101 -1.787 -5.013 -10.483 1.00 0.00 C ATOM 1181 O GLU A 101 -1.865 -4.758 -11.684 1.00 0.00 O ATOM 1182 CB GLU A 101 -3.742 -4.734 -8.915 1.00 0.00 C ATOM 1183 CG GLU A 101 -3.430 -5.874 -7.943 1.00 0.00 C ATOM 1184 CD GLU A 101 -4.713 -6.441 -7.332 1.00 0.00 C ATOM 1185 OE1 GLU A 101 -5.676 -6.628 -8.108 1.00 0.00 O ATOM 1186 OE2 GLU A 101 -4.703 -6.675 -6.105 1.00 0.00 O ATOM 0 H GLU A 101 -3.688 -2.636 -10.299 1.00 0.00 H new ATOM 0 HA GLU A 101 -1.773 -3.978 -8.609 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -4.341 -3.975 -8.411 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -4.339 -5.112 -9.745 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -2.892 -6.665 -8.465 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -2.775 -5.512 -7.151 1.00 0.00 H new ATOM 1193 N ARG A 102 -1.144 -6.056 -9.978 1.00 0.00 N ATOM 1194 CA ARG A 102 -0.463 -7.005 -10.841 1.00 0.00 C ATOM 1195 C ARG A 102 0.224 -8.086 -10.004 1.00 0.00 C ATOM 1196 O ARG A 102 1.440 -8.055 -9.821 1.00 0.00 O ATOM 1197 CB ARG A 102 0.581 -6.305 -11.713 1.00 0.00 C ATOM 1198 CG ARG A 102 1.116 -5.048 -11.025 1.00 0.00 C ATOM 1199 CD ARG A 102 1.014 -3.832 -11.948 1.00 0.00 C ATOM 1200 NE ARG A 102 2.351 -3.489 -12.483 1.00 0.00 N ATOM 1201 CZ ARG A 102 3.417 -3.213 -11.720 1.00 0.00 C ATOM 1202 NH1 ARG A 102 3.310 -3.238 -10.385 1.00 0.00 N ATOM 1203 NH2 ARG A 102 4.591 -2.912 -12.293 1.00 0.00 N ATOM 0 H ARG A 102 -1.081 -6.264 -8.981 1.00 0.00 H new ATOM 0 HA ARG A 102 -1.212 -7.462 -11.487 1.00 0.00 H new ATOM 0 HB2 ARG A 102 1.404 -6.989 -11.920 1.00 0.00 H new ATOM 0 HB3 ARG A 102 0.139 -6.038 -12.673 1.00 0.00 H new ATOM 0 HG2 ARG A 102 0.553 -4.863 -10.110 1.00 0.00 H new ATOM 0 HG3 ARG A 102 2.155 -5.202 -10.735 1.00 0.00 H new ATOM 0 HD2 ARG A 102 0.328 -4.044 -12.768 1.00 0.00 H new ATOM 0 HD3 ARG A 102 0.603 -2.983 -11.401 1.00 0.00 H new ATOM 0 HE ARG A 102 2.468 -3.461 -13.496 1.00 0.00 H new ATOM 0 HH11 ARG A 102 2.417 -3.467 -9.949 1.00 0.00 H new ATOM 0 HH12 ARG A 102 4.122 -3.028 -9.804 1.00 0.00 H new ATOM 0 HH21 ARG A 102 4.672 -2.893 -13.310 1.00 0.00 H new ATOM 0 HH22 ARG A 102 5.403 -2.702 -11.712 1.00 0.00 H new ATOM 1217 N LEU A 103 -0.585 -9.016 -9.517 1.00 0.00 N ATOM 1218 CA LEU A 103 -0.070 -10.104 -8.704 1.00 0.00 C ATOM 1219 C LEU A 103 1.316 -10.505 -9.214 1.00 0.00 C ATOM 1220 O LEU A 103 1.432 -11.258 -10.179 1.00 0.00 O ATOM 1221 CB LEU A 103 -1.069 -11.262 -8.664 1.00 0.00 C ATOM 1222 CG LEU A 103 -0.884 -12.269 -7.527 1.00 0.00 C ATOM 1223 CD1 LEU A 103 -1.506 -11.752 -6.229 1.00 0.00 C ATOM 1224 CD2 LEU A 103 -1.431 -13.644 -7.918 1.00 0.00 C ATOM 0 H LEU A 103 -1.593 -9.038 -9.670 1.00 0.00 H new ATOM 0 HA LEU A 103 0.052 -9.782 -7.670 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -2.074 -10.846 -8.594 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -1.011 -11.799 -9.611 1.00 0.00 H new ATOM 0 HG LEU A 103 0.184 -12.387 -7.346 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -1.360 -12.487 -5.438 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -1.029 -10.814 -5.945 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -2.573 -11.586 -6.378 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -1.287 -14.341 -7.092 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -2.494 -13.562 -8.143 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -0.902 -14.009 -8.798 1.00 0.00 H new ATOM 1236 N GLU A 104 2.332 -9.984 -8.541 1.00 0.00 N ATOM 1237 CA GLU A 104 3.705 -10.278 -8.914 1.00 0.00 C ATOM 1238 C GLU A 104 3.873 -11.775 -9.182 1.00 0.00 C ATOM 1239 O GLU A 104 4.242 -12.174 -10.286 1.00 0.00 O ATOM 1240 CB GLU A 104 4.680 -9.801 -7.836 1.00 0.00 C ATOM 1241 CG GLU A 104 6.078 -10.379 -8.066 1.00 0.00 C ATOM 1242 CD GLU A 104 6.514 -11.247 -6.884 1.00 0.00 C ATOM 1243 OE1 GLU A 104 6.480 -10.720 -5.751 1.00 0.00 O ATOM 1244 OE2 GLU A 104 6.872 -12.417 -7.140 1.00 0.00 O ATOM 0 H GLU A 104 2.232 -9.360 -7.740 1.00 0.00 H new ATOM 0 HA GLU A 104 3.936 -9.736 -9.831 1.00 0.00 H new ATOM 0 HB2 GLU A 104 4.728 -8.712 -7.840 1.00 0.00 H new ATOM 0 HB3 GLU A 104 4.316 -10.101 -6.853 1.00 0.00 H new ATOM 0 HG2 GLU A 104 6.084 -10.973 -8.980 1.00 0.00 H new ATOM 0 HG3 GLU A 104 6.792 -9.568 -8.209 1.00 0.00 H new ATOM 1251 N GLU A 105 3.595 -12.563 -8.154 1.00 0.00 N ATOM 1252 CA GLU A 105 3.711 -14.007 -8.265 1.00 0.00 C ATOM 1253 C GLU A 105 2.336 -14.663 -8.114 1.00 0.00 C ATOM 1254 O GLU A 105 1.549 -14.686 -9.059 1.00 0.00 O ATOM 1255 CB GLU A 105 4.697 -14.558 -7.233 1.00 0.00 C ATOM 1256 CG GLU A 105 4.634 -16.086 -7.176 1.00 0.00 C ATOM 1257 CD GLU A 105 6.010 -16.702 -7.435 1.00 0.00 C ATOM 1258 OE1 GLU A 105 6.700 -16.188 -8.342 1.00 0.00 O ATOM 1259 OE2 GLU A 105 6.342 -17.672 -6.720 1.00 0.00 O ATOM 0 H GLU A 105 3.290 -12.229 -7.240 1.00 0.00 H new ATOM 0 HA GLU A 105 4.100 -14.246 -9.255 1.00 0.00 H new ATOM 0 HB2 GLU A 105 5.709 -14.241 -7.486 1.00 0.00 H new ATOM 0 HB3 GLU A 105 4.470 -14.144 -6.251 1.00 0.00 H new ATOM 0 HG2 GLU A 105 4.268 -16.402 -6.199 1.00 0.00 H new ATOM 0 HG3 GLU A 105 3.923 -16.452 -7.916 1.00 0.00 H new ATOM 1266 N ASN A 106 2.090 -15.180 -6.920 1.00 0.00 N ATOM 1267 CA ASN A 106 0.825 -15.834 -6.633 1.00 0.00 C ATOM 1268 C ASN A 106 0.447 -15.587 -5.172 1.00 0.00 C ATOM 1269 O ASN A 106 0.130 -16.524 -4.441 1.00 0.00 O ATOM 1270 CB ASN A 106 0.927 -17.346 -6.846 1.00 0.00 C ATOM 1271 CG ASN A 106 1.807 -17.993 -5.774 1.00 0.00 C ATOM 1272 OD1 ASN A 106 2.473 -17.328 -4.997 1.00 0.00 O ATOM 1273 ND2 ASN A 106 1.774 -19.322 -5.776 1.00 0.00 N ATOM 0 H ASN A 106 2.746 -15.159 -6.139 1.00 0.00 H new ATOM 0 HA ASN A 106 0.073 -15.424 -7.307 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -0.069 -17.788 -6.820 1.00 0.00 H new ATOM 0 HB3 ASN A 106 1.341 -17.551 -7.833 1.00 0.00 H new ATOM 0 HD21 ASN A 106 2.328 -19.847 -5.099 1.00 0.00 H new ATOM 0 HD22 ASN A 106 1.195 -19.817 -6.454 1.00 0.00 H new ATOM 1280 N HIS A 107 0.491 -14.319 -4.789 1.00 0.00 N ATOM 1281 CA HIS A 107 0.157 -13.936 -3.428 1.00 0.00 C ATOM 1282 C HIS A 107 0.295 -12.420 -3.273 1.00 0.00 C ATOM 1283 O HIS A 107 -0.635 -11.752 -2.823 1.00 0.00 O ATOM 1284 CB HIS A 107 1.006 -14.715 -2.421 1.00 0.00 C ATOM 1285 CG HIS A 107 0.358 -15.985 -1.924 1.00 0.00 C ATOM 1286 ND1 HIS A 107 1.052 -16.956 -1.223 1.00 0.00 N ATOM 1287 CD2 HIS A 107 -0.926 -16.432 -2.032 1.00 0.00 C ATOM 1288 CE1 HIS A 107 0.214 -17.939 -0.929 1.00 0.00 C ATOM 1289 NE2 HIS A 107 -1.011 -17.613 -1.432 1.00 0.00 N ATOM 0 H HIS A 107 0.753 -13.544 -5.398 1.00 0.00 H new ATOM 0 HA HIS A 107 -0.881 -14.195 -3.218 1.00 0.00 H new ATOM 0 HB2 HIS A 107 1.962 -14.963 -2.882 1.00 0.00 H new ATOM 0 HB3 HIS A 107 1.221 -14.071 -1.568 1.00 0.00 H new ATOM 0 HD2 HIS A 107 -1.736 -15.913 -2.523 1.00 0.00 H new ATOM 0 HE1 HIS A 107 0.458 -18.840 -0.386 1.00 0.00 H new ATOM 0 HE2 HIS A 107 -1.854 -18.183 -1.359 1.00 0.00 H new ATOM 1297 N TYR A 108 1.461 -11.922 -3.654 1.00 0.00 N ATOM 1298 CA TYR A 108 1.733 -10.497 -3.563 1.00 0.00 C ATOM 1299 C TYR A 108 1.061 -9.737 -4.709 1.00 0.00 C ATOM 1300 O TYR A 108 1.173 -10.130 -5.869 1.00 0.00 O ATOM 1301 CB TYR A 108 3.250 -10.348 -3.689 1.00 0.00 C ATOM 1302 CG TYR A 108 4.043 -11.480 -3.032 1.00 0.00 C ATOM 1303 CD1 TYR A 108 3.909 -11.723 -1.681 1.00 0.00 C ATOM 1304 CD2 TYR A 108 4.893 -12.258 -3.792 1.00 0.00 C ATOM 1305 CE1 TYR A 108 4.655 -12.788 -1.063 1.00 0.00 C ATOM 1306 CE2 TYR A 108 5.639 -13.323 -3.174 1.00 0.00 C ATOM 1307 CZ TYR A 108 5.484 -13.536 -1.840 1.00 0.00 C ATOM 1308 OH TYR A 108 6.188 -14.542 -1.257 1.00 0.00 O ATOM 0 H TYR A 108 2.229 -12.480 -4.027 1.00 0.00 H new ATOM 0 HA TYR A 108 1.350 -10.092 -2.626 1.00 0.00 H new ATOM 0 HB2 TYR A 108 3.514 -10.299 -4.746 1.00 0.00 H new ATOM 0 HB3 TYR A 108 3.550 -9.401 -3.241 1.00 0.00 H new ATOM 0 HD1 TYR A 108 3.244 -11.114 -1.086 1.00 0.00 H new ATOM 0 HD2 TYR A 108 4.998 -12.068 -4.850 1.00 0.00 H new ATOM 0 HE1 TYR A 108 4.559 -12.989 -0.006 1.00 0.00 H new ATOM 0 HE2 TYR A 108 6.307 -13.939 -3.757 1.00 0.00 H new ATOM 0 HH TYR A 108 6.737 -14.991 -1.933 1.00 0.00 H new ATOM 1318 N ASN A 109 0.377 -8.663 -4.342 1.00 0.00 N ATOM 1319 CA ASN A 109 -0.312 -7.844 -5.325 1.00 0.00 C ATOM 1320 C ASN A 109 0.508 -6.581 -5.596 1.00 0.00 C ATOM 1321 O ASN A 109 -0.020 -5.471 -5.546 1.00 0.00 O ATOM 1322 CB ASN A 109 -1.689 -7.413 -4.814 1.00 0.00 C ATOM 1323 CG ASN A 109 -2.709 -8.543 -4.967 1.00 0.00 C ATOM 1324 OD1 ASN A 109 -3.223 -9.085 -4.002 1.00 0.00 O ATOM 1325 ND2 ASN A 109 -2.972 -8.867 -6.230 1.00 0.00 N ATOM 0 H ASN A 109 0.285 -8.341 -3.378 1.00 0.00 H new ATOM 0 HA ASN A 109 -0.432 -8.436 -6.232 1.00 0.00 H new ATOM 0 HB2 ASN A 109 -1.617 -7.122 -3.766 1.00 0.00 H new ATOM 0 HB3 ASN A 109 -2.027 -6.536 -5.365 1.00 0.00 H new ATOM 0 HD21 ASN A 109 -3.640 -9.610 -6.438 1.00 0.00 H new ATOM 0 HD22 ASN A 109 -2.506 -8.373 -6.991 1.00 0.00 H new ATOM 1332 N THR A 110 1.785 -6.793 -5.878 1.00 0.00 N ATOM 1333 CA THR A 110 2.683 -5.685 -6.157 1.00 0.00 C ATOM 1334 C THR A 110 2.043 -4.718 -7.156 1.00 0.00 C ATOM 1335 O THR A 110 2.085 -4.949 -8.363 1.00 0.00 O ATOM 1336 CB THR A 110 4.013 -6.266 -6.641 1.00 0.00 C ATOM 1337 OG1 THR A 110 3.693 -6.873 -7.890 1.00 0.00 O ATOM 1338 CG2 THR A 110 4.494 -7.431 -5.774 1.00 0.00 C ATOM 0 H THR A 110 2.219 -7.715 -5.919 1.00 0.00 H new ATOM 0 HA THR A 110 2.875 -5.096 -5.260 1.00 0.00 H new ATOM 0 HB THR A 110 4.770 -5.482 -6.647 1.00 0.00 H new ATOM 0 HG1 THR A 110 3.331 -6.196 -8.499 1.00 0.00 H new ATOM 0 HG21 THR A 110 5.441 -7.806 -6.161 1.00 0.00 H new ATOM 0 HG22 THR A 110 4.631 -7.089 -4.748 1.00 0.00 H new ATOM 0 HG23 THR A 110 3.752 -8.230 -5.794 1.00 0.00 H new ATOM 1346 N TYR A 111 1.466 -3.656 -6.614 1.00 0.00 N ATOM 1347 CA TYR A 111 0.818 -2.653 -7.442 1.00 0.00 C ATOM 1348 C TYR A 111 1.824 -1.607 -7.925 1.00 0.00 C ATOM 1349 O TYR A 111 3.030 -1.767 -7.738 1.00 0.00 O ATOM 1350 CB TYR A 111 -0.218 -1.971 -6.546 1.00 0.00 C ATOM 1351 CG TYR A 111 -0.950 -2.927 -5.602 1.00 0.00 C ATOM 1352 CD1 TYR A 111 -0.400 -3.243 -4.376 1.00 0.00 C ATOM 1353 CD2 TYR A 111 -2.161 -3.474 -5.976 1.00 0.00 C ATOM 1354 CE1 TYR A 111 -1.088 -4.143 -3.488 1.00 0.00 C ATOM 1355 CE2 TYR A 111 -2.849 -4.374 -5.088 1.00 0.00 C ATOM 1356 CZ TYR A 111 -2.279 -4.664 -3.888 1.00 0.00 C ATOM 1357 OH TYR A 111 -2.930 -5.514 -3.049 1.00 0.00 O ATOM 0 H TYR A 111 1.434 -3.468 -5.612 1.00 0.00 H new ATOM 0 HA TYR A 111 0.371 -3.114 -8.323 1.00 0.00 H new ATOM 0 HB2 TYR A 111 0.279 -1.202 -5.954 1.00 0.00 H new ATOM 0 HB3 TYR A 111 -0.951 -1.466 -7.175 1.00 0.00 H new ATOM 0 HD1 TYR A 111 0.547 -2.815 -4.083 1.00 0.00 H new ATOM 0 HD2 TYR A 111 -2.592 -3.227 -6.935 1.00 0.00 H new ATOM 0 HE1 TYR A 111 -0.668 -4.399 -2.526 1.00 0.00 H new ATOM 0 HE2 TYR A 111 -3.797 -4.809 -5.369 1.00 0.00 H new ATOM 0 HH TYR A 111 -3.268 -5.016 -2.276 1.00 0.00 H new ATOM 1367 N ILE A 112 1.293 -0.558 -8.536 1.00 0.00 N ATOM 1368 CA ILE A 112 2.130 0.514 -9.047 1.00 0.00 C ATOM 1369 C ILE A 112 1.315 1.807 -9.106 1.00 0.00 C ATOM 1370 O ILE A 112 0.280 1.864 -9.769 1.00 0.00 O ATOM 1371 CB ILE A 112 2.750 0.117 -10.389 1.00 0.00 C ATOM 1372 CG1 ILE A 112 4.249 -0.154 -10.241 1.00 0.00 C ATOM 1373 CG2 ILE A 112 2.460 1.170 -11.460 1.00 0.00 C ATOM 1374 CD1 ILE A 112 4.924 -0.261 -11.610 1.00 0.00 C ATOM 0 H ILE A 112 0.293 -0.428 -8.689 1.00 0.00 H new ATOM 0 HA ILE A 112 2.969 0.695 -8.375 1.00 0.00 H new ATOM 0 HB ILE A 112 2.286 -0.813 -10.719 1.00 0.00 H new ATOM 0 HG12 ILE A 112 4.712 0.647 -9.665 1.00 0.00 H new ATOM 0 HG13 ILE A 112 4.402 -1.078 -9.683 1.00 0.00 H new ATOM 0 HG21 ILE A 112 2.912 0.863 -12.403 1.00 0.00 H new ATOM 0 HG22 ILE A 112 1.382 1.270 -11.589 1.00 0.00 H new ATOM 0 HG23 ILE A 112 2.879 2.128 -11.151 1.00 0.00 H new ATOM 0 HD11 ILE A 112 5.989 -0.454 -11.477 1.00 0.00 H new ATOM 0 HD12 ILE A 112 4.475 -1.079 -12.174 1.00 0.00 H new ATOM 0 HD13 ILE A 112 4.790 0.673 -12.156 1.00 0.00 H new ATOM 1386 N SER A 113 1.812 2.815 -8.403 1.00 0.00 N ATOM 1387 CA SER A 113 1.143 4.104 -8.366 1.00 0.00 C ATOM 1388 C SER A 113 0.596 4.449 -9.753 1.00 0.00 C ATOM 1389 O SER A 113 1.319 4.983 -10.593 1.00 0.00 O ATOM 1390 CB SER A 113 2.090 5.202 -7.880 1.00 0.00 C ATOM 1391 OG SER A 113 3.065 5.540 -8.863 1.00 0.00 O ATOM 0 H SER A 113 2.671 2.764 -7.855 1.00 0.00 H new ATOM 0 HA SER A 113 0.314 4.040 -7.661 1.00 0.00 H new ATOM 0 HB2 SER A 113 1.513 6.090 -7.621 1.00 0.00 H new ATOM 0 HB3 SER A 113 2.592 4.872 -6.970 1.00 0.00 H new ATOM 0 HG SER A 113 2.620 5.719 -9.717 1.00 0.00 H new ATOM 1397 N LYS A 114 -0.674 4.131 -9.950 1.00 0.00 N ATOM 1398 CA LYS A 114 -1.326 4.401 -11.220 1.00 0.00 C ATOM 1399 C LYS A 114 -1.178 5.885 -11.559 1.00 0.00 C ATOM 1400 O LYS A 114 -1.342 6.282 -12.711 1.00 0.00 O ATOM 1401 CB LYS A 114 -2.778 3.919 -11.191 1.00 0.00 C ATOM 1402 CG LYS A 114 -3.236 3.475 -12.582 1.00 0.00 C ATOM 1403 CD LYS A 114 -4.532 4.182 -12.984 1.00 0.00 C ATOM 1404 CE LYS A 114 -5.120 3.567 -14.255 1.00 0.00 C ATOM 1405 NZ LYS A 114 -4.367 4.019 -15.446 1.00 0.00 N ATOM 0 H LYS A 114 -1.270 3.688 -9.251 1.00 0.00 H new ATOM 0 HA LYS A 114 -0.845 3.841 -12.021 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -2.876 3.090 -10.490 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -3.424 4.720 -10.830 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -2.457 3.693 -13.312 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -3.388 2.396 -12.591 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -5.256 4.111 -12.172 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -4.337 5.242 -13.145 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -5.088 2.480 -14.188 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -6.168 3.850 -14.351 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -4.779 3.592 -16.300 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -4.419 5.055 -15.517 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -3.372 3.728 -15.359 1.00 0.00 H new ATOM 1419 N LYS A 115 -0.868 6.665 -10.534 1.00 0.00 N ATOM 1420 CA LYS A 115 -0.696 8.098 -10.708 1.00 0.00 C ATOM 1421 C LYS A 115 0.613 8.362 -11.456 1.00 0.00 C ATOM 1422 O LYS A 115 0.804 9.439 -12.017 1.00 0.00 O ATOM 1423 CB LYS A 115 -0.791 8.817 -9.361 1.00 0.00 C ATOM 1424 CG LYS A 115 -1.670 10.065 -9.467 1.00 0.00 C ATOM 1425 CD LYS A 115 -0.898 11.317 -9.045 1.00 0.00 C ATOM 1426 CE LYS A 115 -0.501 12.152 -10.263 1.00 0.00 C ATOM 1427 NZ LYS A 115 -1.685 12.830 -10.835 1.00 0.00 N ATOM 0 H LYS A 115 -0.731 6.332 -9.580 1.00 0.00 H new ATOM 0 HA LYS A 115 -1.501 8.508 -11.318 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -1.202 8.141 -8.612 1.00 0.00 H new ATOM 0 HB3 LYS A 115 0.207 9.098 -9.023 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -2.023 10.179 -10.492 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -2.552 9.948 -8.837 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -1.511 11.917 -8.372 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -0.005 11.028 -8.491 1.00 0.00 H new ATOM 0 HE2 LYS A 115 0.246 12.892 -9.976 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -0.042 11.512 -11.016 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -1.375 13.601 -11.461 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -2.247 12.146 -11.381 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -2.266 13.221 -10.066 1.00 0.00 H new ATOM 1441 N HIS A 116 1.480 7.360 -11.438 1.00 0.00 N ATOM 1442 CA HIS A 116 2.765 7.471 -12.107 1.00 0.00 C ATOM 1443 C HIS A 116 3.379 6.080 -12.273 1.00 0.00 C ATOM 1444 O HIS A 116 4.417 5.781 -11.686 1.00 0.00 O ATOM 1445 CB HIS A 116 3.685 8.439 -11.360 1.00 0.00 C ATOM 1446 CG HIS A 116 3.172 8.848 -10.000 1.00 0.00 C ATOM 1447 ND1 HIS A 116 3.304 8.048 -8.878 1.00 0.00 N ATOM 1448 CD2 HIS A 116 2.527 9.979 -9.593 1.00 0.00 C ATOM 1449 CE1 HIS A 116 2.758 8.679 -7.848 1.00 0.00 C ATOM 1450 NE2 HIS A 116 2.277 9.875 -8.294 1.00 0.00 N ATOM 0 H HIS A 116 1.318 6.468 -10.971 1.00 0.00 H new ATOM 0 HA HIS A 116 2.625 7.890 -13.103 1.00 0.00 H new ATOM 0 HB2 HIS A 116 4.665 7.976 -11.243 1.00 0.00 H new ATOM 0 HB3 HIS A 116 3.825 9.333 -11.968 1.00 0.00 H new ATOM 0 HD1 HIS A 116 3.746 7.129 -8.849 1.00 0.00 H new ATOM 0 HD2 HIS A 116 2.264 10.817 -10.222 1.00 0.00 H new ATOM 0 HE1 HIS A 116 2.704 8.311 -6.834 1.00 0.00 H new ATOM 1458 N ALA A 117 2.710 5.265 -13.077 1.00 0.00 N ATOM 1459 CA ALA A 117 3.177 3.913 -13.328 1.00 0.00 C ATOM 1460 C ALA A 117 4.179 3.930 -14.484 1.00 0.00 C ATOM 1461 O ALA A 117 5.005 3.027 -14.608 1.00 0.00 O ATOM 1462 CB ALA A 117 1.979 3.003 -13.608 1.00 0.00 C ATOM 0 H ALA A 117 1.849 5.516 -13.562 1.00 0.00 H new ATOM 0 HA ALA A 117 3.691 3.516 -12.453 1.00 0.00 H new ATOM 0 HB1 ALA A 117 2.329 1.988 -13.796 1.00 0.00 H new ATOM 0 HB2 ALA A 117 1.313 3.003 -12.745 1.00 0.00 H new ATOM 0 HB3 ALA A 117 1.440 3.369 -14.482 1.00 0.00 H new ATOM 1468 N GLU A 118 4.073 4.967 -15.302 1.00 0.00 N ATOM 1469 CA GLU A 118 4.959 5.113 -16.444 1.00 0.00 C ATOM 1470 C GLU A 118 6.415 5.190 -15.979 1.00 0.00 C ATOM 1471 O GLU A 118 7.335 5.036 -16.781 1.00 0.00 O ATOM 1472 CB GLU A 118 4.583 6.341 -17.276 1.00 0.00 C ATOM 1473 CG GLU A 118 5.723 6.736 -18.216 1.00 0.00 C ATOM 1474 CD GLU A 118 5.189 7.469 -19.448 1.00 0.00 C ATOM 1475 OE1 GLU A 118 4.589 6.780 -20.302 1.00 0.00 O ATOM 1476 OE2 GLU A 118 5.392 8.701 -19.509 1.00 0.00 O ATOM 0 H GLU A 118 3.387 5.714 -15.196 1.00 0.00 H new ATOM 0 HA GLU A 118 4.847 4.236 -17.081 1.00 0.00 H new ATOM 0 HB2 GLU A 118 3.685 6.130 -17.856 1.00 0.00 H new ATOM 0 HB3 GLU A 118 4.347 7.175 -16.615 1.00 0.00 H new ATOM 0 HG2 GLU A 118 6.431 7.374 -17.687 1.00 0.00 H new ATOM 0 HG3 GLU A 118 6.268 5.845 -18.527 1.00 0.00 H new ATOM 1483 N LYS A 119 6.578 5.429 -14.687 1.00 0.00 N ATOM 1484 CA LYS A 119 7.906 5.528 -14.106 1.00 0.00 C ATOM 1485 C LYS A 119 8.232 4.230 -13.364 1.00 0.00 C ATOM 1486 O LYS A 119 9.321 4.085 -12.810 1.00 0.00 O ATOM 1487 CB LYS A 119 8.017 6.780 -13.233 1.00 0.00 C ATOM 1488 CG LYS A 119 9.242 7.611 -13.620 1.00 0.00 C ATOM 1489 CD LYS A 119 9.447 8.773 -12.646 1.00 0.00 C ATOM 1490 CE LYS A 119 9.971 10.013 -13.373 1.00 0.00 C ATOM 1491 NZ LYS A 119 10.943 10.739 -12.526 1.00 0.00 N ATOM 0 H LYS A 119 5.812 5.557 -14.025 1.00 0.00 H new ATOM 0 HA LYS A 119 8.656 5.645 -14.888 1.00 0.00 H new ATOM 0 HB2 LYS A 119 7.115 7.383 -13.340 1.00 0.00 H new ATOM 0 HB3 LYS A 119 8.085 6.492 -12.184 1.00 0.00 H new ATOM 0 HG2 LYS A 119 10.129 6.977 -13.627 1.00 0.00 H new ATOM 0 HG3 LYS A 119 9.119 7.997 -14.632 1.00 0.00 H new ATOM 0 HD2 LYS A 119 8.504 9.008 -12.152 1.00 0.00 H new ATOM 0 HD3 LYS A 119 10.151 8.479 -11.867 1.00 0.00 H new ATOM 0 HE2 LYS A 119 10.444 9.719 -14.310 1.00 0.00 H new ATOM 0 HE3 LYS A 119 9.140 10.670 -13.628 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 11.288 11.578 -13.035 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 10.480 11.036 -11.643 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 11.744 10.114 -12.304 1.00 0.00 H new ATOM 1505 N ASN A 120 7.269 3.321 -13.378 1.00 0.00 N ATOM 1506 CA ASN A 120 7.440 2.040 -12.713 1.00 0.00 C ATOM 1507 C ASN A 120 7.591 2.268 -11.207 1.00 0.00 C ATOM 1508 O ASN A 120 8.475 1.692 -10.575 1.00 0.00 O ATOM 1509 CB ASN A 120 8.697 1.324 -13.211 1.00 0.00 C ATOM 1510 CG ASN A 120 8.624 1.073 -14.719 1.00 0.00 C ATOM 1511 OD1 ASN A 120 9.523 1.405 -15.474 1.00 0.00 O ATOM 1512 ND2 ASN A 120 7.505 0.471 -15.113 1.00 0.00 N ATOM 0 H ASN A 120 6.368 3.446 -13.839 1.00 0.00 H new ATOM 0 HA ASN A 120 6.565 1.427 -12.932 1.00 0.00 H new ATOM 0 HB2 ASN A 120 9.577 1.924 -12.981 1.00 0.00 H new ATOM 0 HB3 ASN A 120 8.812 0.376 -12.686 1.00 0.00 H new ATOM 0 HD21 ASN A 120 7.360 0.260 -16.100 1.00 0.00 H new ATOM 0 HD22 ASN A 120 6.792 0.220 -14.428 1.00 0.00 H new ATOM 1519 N TRP A 121 6.715 3.108 -10.677 1.00 0.00 N ATOM 1520 CA TRP A 121 6.740 3.419 -9.258 1.00 0.00 C ATOM 1521 C TRP A 121 5.808 2.439 -8.543 1.00 0.00 C ATOM 1522 O TRP A 121 4.588 2.597 -8.580 1.00 0.00 O ATOM 1523 CB TRP A 121 6.371 4.883 -9.011 1.00 0.00 C ATOM 1524 CG TRP A 121 7.448 5.878 -9.449 1.00 0.00 C ATOM 1525 CD1 TRP A 121 8.617 5.618 -10.049 1.00 0.00 C ATOM 1526 CD2 TRP A 121 7.406 7.313 -9.297 1.00 0.00 C ATOM 1527 NE1 TRP A 121 9.330 6.774 -10.293 1.00 0.00 N ATOM 1528 CE2 TRP A 121 8.570 7.838 -9.821 1.00 0.00 C ATOM 1529 CE3 TRP A 121 6.418 8.140 -8.734 1.00 0.00 C ATOM 1530 CZ2 TRP A 121 8.854 9.209 -9.835 1.00 0.00 C ATOM 1531 CZ3 TRP A 121 6.717 9.507 -8.755 1.00 0.00 C ATOM 1532 CH2 TRP A 121 7.884 10.051 -9.279 1.00 0.00 C ATOM 0 H TRP A 121 5.983 3.583 -11.205 1.00 0.00 H new ATOM 0 HA TRP A 121 7.746 3.300 -8.855 1.00 0.00 H new ATOM 0 HB2 TRP A 121 5.445 5.108 -9.541 1.00 0.00 H new ATOM 0 HB3 TRP A 121 6.172 5.023 -7.948 1.00 0.00 H new ATOM 0 HD1 TRP A 121 8.959 4.627 -10.309 1.00 0.00 H new ATOM 0 HE1 TRP A 121 10.246 6.836 -10.738 1.00 0.00 H new ATOM 0 HE3 TRP A 121 5.500 7.751 -8.318 1.00 0.00 H new ATOM 0 HZ2 TRP A 121 9.772 9.596 -10.252 1.00 0.00 H new ATOM 0 HZ3 TRP A 121 5.990 10.187 -8.335 1.00 0.00 H new ATOM 0 HH2 TRP A 121 8.042 11.119 -9.257 1.00 0.00 H new ATOM 1543 N PHE A 122 6.417 1.448 -7.909 1.00 0.00 N ATOM 1544 CA PHE A 122 5.656 0.443 -7.186 1.00 0.00 C ATOM 1545 C PHE A 122 5.170 0.985 -5.841 1.00 0.00 C ATOM 1546 O PHE A 122 5.381 2.155 -5.526 1.00 0.00 O ATOM 1547 CB PHE A 122 6.598 -0.737 -6.937 1.00 0.00 C ATOM 1548 CG PHE A 122 6.603 -1.777 -8.059 1.00 0.00 C ATOM 1549 CD1 PHE A 122 7.248 -1.514 -9.227 1.00 0.00 C ATOM 1550 CD2 PHE A 122 5.963 -2.965 -7.887 1.00 0.00 C ATOM 1551 CE1 PHE A 122 7.252 -2.480 -10.268 1.00 0.00 C ATOM 1552 CE2 PHE A 122 5.968 -3.930 -8.928 1.00 0.00 C ATOM 1553 CZ PHE A 122 6.612 -3.668 -10.097 1.00 0.00 C ATOM 0 H PHE A 122 7.428 1.319 -7.881 1.00 0.00 H new ATOM 0 HA PHE A 122 4.781 0.150 -7.766 1.00 0.00 H new ATOM 0 HB2 PHE A 122 7.611 -0.358 -6.803 1.00 0.00 H new ATOM 0 HB3 PHE A 122 6.314 -1.225 -6.005 1.00 0.00 H new ATOM 0 HD1 PHE A 122 7.757 -0.571 -9.363 1.00 0.00 H new ATOM 0 HD2 PHE A 122 5.451 -3.174 -6.959 1.00 0.00 H new ATOM 0 HE1 PHE A 122 7.764 -2.271 -11.196 1.00 0.00 H new ATOM 0 HE2 PHE A 122 5.460 -4.873 -8.792 1.00 0.00 H new ATOM 0 HZ PHE A 122 6.615 -4.403 -10.889 1.00 0.00 H new ATOM 1563 N VAL A 123 4.529 0.108 -5.083 1.00 0.00 N ATOM 1564 CA VAL A 123 4.011 0.484 -3.778 1.00 0.00 C ATOM 1565 C VAL A 123 4.583 -0.457 -2.716 1.00 0.00 C ATOM 1566 O VAL A 123 4.012 -1.512 -2.445 1.00 0.00 O ATOM 1567 CB VAL A 123 2.481 0.496 -3.806 1.00 0.00 C ATOM 1568 CG1 VAL A 123 1.933 -0.832 -4.332 1.00 0.00 C ATOM 1569 CG2 VAL A 123 1.910 0.815 -2.423 1.00 0.00 C ATOM 0 H VAL A 123 4.356 -0.862 -5.347 1.00 0.00 H new ATOM 0 HA VAL A 123 4.326 1.495 -3.519 1.00 0.00 H new ATOM 0 HB VAL A 123 2.164 1.284 -4.489 1.00 0.00 H new ATOM 0 HG11 VAL A 123 0.844 -0.798 -4.342 1.00 0.00 H new ATOM 0 HG12 VAL A 123 2.300 -1.002 -5.344 1.00 0.00 H new ATOM 0 HG13 VAL A 123 2.265 -1.644 -3.685 1.00 0.00 H new ATOM 0 HG21 VAL A 123 0.821 0.817 -2.471 1.00 0.00 H new ATOM 0 HG22 VAL A 123 2.240 0.060 -1.710 1.00 0.00 H new ATOM 0 HG23 VAL A 123 2.261 1.796 -2.102 1.00 0.00 H new ATOM 1579 N GLY A 124 5.703 -0.041 -2.144 1.00 0.00 N ATOM 1580 CA GLY A 124 6.359 -0.834 -1.118 1.00 0.00 C ATOM 1581 C GLY A 124 7.306 0.028 -0.281 1.00 0.00 C ATOM 1582 O GLY A 124 8.071 0.823 -0.825 1.00 0.00 O ATOM 0 H GLY A 124 6.173 0.835 -2.371 1.00 0.00 H new ATOM 0 HA2 GLY A 124 5.610 -1.290 -0.471 1.00 0.00 H new ATOM 0 HA3 GLY A 124 6.917 -1.647 -1.583 1.00 0.00 H new ATOM 1586 N LEU A 125 7.224 -0.160 1.028 1.00 0.00 N ATOM 1587 CA LEU A 125 8.065 0.590 1.945 1.00 0.00 C ATOM 1588 C LEU A 125 9.452 -0.053 2.001 1.00 0.00 C ATOM 1589 O LEU A 125 9.577 -1.244 2.280 1.00 0.00 O ATOM 1590 CB LEU A 125 7.389 0.714 3.312 1.00 0.00 C ATOM 1591 CG LEU A 125 5.878 0.474 3.338 1.00 0.00 C ATOM 1592 CD1 LEU A 125 5.553 -0.920 3.877 1.00 0.00 C ATOM 1593 CD2 LEU A 125 5.161 1.574 4.123 1.00 0.00 C ATOM 0 H LEU A 125 6.588 -0.821 1.475 1.00 0.00 H new ATOM 0 HA LEU A 125 8.201 1.611 1.588 1.00 0.00 H new ATOM 0 HB2 LEU A 125 7.861 0.007 3.994 1.00 0.00 H new ATOM 0 HB3 LEU A 125 7.585 1.713 3.703 1.00 0.00 H new ATOM 0 HG LEU A 125 5.508 0.517 2.314 1.00 0.00 H new ATOM 0 HD11 LEU A 125 4.473 -1.064 3.885 1.00 0.00 H new ATOM 0 HD12 LEU A 125 6.015 -1.674 3.239 1.00 0.00 H new ATOM 0 HD13 LEU A 125 5.939 -1.017 4.892 1.00 0.00 H new ATOM 0 HD21 LEU A 125 4.089 1.379 4.126 1.00 0.00 H new ATOM 0 HD22 LEU A 125 5.530 1.589 5.149 1.00 0.00 H new ATOM 0 HD23 LEU A 125 5.353 2.539 3.655 1.00 0.00 H new ATOM 1605 N LYS A 126 10.459 0.765 1.731 1.00 0.00 N ATOM 1606 CA LYS A 126 11.833 0.290 1.748 1.00 0.00 C ATOM 1607 C LYS A 126 11.934 -0.933 2.660 1.00 0.00 C ATOM 1608 O LYS A 126 11.595 -0.862 3.840 1.00 0.00 O ATOM 1609 CB LYS A 126 12.786 1.424 2.130 1.00 0.00 C ATOM 1610 CG LYS A 126 13.911 1.564 1.102 1.00 0.00 C ATOM 1611 CD LYS A 126 14.750 2.815 1.375 1.00 0.00 C ATOM 1612 CE LYS A 126 16.243 2.516 1.226 1.00 0.00 C ATOM 1613 NZ LYS A 126 16.995 3.044 2.387 1.00 0.00 N ATOM 0 H LYS A 126 10.351 1.753 1.499 1.00 0.00 H new ATOM 0 HA LYS A 126 12.139 -0.030 0.752 1.00 0.00 H new ATOM 0 HB2 LYS A 126 12.233 2.361 2.199 1.00 0.00 H new ATOM 0 HB3 LYS A 126 13.211 1.231 3.115 1.00 0.00 H new ATOM 0 HG2 LYS A 126 14.548 0.680 1.132 1.00 0.00 H new ATOM 0 HG3 LYS A 126 13.488 1.617 0.099 1.00 0.00 H new ATOM 0 HD2 LYS A 126 14.463 3.608 0.684 1.00 0.00 H new ATOM 0 HD3 LYS A 126 14.547 3.181 2.382 1.00 0.00 H new ATOM 0 HE2 LYS A 126 16.398 1.440 1.143 1.00 0.00 H new ATOM 0 HE3 LYS A 126 16.620 2.964 0.307 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 18.007 2.833 2.270 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 16.861 4.074 2.448 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 16.646 2.597 3.259 1.00 0.00 H new ATOM 1627 N LYS A 127 12.403 -2.028 2.079 1.00 0.00 N ATOM 1628 CA LYS A 127 12.553 -3.266 2.825 1.00 0.00 C ATOM 1629 C LYS A 127 13.610 -3.074 3.915 1.00 0.00 C ATOM 1630 O LYS A 127 14.631 -3.760 3.922 1.00 0.00 O ATOM 1631 CB LYS A 127 12.851 -4.430 1.878 1.00 0.00 C ATOM 1632 CG LYS A 127 13.789 -3.993 0.751 1.00 0.00 C ATOM 1633 CD LYS A 127 14.967 -3.186 1.300 1.00 0.00 C ATOM 1634 CE LYS A 127 15.852 -2.666 0.165 1.00 0.00 C ATOM 1635 NZ LYS A 127 17.108 -2.099 0.705 1.00 0.00 N ATOM 0 H LYS A 127 12.684 -2.083 1.100 1.00 0.00 H new ATOM 0 HA LYS A 127 11.620 -3.524 3.326 1.00 0.00 H new ATOM 0 HB2 LYS A 127 13.304 -5.250 2.435 1.00 0.00 H new ATOM 0 HB3 LYS A 127 11.920 -4.807 1.455 1.00 0.00 H new ATOM 0 HG2 LYS A 127 14.160 -4.870 0.221 1.00 0.00 H new ATOM 0 HG3 LYS A 127 13.238 -3.393 0.027 1.00 0.00 H new ATOM 0 HD2 LYS A 127 14.595 -2.348 1.889 1.00 0.00 H new ATOM 0 HD3 LYS A 127 15.558 -3.809 1.971 1.00 0.00 H new ATOM 0 HE2 LYS A 127 16.080 -3.477 -0.527 1.00 0.00 H new ATOM 0 HE3 LYS A 127 15.316 -1.904 -0.402 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 17.697 -1.751 -0.078 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 16.886 -1.312 1.347 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 17.625 -2.835 1.226 1.00 0.00 H new ATOM 1649 N ASN A 128 13.329 -2.137 4.809 1.00 0.00 N ATOM 1650 CA ASN A 128 14.243 -1.847 5.901 1.00 0.00 C ATOM 1651 C ASN A 128 13.488 -1.111 7.009 1.00 0.00 C ATOM 1652 O ASN A 128 13.679 -1.396 8.191 1.00 0.00 O ATOM 1653 CB ASN A 128 15.391 -0.949 5.434 1.00 0.00 C ATOM 1654 CG ASN A 128 16.720 -1.707 5.449 1.00 0.00 C ATOM 1655 OD1 ASN A 128 16.829 -2.810 5.959 1.00 0.00 O ATOM 1656 ND2 ASN A 128 17.720 -1.055 4.863 1.00 0.00 N ATOM 0 H ASN A 128 12.482 -1.569 4.799 1.00 0.00 H new ATOM 0 HA ASN A 128 14.648 -2.792 6.262 1.00 0.00 H new ATOM 0 HB2 ASN A 128 15.187 -0.586 4.427 1.00 0.00 H new ATOM 0 HB3 ASN A 128 15.460 -0.074 6.081 1.00 0.00 H new ATOM 0 HD21 ASN A 128 18.648 -1.476 4.821 1.00 0.00 H new ATOM 0 HD22 ASN A 128 17.559 -0.134 4.456 1.00 0.00 H new ATOM 1663 N GLY A 129 12.645 -0.178 6.589 1.00 0.00 N ATOM 1664 CA GLY A 129 11.861 0.601 7.532 1.00 0.00 C ATOM 1665 C GLY A 129 11.850 2.081 7.145 1.00 0.00 C ATOM 1666 O GLY A 129 12.701 2.849 7.590 1.00 0.00 O ATOM 0 H GLY A 129 12.488 0.055 5.609 1.00 0.00 H new ATOM 0 HA2 GLY A 129 10.840 0.222 7.562 1.00 0.00 H new ATOM 0 HA3 GLY A 129 12.273 0.487 8.535 1.00 0.00 H new ATOM 1670 N SER A 130 10.876 2.437 6.320 1.00 0.00 N ATOM 1671 CA SER A 130 10.742 3.811 5.868 1.00 0.00 C ATOM 1672 C SER A 130 9.709 3.894 4.743 1.00 0.00 C ATOM 1673 O SER A 130 9.422 2.896 4.084 1.00 0.00 O ATOM 1674 CB SER A 130 12.087 4.368 5.396 1.00 0.00 C ATOM 1675 OG SER A 130 12.823 4.962 6.462 1.00 0.00 O ATOM 0 H SER A 130 10.172 1.797 5.953 1.00 0.00 H new ATOM 0 HA SER A 130 10.403 4.416 6.709 1.00 0.00 H new ATOM 0 HB2 SER A 130 12.676 3.565 4.952 1.00 0.00 H new ATOM 0 HB3 SER A 130 11.918 5.109 4.615 1.00 0.00 H new ATOM 0 HG SER A 130 12.773 4.387 7.254 1.00 0.00 H new ATOM 1681 N CYS A 131 9.178 5.094 4.558 1.00 0.00 N ATOM 1682 CA CYS A 131 8.182 5.320 3.524 1.00 0.00 C ATOM 1683 C CYS A 131 8.869 5.997 2.336 1.00 0.00 C ATOM 1684 O CYS A 131 9.775 6.808 2.518 1.00 0.00 O ATOM 1685 CB CYS A 131 7.002 6.142 4.045 1.00 0.00 C ATOM 1686 SG CYS A 131 5.546 5.903 2.962 1.00 0.00 S ATOM 0 H CYS A 131 9.419 5.920 5.106 1.00 0.00 H new ATOM 0 HA CYS A 131 7.762 4.366 3.205 1.00 0.00 H new ATOM 0 HB2 CYS A 131 6.761 5.841 5.064 1.00 0.00 H new ATOM 0 HB3 CYS A 131 7.271 7.198 4.079 1.00 0.00 H new ATOM 0 HG CYS A 131 4.549 6.604 3.415 1.00 0.00 H new ATOM 1692 N LYS A 132 8.410 5.639 1.146 1.00 0.00 N ATOM 1693 CA LYS A 132 8.969 6.202 -0.072 1.00 0.00 C ATOM 1694 C LYS A 132 8.577 7.677 -0.173 1.00 0.00 C ATOM 1695 O LYS A 132 7.882 8.199 0.697 1.00 0.00 O ATOM 1696 CB LYS A 132 8.552 5.370 -1.287 1.00 0.00 C ATOM 1697 CG LYS A 132 9.775 4.786 -1.997 1.00 0.00 C ATOM 1698 CD LYS A 132 9.983 3.319 -1.614 1.00 0.00 C ATOM 1699 CE LYS A 132 11.247 3.147 -0.770 1.00 0.00 C ATOM 1700 NZ LYS A 132 11.309 4.180 0.288 1.00 0.00 N ATOM 0 H LYS A 132 7.658 4.966 0.999 1.00 0.00 H new ATOM 0 HA LYS A 132 10.058 6.162 -0.046 1.00 0.00 H new ATOM 0 HB2 LYS A 132 7.891 4.563 -0.970 1.00 0.00 H new ATOM 0 HB3 LYS A 132 7.986 5.992 -1.981 1.00 0.00 H new ATOM 0 HG2 LYS A 132 9.648 4.869 -3.076 1.00 0.00 H new ATOM 0 HG3 LYS A 132 10.662 5.363 -1.735 1.00 0.00 H new ATOM 0 HD2 LYS A 132 9.118 2.959 -1.057 1.00 0.00 H new ATOM 0 HD3 LYS A 132 10.058 2.711 -2.516 1.00 0.00 H new ATOM 0 HE2 LYS A 132 11.258 2.155 -0.319 1.00 0.00 H new ATOM 0 HE3 LYS A 132 12.129 3.217 -1.407 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 12.030 3.916 0.989 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 11.558 5.097 -0.136 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 10.383 4.255 0.755 1.00 0.00 H new ATOM 1714 N ARG A 133 9.040 8.307 -1.242 1.00 0.00 N ATOM 1715 CA ARG A 133 8.747 9.713 -1.468 1.00 0.00 C ATOM 1716 C ARG A 133 9.082 10.099 -2.910 1.00 0.00 C ATOM 1717 O ARG A 133 9.889 10.997 -3.145 1.00 0.00 O ATOM 1718 CB ARG A 133 9.543 10.602 -0.511 1.00 0.00 C ATOM 1719 CG ARG A 133 11.037 10.557 -0.836 1.00 0.00 C ATOM 1720 CD ARG A 133 11.591 11.965 -1.065 1.00 0.00 C ATOM 1721 NE ARG A 133 12.719 11.916 -2.022 1.00 0.00 N ATOM 1722 CZ ARG A 133 13.133 12.962 -2.750 1.00 0.00 C ATOM 1723 NH1 ARG A 133 12.515 14.146 -2.634 1.00 0.00 N ATOM 1724 NH2 ARG A 133 14.165 12.825 -3.593 1.00 0.00 N ATOM 0 H ARG A 133 9.616 7.870 -1.962 1.00 0.00 H new ATOM 0 HA ARG A 133 7.683 9.864 -1.285 1.00 0.00 H new ATOM 0 HB2 ARG A 133 9.183 11.629 -0.579 1.00 0.00 H new ATOM 0 HB3 ARG A 133 9.380 10.274 0.516 1.00 0.00 H new ATOM 0 HG2 ARG A 133 11.576 10.079 -0.019 1.00 0.00 H new ATOM 0 HG3 ARG A 133 11.201 9.949 -1.725 1.00 0.00 H new ATOM 0 HD2 ARG A 133 10.805 12.616 -1.449 1.00 0.00 H new ATOM 0 HD3 ARG A 133 11.924 12.392 -0.119 1.00 0.00 H new ATOM 0 HE ARG A 133 13.212 11.030 -2.134 1.00 0.00 H new ATOM 0 HH11 ARG A 133 11.730 14.251 -1.992 1.00 0.00 H new ATOM 0 HH12 ARG A 133 12.830 14.942 -3.188 1.00 0.00 H new ATOM 0 HH21 ARG A 133 14.636 11.924 -3.681 1.00 0.00 H new ATOM 0 HH22 ARG A 133 14.480 13.621 -4.147 1.00 0.00 H new ATOM 1738 N GLY A 134 8.444 9.402 -3.839 1.00 0.00 N ATOM 1739 CA GLY A 134 8.664 9.661 -5.252 1.00 0.00 C ATOM 1740 C GLY A 134 9.262 8.437 -5.948 1.00 0.00 C ATOM 1741 O GLY A 134 8.838 7.309 -5.701 1.00 0.00 O ATOM 0 H GLY A 134 7.775 8.658 -3.641 1.00 0.00 H new ATOM 0 HA2 GLY A 134 7.720 9.929 -5.727 1.00 0.00 H new ATOM 0 HA3 GLY A 134 9.333 10.513 -5.369 1.00 0.00 H new ATOM 1745 N PRO A 135 10.265 8.708 -6.826 1.00 0.00 N ATOM 1746 CA PRO A 135 10.926 7.641 -7.559 1.00 0.00 C ATOM 1747 C PRO A 135 11.883 6.865 -6.653 1.00 0.00 C ATOM 1748 O PRO A 135 13.085 6.818 -6.909 1.00 0.00 O ATOM 1749 CB PRO A 135 11.631 8.336 -8.713 1.00 0.00 C ATOM 1750 CG PRO A 135 11.726 9.801 -8.322 1.00 0.00 C ATOM 1751 CD PRO A 135 10.793 10.031 -7.144 1.00 0.00 C ATOM 0 HA PRO A 135 10.229 6.890 -7.930 1.00 0.00 H new ATOM 0 HB2 PRO A 135 12.621 7.911 -8.879 1.00 0.00 H new ATOM 0 HB3 PRO A 135 11.073 8.215 -9.641 1.00 0.00 H new ATOM 0 HG2 PRO A 135 12.750 10.059 -8.053 1.00 0.00 H new ATOM 0 HG3 PRO A 135 11.446 10.439 -9.161 1.00 0.00 H new ATOM 0 HD2 PRO A 135 11.325 10.459 -6.295 1.00 0.00 H new ATOM 0 HD3 PRO A 135 9.993 10.725 -7.402 1.00 0.00 H new ATOM 1759 N ARG A 136 11.314 6.275 -5.612 1.00 0.00 N ATOM 1760 CA ARG A 136 12.102 5.503 -4.666 1.00 0.00 C ATOM 1761 C ARG A 136 11.452 4.140 -4.422 1.00 0.00 C ATOM 1762 O ARG A 136 11.929 3.359 -3.599 1.00 0.00 O ATOM 1763 CB ARG A 136 12.240 6.241 -3.333 1.00 0.00 C ATOM 1764 CG ARG A 136 13.329 7.313 -3.409 1.00 0.00 C ATOM 1765 CD ARG A 136 14.280 7.214 -2.215 1.00 0.00 C ATOM 1766 NE ARG A 136 14.585 8.567 -1.698 1.00 0.00 N ATOM 1767 CZ ARG A 136 15.671 8.867 -0.972 1.00 0.00 C ATOM 1768 NH1 ARG A 136 16.561 7.911 -0.672 1.00 0.00 N ATOM 1769 NH2 ARG A 136 15.866 10.122 -0.545 1.00 0.00 N ATOM 0 H ARG A 136 10.317 6.316 -5.403 1.00 0.00 H new ATOM 0 HA ARG A 136 13.094 5.364 -5.096 1.00 0.00 H new ATOM 0 HB2 ARG A 136 11.289 6.702 -3.069 1.00 0.00 H new ATOM 0 HB3 ARG A 136 12.480 5.530 -2.543 1.00 0.00 H new ATOM 0 HG2 ARG A 136 13.891 7.201 -4.336 1.00 0.00 H new ATOM 0 HG3 ARG A 136 12.870 8.301 -3.432 1.00 0.00 H new ATOM 0 HD2 ARG A 136 13.829 6.609 -1.429 1.00 0.00 H new ATOM 0 HD3 ARG A 136 15.201 6.713 -2.514 1.00 0.00 H new ATOM 0 HE ARG A 136 13.927 9.318 -1.907 1.00 0.00 H new ATOM 0 HH11 ARG A 136 16.412 6.955 -0.996 1.00 0.00 H new ATOM 0 HH12 ARG A 136 17.388 8.139 -0.120 1.00 0.00 H new ATOM 0 HH21 ARG A 136 15.188 10.849 -0.772 1.00 0.00 H new ATOM 0 HH22 ARG A 136 16.693 10.350 0.008 1.00 0.00 H new ATOM 1783 N THR A 137 10.374 3.895 -5.152 1.00 0.00 N ATOM 1784 CA THR A 137 9.654 2.639 -5.025 1.00 0.00 C ATOM 1785 C THR A 137 9.566 1.935 -6.381 1.00 0.00 C ATOM 1786 O THR A 137 8.998 2.474 -7.329 1.00 0.00 O ATOM 1787 CB THR A 137 8.287 2.938 -4.407 1.00 0.00 C ATOM 1788 OG1 THR A 137 7.617 1.680 -4.419 1.00 0.00 O ATOM 1789 CG2 THR A 137 7.422 3.830 -5.300 1.00 0.00 C ATOM 0 H THR A 137 9.982 4.545 -5.833 1.00 0.00 H new ATOM 0 HA THR A 137 10.180 1.947 -4.368 1.00 0.00 H new ATOM 0 HB THR A 137 8.425 3.419 -3.439 1.00 0.00 H new ATOM 0 HG1 THR A 137 7.802 1.203 -3.583 1.00 0.00 H new ATOM 0 HG21 THR A 137 6.463 4.011 -4.814 1.00 0.00 H new ATOM 0 HG22 THR A 137 7.930 4.780 -5.466 1.00 0.00 H new ATOM 0 HG23 THR A 137 7.256 3.335 -6.257 1.00 0.00 H new ATOM 1797 N HIS A 138 10.138 0.741 -6.429 1.00 0.00 N ATOM 1798 CA HIS A 138 10.132 -0.043 -7.653 1.00 0.00 C ATOM 1799 C HIS A 138 10.488 -1.496 -7.334 1.00 0.00 C ATOM 1800 O HIS A 138 10.707 -1.845 -6.175 1.00 0.00 O ATOM 1801 CB HIS A 138 11.059 0.578 -8.700 1.00 0.00 C ATOM 1802 CG HIS A 138 11.289 2.059 -8.516 1.00 0.00 C ATOM 1803 ND1 HIS A 138 12.046 2.577 -7.479 1.00 0.00 N ATOM 1804 CD2 HIS A 138 10.856 3.126 -9.247 1.00 0.00 C ATOM 1805 CE1 HIS A 138 12.060 3.897 -7.590 1.00 0.00 C ATOM 1806 NE2 HIS A 138 11.321 4.235 -8.686 1.00 0.00 N ATOM 0 H HIS A 138 10.609 0.297 -5.640 1.00 0.00 H new ATOM 0 HA HIS A 138 9.132 -0.037 -8.088 1.00 0.00 H new ATOM 0 HB2 HIS A 138 12.020 0.065 -8.669 1.00 0.00 H new ATOM 0 HB3 HIS A 138 10.638 0.407 -9.691 1.00 0.00 H new ATOM 0 HD2 HIS A 138 10.239 3.077 -10.132 1.00 0.00 H new ATOM 0 HE1 HIS A 138 12.567 4.585 -6.929 1.00 0.00 H new ATOM 0 HE2 HIS A 138 11.153 5.184 -9.019 1.00 0.00 H new ATOM 1814 N TYR A 139 10.533 -2.305 -8.383 1.00 0.00 N ATOM 1815 CA TYR A 139 10.858 -3.712 -8.229 1.00 0.00 C ATOM 1816 C TYR A 139 12.171 -3.892 -7.463 1.00 0.00 C ATOM 1817 O TYR A 139 12.688 -2.941 -6.879 1.00 0.00 O ATOM 1818 CB TYR A 139 11.029 -4.263 -9.646 1.00 0.00 C ATOM 1819 CG TYR A 139 10.145 -5.474 -9.953 1.00 0.00 C ATOM 1820 CD1 TYR A 139 8.861 -5.537 -9.450 1.00 0.00 C ATOM 1821 CD2 TYR A 139 10.632 -6.504 -10.732 1.00 0.00 C ATOM 1822 CE1 TYR A 139 8.030 -6.677 -9.739 1.00 0.00 C ATOM 1823 CE2 TYR A 139 9.801 -7.643 -11.021 1.00 0.00 C ATOM 1824 CZ TYR A 139 8.541 -7.674 -10.511 1.00 0.00 C ATOM 1825 OH TYR A 139 7.755 -8.750 -10.784 1.00 0.00 O ATOM 0 H TYR A 139 10.350 -2.012 -9.343 1.00 0.00 H new ATOM 0 HA TYR A 139 10.076 -4.227 -7.671 1.00 0.00 H new ATOM 0 HB2 TYR A 139 10.806 -3.472 -10.362 1.00 0.00 H new ATOM 0 HB3 TYR A 139 12.073 -4.541 -9.793 1.00 0.00 H new ATOM 0 HD1 TYR A 139 8.480 -4.732 -8.840 1.00 0.00 H new ATOM 0 HD2 TYR A 139 11.637 -6.455 -11.125 1.00 0.00 H new ATOM 0 HE1 TYR A 139 7.024 -6.739 -9.352 1.00 0.00 H new ATOM 0 HE2 TYR A 139 10.170 -8.455 -11.630 1.00 0.00 H new ATOM 0 HH TYR A 139 8.250 -9.382 -11.346 1.00 0.00 H new ATOM 1891 N ILE A 144 7.503 -4.179 -2.200 1.00 0.00 N ATOM 1892 CA ILE A 144 6.315 -4.163 -3.037 1.00 0.00 C ATOM 1893 C ILE A 144 5.492 -5.425 -2.772 1.00 0.00 C ATOM 1894 O ILE A 144 4.267 -5.406 -2.880 1.00 0.00 O ATOM 1895 CB ILE A 144 6.697 -3.975 -4.506 1.00 0.00 C ATOM 1896 CG1 ILE A 144 7.285 -5.262 -5.088 1.00 0.00 C ATOM 1897 CG2 ILE A 144 7.642 -2.784 -4.679 1.00 0.00 C ATOM 1898 CD1 ILE A 144 7.977 -4.993 -6.426 1.00 0.00 C ATOM 0 HA ILE A 144 5.683 -3.312 -2.785 1.00 0.00 H new ATOM 0 HB ILE A 144 5.791 -3.751 -5.069 1.00 0.00 H new ATOM 0 HG12 ILE A 144 7.999 -5.690 -4.385 1.00 0.00 H new ATOM 0 HG13 ILE A 144 6.493 -5.998 -5.226 1.00 0.00 H new ATOM 0 HG21 ILE A 144 7.898 -2.673 -5.733 1.00 0.00 H new ATOM 0 HG22 ILE A 144 7.152 -1.876 -4.327 1.00 0.00 H new ATOM 0 HG23 ILE A 144 8.550 -2.953 -4.101 1.00 0.00 H new ATOM 0 HD11 ILE A 144 8.386 -5.924 -6.818 1.00 0.00 H new ATOM 0 HD12 ILE A 144 7.254 -4.588 -7.134 1.00 0.00 H new ATOM 0 HD13 ILE A 144 8.784 -4.275 -6.280 1.00 0.00 H new ATOM 1910 N LEU A 145 6.199 -6.493 -2.430 1.00 0.00 N ATOM 1911 CA LEU A 145 5.549 -7.761 -2.148 1.00 0.00 C ATOM 1912 C LEU A 145 4.690 -7.622 -0.890 1.00 0.00 C ATOM 1913 O LEU A 145 5.215 -7.564 0.221 1.00 0.00 O ATOM 1914 CB LEU A 145 6.583 -8.886 -2.065 1.00 0.00 C ATOM 1915 CG LEU A 145 6.817 -9.678 -3.353 1.00 0.00 C ATOM 1916 CD1 LEU A 145 7.699 -8.894 -4.327 1.00 0.00 C ATOM 1917 CD2 LEU A 145 7.391 -11.063 -3.048 1.00 0.00 C ATOM 0 H LEU A 145 7.215 -6.506 -2.342 1.00 0.00 H new ATOM 0 HA LEU A 145 4.878 -8.034 -2.963 1.00 0.00 H new ATOM 0 HB2 LEU A 145 7.533 -8.456 -1.748 1.00 0.00 H new ATOM 0 HB3 LEU A 145 6.272 -9.582 -1.286 1.00 0.00 H new ATOM 0 HG LEU A 145 5.854 -9.828 -3.841 1.00 0.00 H new ATOM 0 HD11 LEU A 145 7.849 -9.480 -5.234 1.00 0.00 H new ATOM 0 HD12 LEU A 145 7.213 -7.952 -4.580 1.00 0.00 H new ATOM 0 HD13 LEU A 145 8.664 -8.691 -3.862 1.00 0.00 H new ATOM 0 HD21 LEU A 145 7.548 -11.605 -3.980 1.00 0.00 H new ATOM 0 HD22 LEU A 145 8.342 -10.956 -2.526 1.00 0.00 H new ATOM 0 HD23 LEU A 145 6.693 -11.616 -2.420 1.00 0.00 H new ATOM 1929 N PHE A 146 3.384 -7.571 -1.106 1.00 0.00 N ATOM 1930 CA PHE A 146 2.447 -7.439 -0.004 1.00 0.00 C ATOM 1931 C PHE A 146 1.519 -8.652 0.075 1.00 0.00 C ATOM 1932 O PHE A 146 0.779 -8.935 -0.866 1.00 0.00 O ATOM 1933 CB PHE A 146 1.609 -6.188 -0.276 1.00 0.00 C ATOM 1934 CG PHE A 146 2.320 -4.877 0.067 1.00 0.00 C ATOM 1935 CD1 PHE A 146 3.193 -4.829 1.108 1.00 0.00 C ATOM 1936 CD2 PHE A 146 2.077 -3.759 -0.669 1.00 0.00 C ATOM 1937 CE1 PHE A 146 3.853 -3.612 1.426 1.00 0.00 C ATOM 1938 CE2 PHE A 146 2.736 -2.542 -0.351 1.00 0.00 C ATOM 1939 CZ PHE A 146 3.610 -2.494 0.690 1.00 0.00 C ATOM 0 H PHE A 146 2.952 -7.619 -2.029 1.00 0.00 H new ATOM 0 HA PHE A 146 2.990 -7.368 0.939 1.00 0.00 H new ATOM 0 HB2 PHE A 146 1.329 -6.173 -1.329 1.00 0.00 H new ATOM 0 HB3 PHE A 146 0.685 -6.250 0.299 1.00 0.00 H new ATOM 0 HD1 PHE A 146 3.385 -5.716 1.693 1.00 0.00 H new ATOM 0 HD2 PHE A 146 1.383 -3.797 -1.495 1.00 0.00 H new ATOM 0 HE1 PHE A 146 4.548 -3.574 2.252 1.00 0.00 H new ATOM 0 HE2 PHE A 146 2.543 -1.655 -0.936 1.00 0.00 H new ATOM 0 HZ PHE A 146 4.111 -1.568 0.932 1.00 0.00 H new ATOM 1949 N LEU A 147 1.588 -9.338 1.207 1.00 0.00 N ATOM 1950 CA LEU A 147 0.763 -10.514 1.422 1.00 0.00 C ATOM 1951 C LEU A 147 -0.317 -10.193 2.456 1.00 0.00 C ATOM 1952 O LEU A 147 -0.030 -10.092 3.648 1.00 0.00 O ATOM 1953 CB LEU A 147 1.632 -11.717 1.793 1.00 0.00 C ATOM 1954 CG LEU A 147 0.965 -13.089 1.672 1.00 0.00 C ATOM 1955 CD1 LEU A 147 0.889 -13.784 3.034 1.00 0.00 C ATOM 1956 CD2 LEU A 147 -0.409 -12.974 1.010 1.00 0.00 C ATOM 0 H LEU A 147 2.203 -9.101 1.985 1.00 0.00 H new ATOM 0 HA LEU A 147 0.250 -10.792 0.502 1.00 0.00 H new ATOM 0 HB2 LEU A 147 2.519 -11.709 1.159 1.00 0.00 H new ATOM 0 HB3 LEU A 147 1.974 -11.590 2.820 1.00 0.00 H new ATOM 0 HG LEU A 147 1.582 -13.713 1.026 1.00 0.00 H new ATOM 0 HD11 LEU A 147 0.411 -14.757 2.920 1.00 0.00 H new ATOM 0 HD12 LEU A 147 1.895 -13.919 3.430 1.00 0.00 H new ATOM 0 HD13 LEU A 147 0.307 -13.172 3.723 1.00 0.00 H new ATOM 0 HD21 LEU A 147 -0.861 -13.963 0.936 1.00 0.00 H new ATOM 0 HD22 LEU A 147 -1.049 -12.326 1.610 1.00 0.00 H new ATOM 0 HD23 LEU A 147 -0.298 -12.551 0.012 1.00 0.00 H new ATOM 1968 N PRO A 148 -1.570 -10.037 1.950 1.00 0.00 N ATOM 1969 CA PRO A 148 -2.695 -9.729 2.817 1.00 0.00 C ATOM 1970 C PRO A 148 -3.131 -10.964 3.608 1.00 0.00 C ATOM 1971 O PRO A 148 -3.381 -12.020 3.030 1.00 0.00 O ATOM 1972 CB PRO A 148 -3.777 -9.207 1.886 1.00 0.00 C ATOM 1973 CG PRO A 148 -3.391 -9.675 0.493 1.00 0.00 C ATOM 1974 CD PRO A 148 -1.947 -10.149 0.544 1.00 0.00 C ATOM 0 HA PRO A 148 -2.450 -8.987 3.577 1.00 0.00 H new ATOM 0 HB2 PRO A 148 -4.756 -9.593 2.170 1.00 0.00 H new ATOM 0 HB3 PRO A 148 -3.838 -8.120 1.930 1.00 0.00 H new ATOM 0 HG2 PRO A 148 -4.046 -10.482 0.166 1.00 0.00 H new ATOM 0 HG3 PRO A 148 -3.501 -8.864 -0.227 1.00 0.00 H new ATOM 0 HD2 PRO A 148 -1.854 -11.176 0.190 1.00 0.00 H new ATOM 0 HD3 PRO A 148 -1.306 -9.535 -0.088 1.00 0.00 H new ATOM 1982 N LEU A 149 -3.210 -10.789 4.919 1.00 0.00 N ATOM 1983 CA LEU A 149 -3.612 -11.876 5.796 1.00 0.00 C ATOM 1984 C LEU A 149 -4.638 -11.358 6.805 1.00 0.00 C ATOM 1985 O LEU A 149 -4.378 -11.338 8.007 1.00 0.00 O ATOM 1986 CB LEU A 149 -2.386 -12.523 6.443 1.00 0.00 C ATOM 1987 CG LEU A 149 -1.452 -11.580 7.204 1.00 0.00 C ATOM 1988 CD1 LEU A 149 -1.569 -11.792 8.714 1.00 0.00 C ATOM 1989 CD2 LEU A 149 -0.009 -11.725 6.715 1.00 0.00 C ATOM 0 H LEU A 149 -3.003 -9.911 5.395 1.00 0.00 H new ATOM 0 HA LEU A 149 -4.097 -12.667 5.225 1.00 0.00 H new ATOM 0 HB2 LEU A 149 -2.729 -13.296 7.131 1.00 0.00 H new ATOM 0 HB3 LEU A 149 -1.810 -13.022 5.664 1.00 0.00 H new ATOM 0 HG LEU A 149 -1.761 -10.555 6.998 1.00 0.00 H new ATOM 0 HD11 LEU A 149 -0.895 -11.109 9.231 1.00 0.00 H new ATOM 0 HD12 LEU A 149 -2.594 -11.598 9.030 1.00 0.00 H new ATOM 0 HD13 LEU A 149 -1.302 -12.820 8.959 1.00 0.00 H new ATOM 0 HD21 LEU A 149 0.634 -11.044 7.272 1.00 0.00 H new ATOM 0 HD22 LEU A 149 0.327 -12.750 6.871 1.00 0.00 H new ATOM 0 HD23 LEU A 149 0.041 -11.484 5.653 1.00 0.00 H new ATOM 2001 N PRO A 150 -5.815 -10.941 6.265 1.00 0.00 N ATOM 2002 CA PRO A 150 -6.882 -10.425 7.105 1.00 0.00 C ATOM 2003 C PRO A 150 -7.588 -11.558 7.854 1.00 0.00 C ATOM 2004 O PRO A 150 -7.322 -12.732 7.603 1.00 0.00 O ATOM 2005 CB PRO A 150 -7.804 -9.677 6.155 1.00 0.00 C ATOM 2006 CG PRO A 150 -7.473 -10.191 4.763 1.00 0.00 C ATOM 2007 CD PRO A 150 -6.159 -10.950 4.847 1.00 0.00 C ATOM 0 HA PRO A 150 -6.516 -9.762 7.889 1.00 0.00 H new ATOM 0 HB2 PRO A 150 -8.850 -9.860 6.401 1.00 0.00 H new ATOM 0 HB3 PRO A 150 -7.645 -8.601 6.222 1.00 0.00 H new ATOM 0 HG2 PRO A 150 -8.267 -10.842 4.398 1.00 0.00 H new ATOM 0 HG3 PRO A 150 -7.391 -9.362 4.060 1.00 0.00 H new ATOM 0 HD2 PRO A 150 -6.265 -11.968 4.472 1.00 0.00 H new ATOM 0 HD3 PRO A 150 -5.385 -10.469 4.249 1.00 0.00 H new ATOM 2015 N VAL A 151 -8.472 -11.165 8.759 1.00 0.00 N ATOM 2016 CA VAL A 151 -9.217 -12.133 9.546 1.00 0.00 C ATOM 2017 C VAL A 151 -10.418 -11.441 10.194 1.00 0.00 C ATOM 2018 O VAL A 151 -10.783 -11.754 11.326 1.00 0.00 O ATOM 2019 CB VAL A 151 -8.292 -12.803 10.565 1.00 0.00 C ATOM 2020 CG1 VAL A 151 -7.478 -13.922 9.913 1.00 0.00 C ATOM 2021 CG2 VAL A 151 -7.376 -11.775 11.232 1.00 0.00 C ATOM 0 H VAL A 151 -8.689 -10.190 8.965 1.00 0.00 H new ATOM 0 HA VAL A 151 -9.604 -12.927 8.907 1.00 0.00 H new ATOM 0 HB VAL A 151 -8.914 -13.250 11.340 1.00 0.00 H new ATOM 0 HG11 VAL A 151 -6.829 -14.382 10.658 1.00 0.00 H new ATOM 0 HG12 VAL A 151 -8.154 -14.675 9.507 1.00 0.00 H new ATOM 0 HG13 VAL A 151 -6.870 -13.508 9.108 1.00 0.00 H new ATOM 0 HG21 VAL A 151 -6.729 -12.277 11.951 1.00 0.00 H new ATOM 0 HG22 VAL A 151 -6.765 -11.286 10.473 1.00 0.00 H new ATOM 0 HG23 VAL A 151 -7.981 -11.029 11.747 1.00 0.00 H new