USER MOD reduce.3.24.130724 H: found=0, std=0, add=571, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 571 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 Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 SER OG : rot -91:sc= 1.28 USER MOD Single : A 49 TYR OH : rot 180:sc= 0 USER MOD Single : A 50 ASN : amide:sc= 0.535! C(o=0.53!,f=-6!) USER MOD Single : A 53 ASN : amide:sc=-0.00504 K(o=-0.005,f=-0.84) USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 180:sc= -0.122 USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 63 THR OG1 : rot -102:sc= 0.208 USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 66 ASN : amide:sc= 0 K(o=0,f=-0.8) USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 74 SER OG : rot 180:sc= -0.144 USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 84 TYR OH : rot 9:sc= 1.27 USER MOD Single : A 85 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 GLN : amide:sc= 0.0489 X(o=0.049,f=-0.015) USER MOD Single : A 90 GLN : amide:sc= -0.0451 X(o=-0.045,f=-0.19) USER MOD Single : A 91 GLN : amide:sc= 0.846 K(o=0.85,f=-0.0046) USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 SER OG : rot 27:sc= 0.124 USER MOD Single : A 102 TYR OH : rot 180:sc= 0 USER MOD Single : A 103 TYR OH : rot 180:sc= 0.535 USER MOD Single : A 104 THR OG1 : rot 123:sc= 2.11 USER MOD Single : A 107 SER OG : rot -19:sc= 0.938 USER MOD Single : A 108 GLN : amide:sc= -0.0173 K(o=-0.017,f=-0.86) USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 GLN : amide:sc= 0.586 K(o=0.59,f=-0.0068) USER MOD ----------------------------------------------------------------- ATOM 28 N PRO A 40 4.551 5.168 -0.040 1.00 0.00 N0 ATOM 29 CA PRO A 40 5.630 4.861 -0.973 1.00 0.00 C0 ATOM 30 C PRO A 40 6.758 4.108 -0.282 1.00 0.00 C0 ATOM 31 O PRO A 40 7.101 4.398 0.864 1.00 0.00 O0 ATOM 32 CB PRO A 40 6.081 6.247 -1.445 1.00 0.00 C0 ATOM 33 CG PRO A 40 4.863 7.096 -1.306 1.00 0.00 C0 ATOM 34 CD PRO A 40 4.204 6.603 -0.046 1.00 0.00 C0 ATOM 0 HA PRO A 40 5.321 4.213 -1.793 1.00 0.00 H new ATOM 0 HB2 PRO A 40 6.902 6.627 -0.837 1.00 0.00 H new ATOM 0 HB3 PRO A 40 6.433 6.221 -2.476 1.00 0.00 H new ATOM 0 HG2 PRO A 40 5.121 8.152 -1.232 1.00 0.00 H new ATOM 0 HG3 PRO A 40 4.204 6.989 -2.167 1.00 0.00 H new ATOM 0 HD2 PRO A 40 4.585 7.116 0.838 1.00 0.00 H new ATOM 0 HD3 PRO A 40 3.125 6.759 -0.065 1.00 0.00 H new ATOM 42 N LYS A 41 7.331 3.138 -0.984 1.00 0.00 N0 ATOM 43 CA LYS A 41 8.481 2.399 -0.474 1.00 0.00 C0 ATOM 44 C LYS A 41 9.667 3.323 -0.235 1.00 0.00 C0 ATOM 45 O LYS A 41 10.044 4.104 -1.107 1.00 0.00 O0 ATOM 46 CB LYS A 41 8.871 1.281 -1.442 1.00 0.00 C0 ATOM 47 CG LYS A 41 10.014 0.399 -0.957 1.00 0.00 C0 ATOM 48 CD LYS A 41 10.297 -0.730 -1.937 1.00 0.00 C0 ATOM 49 CE LYS A 41 11.444 -1.607 -1.457 1.00 0.00 C0 ATOM 50 NZ LYS A 41 11.732 -2.716 -2.407 1.00 0.00 N0 ATOM 0 H LYS A 41 7.018 2.844 -1.909 1.00 0.00 H new ATOM 0 HA LYS A 41 8.197 1.957 0.481 1.00 0.00 H new ATOM 0 HB2 LYS A 41 7.998 0.655 -1.626 1.00 0.00 H new ATOM 0 HB3 LYS A 41 9.151 1.725 -2.397 1.00 0.00 H new ATOM 0 HG2 LYS A 41 10.912 1.003 -0.826 1.00 0.00 H new ATOM 0 HG3 LYS A 41 9.765 -0.018 0.019 1.00 0.00 H new ATOM 0 HD2 LYS A 41 9.401 -1.337 -2.063 1.00 0.00 H new ATOM 0 HD3 LYS A 41 10.540 -0.313 -2.914 1.00 0.00 H new ATOM 0 HE2 LYS A 41 12.338 -0.997 -1.330 1.00 0.00 H new ATOM 0 HE3 LYS A 41 11.199 -2.021 -0.479 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 12.520 -3.289 -2.043 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 10.887 -3.314 -2.509 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 11.991 -2.321 -3.334 1.00 0.00 H new ATOM 64 N GLY A 42 10.254 3.228 0.953 1.00 0.00 N0 ATOM 65 CA GLY A 42 11.344 4.114 1.344 1.00 0.00 C0 ATOM 66 C GLY A 42 10.845 5.241 2.238 1.00 0.00 C0 ATOM 67 O GLY A 42 11.608 6.128 2.621 1.00 0.00 O0 ATOM 0 H GLY A 42 9.992 2.544 1.663 1.00 0.00 H new ATOM 0 HA2 GLY A 42 12.110 3.543 1.868 1.00 0.00 H new ATOM 0 HA3 GLY A 42 11.812 4.533 0.454 1.00 0.00 H new ATOM 71 N SER A 43 9.559 5.201 2.569 1.00 0.00 N0 ATOM 72 CA SER A 43 8.980 6.153 3.511 1.00 0.00 C0 ATOM 73 C SER A 43 9.111 5.655 4.945 1.00 0.00 C0 ATOM 74 O SER A 43 9.342 4.470 5.182 1.00 0.00 O0 ATOM 75 CB SER A 43 7.519 6.392 3.181 1.00 0.00 C0 ATOM 76 OG SER A 43 6.764 5.229 3.377 1.00 0.00 O0 ATOM 0 H SER A 43 8.897 4.519 2.199 1.00 0.00 H new ATOM 0 HA SER A 43 9.528 7.091 3.422 1.00 0.00 H new ATOM 0 HB2 SER A 43 7.127 7.194 3.807 1.00 0.00 H new ATOM 0 HB3 SER A 43 7.425 6.721 2.146 1.00 0.00 H new ATOM 0 HG SER A 43 6.733 4.715 2.543 1.00 0.00 H new ATOM 82 N ALA A 44 8.964 6.569 5.898 1.00 0.00 N0 ATOM 83 CA ALA A 44 9.060 6.224 7.312 1.00 0.00 C0 ATOM 84 C ALA A 44 7.678 6.059 7.934 1.00 0.00 C0 ATOM 85 O ALA A 44 6.723 6.723 7.532 1.00 0.00 O0 ATOM 86 CB ALA A 44 9.856 7.281 8.063 1.00 0.00 C0 ATOM 0 H ALA A 44 8.778 7.555 5.717 1.00 0.00 H new ATOM 0 HA ALA A 44 9.581 5.270 7.391 1.00 0.00 H new ATOM 0 HB1 ALA A 44 9.919 7.009 9.117 1.00 0.00 H new ATOM 0 HB2 ALA A 44 10.860 7.346 7.645 1.00 0.00 H new ATOM 0 HB3 ALA A 44 9.360 8.247 7.966 1.00 0.00 H new ATOM 92 N PHE A 45 7.581 5.170 8.916 1.00 0.00 N0 ATOM 93 CA PHE A 45 6.318 4.920 9.599 1.00 0.00 C0 ATOM 94 C PHE A 45 6.430 5.216 11.090 1.00 0.00 C0 ATOM 95 O PHE A 45 7.433 4.885 11.725 1.00 0.00 O0 ATOM 96 CB PHE A 45 5.876 3.470 9.395 1.00 0.00 C0 ATOM 97 CG PHE A 45 5.675 3.095 7.953 1.00 0.00 C0 ATOM 98 CD1 PHE A 45 6.729 2.608 7.196 1.00 0.00 C0 ATOM 99 CD2 PHE A 45 4.434 3.231 7.353 1.00 0.00 C0 ATOM 100 CE1 PHE A 45 6.547 2.263 5.870 1.00 0.00 C0 ATOM 101 CE2 PHE A 45 4.247 2.887 6.029 1.00 0.00 C0 ATOM 102 CZ PHE A 45 5.306 2.402 5.286 1.00 0.00 C0 ATOM 0 H PHE A 45 8.363 4.610 9.257 1.00 0.00 H new ATOM 0 HA PHE A 45 5.572 5.587 9.168 1.00 0.00 H new ATOM 0 HB2 PHE A 45 6.623 2.807 9.833 1.00 0.00 H new ATOM 0 HB3 PHE A 45 4.945 3.304 9.937 1.00 0.00 H new ATOM 0 HD1 PHE A 45 7.704 2.497 7.647 1.00 0.00 H new ATOM 0 HD2 PHE A 45 3.602 3.611 7.928 1.00 0.00 H new ATOM 0 HE1 PHE A 45 7.377 1.885 5.292 1.00 0.00 H new ATOM 0 HE2 PHE A 45 3.274 2.997 5.574 1.00 0.00 H new ATOM 0 HZ PHE A 45 5.162 2.132 4.250 1.00 0.00 H new ATOM 112 N VAL A 46 5.396 5.840 11.644 1.00 0.00 N0 ATOM 113 CA VAL A 46 5.384 6.196 13.058 1.00 0.00 C0 ATOM 114 C VAL A 46 3.971 6.153 13.624 1.00 0.00 C0 ATOM 115 O VAL A 46 3.007 6.496 12.941 1.00 0.00 O0 ATOM 116 CB VAL A 46 5.972 7.606 13.258 1.00 0.00 C0 ATOM 117 CG1 VAL A 46 5.078 8.652 12.608 1.00 0.00 C0 ATOM 118 CG2 VAL A 46 6.142 7.889 14.743 1.00 0.00 C0 ATOM 0 H VAL A 46 4.555 6.110 11.135 1.00 0.00 H new ATOM 0 HA VAL A 46 5.995 5.466 13.590 1.00 0.00 H new ATOM 0 HB VAL A 46 6.950 7.654 12.780 1.00 0.00 H new ATOM 0 HG11 VAL A 46 5.508 9.642 12.759 1.00 0.00 H new ATOM 0 HG12 VAL A 46 4.998 8.450 11.540 1.00 0.00 H new ATOM 0 HG13 VAL A 46 4.087 8.614 13.059 1.00 0.00 H new ATOM 0 HG21 VAL A 46 6.558 8.887 14.878 1.00 0.00 H new ATOM 0 HG22 VAL A 46 5.173 7.830 15.238 1.00 0.00 H new ATOM 0 HG23 VAL A 46 6.817 7.153 15.179 1.00 0.00 H new ATOM 128 N ARG A 47 3.855 5.727 14.878 1.00 0.00 N0 ATOM 129 CA ARG A 47 2.567 5.692 15.560 1.00 0.00 C0 ATOM 130 C ARG A 47 2.710 6.066 17.029 1.00 0.00 C0 ATOM 131 O ARG A 47 3.769 5.879 17.627 1.00 0.00 O0 ATOM 132 CB ARG A 47 1.941 4.310 15.450 1.00 0.00 C0 ATOM 133 CG ARG A 47 2.716 3.200 16.143 1.00 0.00 C0 ATOM 134 CD ARG A 47 2.049 1.882 15.983 1.00 0.00 C0 ATOM 135 NE ARG A 47 2.825 0.806 16.576 1.00 0.00 N0 ATOM 136 CZ ARG A 47 2.465 -0.492 16.570 1.00 0.00 C0 ATOM 137 NH1 ARG A 47 1.338 -0.858 15.998 1.00 0.00 N0 ATOM 138 NH2 ARG A 47 3.242 -1.397 17.138 1.00 0.00 N0 ATOM 0 H ARG A 47 4.639 5.401 15.443 1.00 0.00 H new ATOM 0 HA ARG A 47 1.920 6.423 15.074 1.00 0.00 H new ATOM 0 HB2 ARG A 47 0.936 4.348 15.869 1.00 0.00 H new ATOM 0 HB3 ARG A 47 1.837 4.057 14.395 1.00 0.00 H new ATOM 0 HG2 ARG A 47 3.725 3.150 15.733 1.00 0.00 H new ATOM 0 HG3 ARG A 47 2.814 3.432 17.204 1.00 0.00 H new ATOM 0 HD2 ARG A 47 1.063 1.916 16.446 1.00 0.00 H new ATOM 0 HD3 ARG A 47 1.897 1.678 14.923 1.00 0.00 H new ATOM 0 HE ARG A 47 3.705 1.051 17.029 1.00 0.00 H new ATOM 0 HH11 ARG A 47 0.738 -0.159 15.560 1.00 0.00 H new ATOM 0 HH12 ARG A 47 1.064 -1.841 15.993 1.00 0.00 H new ATOM 0 HH21 ARG A 47 4.115 -1.113 17.582 1.00 0.00 H new ATOM 0 HH22 ARG A 47 2.968 -2.380 17.133 1.00 0.00 H new ATOM 152 N ALA A 48 1.638 6.598 17.606 1.00 0.00 N0 ATOM 153 CA ALA A 48 1.593 6.869 19.039 1.00 0.00 C0 ATOM 154 C ALA A 48 0.963 5.709 19.800 1.00 0.00 C0 ATOM 155 O ALA A 48 0.179 4.942 19.242 1.00 0.00 O0 ATOM 156 CB ALA A 48 0.831 8.156 19.310 1.00 0.00 C0 ATOM 0 H ALA A 48 0.787 6.851 17.103 1.00 0.00 H new ATOM 0 HA ALA A 48 2.618 6.985 19.392 1.00 0.00 H new ATOM 0 HB1 ALA A 48 0.806 8.345 20.383 1.00 0.00 H new ATOM 0 HB2 ALA A 48 1.328 8.986 18.807 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -0.188 8.062 18.934 1.00 0.00 H new ATOM 162 N TYR A 49 1.312 5.588 21.075 1.00 0.00 N0 ATOM 163 CA TYR A 49 0.704 4.586 21.942 1.00 0.00 C0 ATOM 164 C TYR A 49 0.332 5.181 23.297 1.00 0.00 C0 ATOM 165 O TYR A 49 1.147 5.844 23.938 1.00 0.00 O0 ATOM 166 CB TYR A 49 1.646 3.395 22.128 1.00 0.00 C0 ATOM 167 CG TYR A 49 1.111 2.332 23.061 1.00 0.00 C0 ATOM 168 CD1 TYR A 49 0.072 1.509 22.651 1.00 0.00 C0 ATOM 169 CD2 TYR A 49 1.659 2.178 24.325 1.00 0.00 C0 ATOM 170 CE1 TYR A 49 -0.417 0.538 23.503 1.00 0.00 C0 ATOM 171 CE2 TYR A 49 1.170 1.207 25.178 1.00 0.00 C0 ATOM 172 CZ TYR A 49 0.136 0.389 24.770 1.00 0.00 C0 ATOM 173 OH TYR A 49 -0.351 -0.579 25.620 1.00 0.00 O0 ATOM 0 H TYR A 49 2.013 6.171 21.532 1.00 0.00 H new ATOM 0 HA TYR A 49 -0.211 4.240 21.461 1.00 0.00 H new ATOM 0 HB2 TYR A 49 1.844 2.945 21.155 1.00 0.00 H new ATOM 0 HB3 TYR A 49 2.600 3.755 22.512 1.00 0.00 H new ATOM 0 HD1 TYR A 49 -0.354 1.628 21.666 1.00 0.00 H new ATOM 0 HD2 TYR A 49 2.469 2.818 24.643 1.00 0.00 H new ATOM 0 HE1 TYR A 49 -1.226 -0.103 23.186 1.00 0.00 H new ATOM 0 HE2 TYR A 49 1.597 1.088 26.163 1.00 0.00 H new ATOM 0 HH TYR A 49 0.145 -0.552 26.465 1.00 0.00 H new ATOM 183 N ASN A 50 -0.902 4.939 23.725 1.00 0.00 N0 ATOM 184 CA ASN A 50 -1.408 5.511 24.966 1.00 0.00 C0 ATOM 185 C ASN A 50 -1.414 4.479 26.086 1.00 0.00 C0 ATOM 186 O ASN A 50 -2.371 3.721 26.239 1.00 0.00 O0 ATOM 187 CB ASN A 50 -2.796 6.087 24.762 1.00 0.00 C0 ATOM 188 CG ASN A 50 -3.344 6.729 26.006 1.00 0.00 C0 ATOM 189 OD1 ASN A 50 -2.870 6.464 27.117 1.00 0.00 O0 ATOM 190 ND2 ASN A 50 -4.335 7.568 25.841 1.00 0.00 N0 ATOM 0 H ASN A 50 -1.571 4.350 23.230 1.00 0.00 H new ATOM 0 HA ASN A 50 -0.738 6.319 25.260 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -2.765 6.825 23.960 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -3.471 5.294 24.439 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -4.749 8.034 26.649 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -4.694 7.756 24.905 1.00 0.00 H new ATOM 197 N ALA A 51 -0.340 4.455 26.869 1.00 0.00 N0 ATOM 198 CA ALA A 51 -0.246 3.559 28.014 1.00 0.00 C0 ATOM 199 C ALA A 51 -1.001 4.117 29.215 1.00 0.00 C0 ATOM 200 O ALA A 51 -0.394 4.539 30.199 1.00 0.00 O0 ATOM 201 CB ALA A 51 1.211 3.308 28.374 1.00 0.00 C0 ATOM 0 H ALA A 51 0.479 5.048 26.730 1.00 0.00 H new ATOM 0 HA ALA A 51 -0.708 2.611 27.737 1.00 0.00 H new ATOM 0 HB1 ALA A 51 1.264 2.637 29.231 1.00 0.00 H new ATOM 0 HB2 ALA A 51 1.722 2.854 27.525 1.00 0.00 H new ATOM 0 HB3 ALA A 51 1.692 4.254 28.624 1.00 0.00 H new ATOM 207 N GLY A 52 -2.325 4.117 29.127 1.00 0.00 N0 ATOM 208 CA GLY A 52 -3.165 4.624 30.206 1.00 0.00 C0 ATOM 209 C GLY A 52 -4.621 4.726 29.770 1.00 0.00 C0 ATOM 210 O GLY A 52 -4.957 4.438 28.621 1.00 0.00 O0 ATOM 0 H GLY A 52 -2.842 3.771 28.318 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -3.087 3.965 31.071 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -2.807 5.605 30.519 1.00 0.00 H new ATOM 214 N ASN A 53 -5.482 5.135 30.694 1.00 0.00 N0 ATOM 215 CA ASN A 53 -6.917 5.186 30.436 1.00 0.00 C0 ATOM 216 C ASN A 53 -7.357 6.593 30.056 1.00 0.00 C0 ATOM 217 O ASN A 53 -8.508 6.813 29.675 1.00 0.00 O0 ATOM 218 CB ASN A 53 -7.695 4.690 31.640 1.00 0.00 C0 ATOM 219 CG ASN A 53 -7.497 3.222 31.892 1.00 0.00 C0 ATOM 220 OD1 ASN A 53 -7.385 2.427 30.952 1.00 0.00 O0 ATOM 221 ND2 ASN A 53 -7.448 2.846 33.144 1.00 0.00 N0 ATOM 0 H ASN A 53 -5.212 5.437 31.630 1.00 0.00 H new ATOM 0 HA ASN A 53 -7.129 4.529 29.593 1.00 0.00 H new ATOM 0 HB2 ASN A 53 -7.388 5.251 32.523 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -8.756 4.889 31.489 1.00 0.00 H new ATOM 0 HD21 ASN A 53 -7.313 1.862 33.376 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -7.545 3.537 33.888 1.00 0.00 H new ATOM 228 N SER A 54 -6.436 7.546 30.160 1.00 0.00 N0 ATOM 229 CA SER A 54 -6.717 8.929 29.791 1.00 0.00 C0 ATOM 230 C SER A 54 -6.175 9.249 28.405 1.00 0.00 C0 ATOM 231 O SER A 54 -5.049 8.883 28.067 1.00 0.00 O0 ATOM 232 CB SER A 54 -6.114 9.874 30.811 1.00 0.00 C0 ATOM 233 OG SER A 54 -6.286 11.209 30.423 1.00 0.00 O0 ATOM 0 H SER A 54 -5.487 7.385 30.497 1.00 0.00 H new ATOM 0 HA SER A 54 -7.799 9.060 29.773 1.00 0.00 H new ATOM 0 HB2 SER A 54 -6.580 9.711 31.783 1.00 0.00 H new ATOM 0 HB3 SER A 54 -5.052 9.659 30.927 1.00 0.00 H new ATOM 0 HG SER A 54 -5.890 11.799 31.098 1.00 0.00 H new ATOM 239 N GLU A 55 -6.983 9.936 27.604 1.00 0.00 N0 ATOM 240 CA GLU A 55 -6.557 10.373 26.278 1.00 0.00 C0 ATOM 241 C GLU A 55 -5.371 11.324 26.367 1.00 0.00 C0 ATOM 242 O GLU A 55 -5.310 12.177 27.253 1.00 0.00 O0 ATOM 243 CB GLU A 55 -7.714 11.052 25.545 1.00 0.00 C0 ATOM 244 CG GLU A 55 -8.861 10.120 25.178 1.00 0.00 C0 ATOM 245 CD GLU A 55 -9.858 9.955 26.289 1.00 0.00 C0 ATOM 246 OE1 GLU A 55 -9.586 10.400 27.378 1.00 0.00 O0 ATOM 247 OE2 GLU A 55 -10.896 9.383 26.048 1.00 0.00 O0 ATOM 0 H GLU A 55 -7.937 10.202 27.849 1.00 0.00 H new ATOM 0 HA GLU A 55 -6.247 9.490 25.719 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -8.102 11.856 26.170 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -7.331 11.512 24.634 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -9.369 10.508 24.295 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -8.458 9.143 24.911 1.00 0.00 H new ATOM 254 N LEU A 56 -4.428 11.173 25.442 1.00 0.00 N0 ATOM 255 CA LEU A 56 -3.195 11.949 25.472 1.00 0.00 C0 ATOM 256 C LEU A 56 -2.982 12.694 24.161 1.00 0.00 C0 ATOM 257 O LEU A 56 -3.327 12.196 23.089 1.00 0.00 O0 ATOM 258 CB LEU A 56 -1.996 11.033 25.747 1.00 0.00 C0 ATOM 259 CG LEU A 56 -2.014 10.303 27.095 1.00 0.00 C0 ATOM 260 CD1 LEU A 56 -0.853 9.319 27.154 1.00 0.00 C0 ATOM 261 CD2 LEU A 56 -1.928 11.318 28.225 1.00 0.00 C0 ATOM 0 H LEU A 56 -4.495 10.519 24.662 1.00 0.00 H new ATOM 0 HA LEU A 56 -3.281 12.681 26.275 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -1.940 10.289 24.952 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -1.085 11.629 25.690 1.00 0.00 H new ATOM 0 HG LEU A 56 -2.944 9.746 27.205 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -0.865 8.799 28.112 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -0.950 8.593 26.346 1.00 0.00 H new ATOM 0 HD13 LEU A 56 0.088 9.859 27.046 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -1.941 10.798 29.183 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -1.003 11.887 28.133 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -2.779 11.997 28.169 1.00 0.00 H new ATOM 273 N ASP A 57 -2.412 13.892 24.251 1.00 0.00 N0 ATOM 274 CA ASP A 57 -2.044 14.657 23.064 1.00 0.00 C0 ATOM 275 C ASP A 57 -0.537 14.655 22.852 1.00 0.00 C0 ATOM 276 O ASP A 57 0.209 15.256 23.624 1.00 0.00 O0 ATOM 277 CB ASP A 57 -2.549 16.097 23.181 1.00 0.00 C0 ATOM 278 CG ASP A 57 -4.068 16.194 23.209 1.00 0.00 C0 ATOM 279 OD1 ASP A 57 -4.712 15.281 22.748 1.00 0.00 O0 ATOM 280 OD2 ASP A 57 -4.571 17.180 23.692 1.00 0.00 O0 ATOM 0 H ASP A 57 -2.195 14.354 25.134 1.00 0.00 H new ATOM 0 HA ASP A 57 -2.512 14.180 22.203 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -2.145 16.545 24.089 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -2.169 16.679 22.342 1.00 0.00 H new ATOM 285 N VAL A 58 -0.093 13.976 21.800 1.00 0.00 N0 ATOM 286 CA VAL A 58 1.330 13.858 21.508 1.00 0.00 C0 ATOM 287 C VAL A 58 1.626 14.215 20.056 1.00 0.00 C0 ATOM 288 O VAL A 58 0.716 14.316 19.234 1.00 0.00 O0 ATOM 289 CB VAL A 58 1.817 12.425 21.791 1.00 0.00 C0 ATOM 290 CG1 VAL A 58 1.576 12.059 23.248 1.00 0.00 C0 ATOM 291 CG2 VAL A 58 1.111 11.445 20.866 1.00 0.00 C0 ATOM 0 H VAL A 58 -0.700 13.498 21.134 1.00 0.00 H new ATOM 0 HA VAL A 58 1.860 14.558 22.154 1.00 0.00 H new ATOM 0 HB VAL A 58 2.889 12.373 21.602 1.00 0.00 H new ATOM 0 HG11 VAL A 58 1.926 11.043 23.431 1.00 0.00 H new ATOM 0 HG12 VAL A 58 2.119 12.751 23.892 1.00 0.00 H new ATOM 0 HG13 VAL A 58 0.510 12.120 23.467 1.00 0.00 H new ATOM 0 HG21 VAL A 58 1.461 10.433 21.072 1.00 0.00 H new ATOM 0 HG22 VAL A 58 0.035 11.498 21.033 1.00 0.00 H new ATOM 0 HG23 VAL A 58 1.331 11.700 19.829 1.00 0.00 H new ATOM 301 N SER A 59 2.905 14.403 19.748 1.00 0.00 N0 ATOM 302 CA SER A 59 3.324 14.735 18.392 1.00 0.00 C0 ATOM 303 C SER A 59 4.700 14.159 18.085 1.00 0.00 C0 ATOM 304 O SER A 59 5.478 13.866 18.992 1.00 0.00 O0 ATOM 305 CB SER A 59 3.344 16.242 18.206 1.00 0.00 C0 ATOM 306 OG SER A 59 4.322 16.834 19.015 1.00 0.00 O0 ATOM 0 H SER A 59 3.669 14.331 20.420 1.00 0.00 H new ATOM 0 HA SER A 59 2.606 14.294 17.700 1.00 0.00 H new ATOM 0 HB2 SER A 59 3.539 16.481 17.160 1.00 0.00 H new ATOM 0 HB3 SER A 59 2.365 16.655 18.450 1.00 0.00 H new ATOM 0 HG SER A 59 4.317 17.804 18.877 1.00 0.00 H new ATOM 312 N VAL A 60 4.995 13.999 16.799 1.00 0.00 N0 ATOM 313 CA VAL A 60 6.319 13.575 16.364 1.00 0.00 C0 ATOM 314 C VAL A 60 6.891 14.531 15.324 1.00 0.00 C0 ATOM 315 O VAL A 60 6.757 14.306 14.121 1.00 0.00 O0 ATOM 316 CB VAL A 60 6.258 12.154 15.772 1.00 0.00 C0 ATOM 317 CG1 VAL A 60 7.648 11.684 15.369 1.00 0.00 C0 ATOM 318 CG2 VAL A 60 5.638 11.199 16.780 1.00 0.00 C0 ATOM 0 H VAL A 60 4.333 14.157 16.039 1.00 0.00 H new ATOM 0 HA VAL A 60 6.971 13.580 17.238 1.00 0.00 H new ATOM 0 HB VAL A 60 5.635 12.171 14.878 1.00 0.00 H new ATOM 0 HG11 VAL A 60 7.586 10.678 14.953 1.00 0.00 H new ATOM 0 HG12 VAL A 60 8.058 12.362 14.620 1.00 0.00 H new ATOM 0 HG13 VAL A 60 8.297 11.675 16.245 1.00 0.00 H new ATOM 0 HG21 VAL A 60 5.598 10.196 16.354 1.00 0.00 H new ATOM 0 HG22 VAL A 60 6.242 11.185 17.687 1.00 0.00 H new ATOM 0 HG23 VAL A 60 4.628 11.531 17.022 1.00 0.00 H new ATOM 328 N GLY A 61 7.527 15.597 15.795 1.00 0.00 N0 ATOM 329 CA GLY A 61 8.048 16.633 14.907 1.00 0.00 C0 ATOM 330 C GLY A 61 6.917 17.399 14.234 1.00 0.00 C0 ATOM 331 O GLY A 61 6.179 18.136 14.887 1.00 0.00 O0 ATOM 0 H GLY A 61 7.695 15.768 16.786 1.00 0.00 H new ATOM 0 HA2 GLY A 61 8.671 17.324 15.475 1.00 0.00 H new ATOM 0 HA3 GLY A 61 8.686 16.179 14.148 1.00 0.00 H new ATOM 335 N SER A 62 6.787 17.220 12.924 1.00 0.00 N0 ATOM 336 CA SER A 62 5.727 17.871 12.163 1.00 0.00 C0 ATOM 337 C SER A 62 4.436 17.065 12.218 1.00 0.00 C0 ATOM 338 O SER A 62 3.371 17.554 11.838 1.00 0.00 O0 ATOM 339 CB SER A 62 6.158 18.055 10.721 1.00 0.00 C0 ATOM 340 OG SER A 62 6.276 16.821 10.071 1.00 0.00 O0 ATOM 0 H SER A 62 7.403 16.629 12.366 1.00 0.00 H new ATOM 0 HA SER A 62 5.540 18.847 12.612 1.00 0.00 H new ATOM 0 HB2 SER A 62 5.433 18.678 10.198 1.00 0.00 H new ATOM 0 HB3 SER A 62 7.112 18.580 10.687 1.00 0.00 H new ATOM 0 HG SER A 62 6.553 16.966 9.142 1.00 0.00 H new ATOM 346 N THR A 63 4.535 15.829 12.693 1.00 0.00 N0 ATOM 347 CA THR A 63 3.382 14.940 12.766 1.00 0.00 C0 ATOM 348 C THR A 63 2.581 15.178 14.040 1.00 0.00 C0 ATOM 349 O THR A 63 3.127 15.141 15.142 1.00 0.00 O0 ATOM 350 CB THR A 63 3.813 13.464 12.694 1.00 0.00 C0 ATOM 351 OG1 THR A 63 4.471 13.216 11.444 1.00 0.00 O0 ATOM 352 CG2 THR A 63 2.605 12.549 12.817 1.00 0.00 C0 ATOM 0 H THR A 63 5.404 15.419 13.034 1.00 0.00 H new ATOM 0 HA THR A 63 2.749 15.164 11.907 1.00 0.00 H new ATOM 0 HB THR A 63 4.496 13.260 13.519 1.00 0.00 H new ATOM 0 HG1 THR A 63 3.854 12.760 10.834 1.00 0.00 H new ATOM 0 HG21 THR A 63 2.929 11.510 12.764 1.00 0.00 H new ATOM 0 HG22 THR A 63 2.110 12.726 13.772 1.00 0.00 H new ATOM 0 HG23 THR A 63 1.909 12.754 12.004 1.00 0.00 H new ATOM 360 N SER A 64 1.284 15.421 13.882 1.00 0.00 N0 ATOM 361 CA SER A 64 0.404 15.651 15.020 1.00 0.00 C0 ATOM 362 C SER A 64 -0.445 14.423 15.316 1.00 0.00 C0 ATOM 363 O SER A 64 -1.226 13.979 14.475 1.00 0.00 O0 ATOM 364 CB SER A 64 -0.493 16.846 14.755 1.00 0.00 C0 ATOM 365 OG SER A 64 -1.427 17.010 15.785 1.00 0.00 O0 ATOM 0 H SER A 64 0.819 15.464 12.975 1.00 0.00 H new ATOM 0 HA SER A 64 1.027 15.854 15.891 1.00 0.00 H new ATOM 0 HB2 SER A 64 0.113 17.747 14.662 1.00 0.00 H new ATOM 0 HB3 SER A 64 -1.012 16.712 13.806 1.00 0.00 H new ATOM 0 HG SER A 64 -1.993 17.787 15.593 1.00 0.00 H new ATOM 371 N LEU A 65 -0.289 13.877 16.519 1.00 0.00 N0 ATOM 372 CA LEU A 65 -1.038 12.695 16.926 1.00 0.00 C0 ATOM 373 C LEU A 65 -1.794 12.943 18.225 1.00 0.00 C0 ATOM 374 O LEU A 65 -1.479 12.354 19.259 1.00 0.00 O0 ATOM 375 CB LEU A 65 -0.091 11.501 17.098 1.00 0.00 C0 ATOM 376 CG LEU A 65 0.702 11.095 15.849 1.00 0.00 C0 ATOM 377 CD1 LEU A 65 1.755 10.063 16.229 1.00 0.00 C0 ATOM 378 CD2 LEU A 65 -0.249 10.546 14.797 1.00 0.00 C0 ATOM 0 H LEU A 65 0.350 14.236 17.228 1.00 0.00 H new ATOM 0 HA LEU A 65 -1.763 12.472 16.143 1.00 0.00 H new ATOM 0 HB2 LEU A 65 0.616 11.733 17.895 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -0.675 10.643 17.430 1.00 0.00 H new ATOM 0 HG LEU A 65 1.208 11.965 15.431 1.00 0.00 H new ATOM 0 HD11 LEU A 65 2.318 9.774 15.342 1.00 0.00 H new ATOM 0 HD12 LEU A 65 2.434 10.491 16.967 1.00 0.00 H new ATOM 0 HD13 LEU A 65 1.267 9.184 16.651 1.00 0.00 H new ATOM 0 HD21 LEU A 65 0.316 10.258 13.910 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -0.768 9.674 15.195 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -0.978 11.312 14.530 1.00 0.00 H new ATOM 390 N ASN A 66 -2.792 13.818 18.165 1.00 0.00 N0 ATOM 391 CA ASN A 66 -3.492 14.264 19.364 1.00 0.00 C0 ATOM 392 C ASN A 66 -4.703 13.388 19.654 1.00 0.00 C0 ATOM 393 O ASN A 66 -5.219 12.711 18.763 1.00 0.00 O0 ATOM 394 CB ASN A 66 -3.906 15.719 19.229 1.00 0.00 C0 ATOM 395 CG ASN A 66 -2.726 16.648 19.140 1.00 0.00 C0 ATOM 396 OD1 ASN A 66 -1.697 16.429 19.790 1.00 0.00 O0 ATOM 397 ND2 ASN A 66 -2.856 17.682 18.350 1.00 0.00 N0 ATOM 0 H ASN A 66 -3.134 14.233 17.298 1.00 0.00 H new ATOM 0 HA ASN A 66 -2.805 14.174 20.206 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -4.525 15.836 18.339 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -4.521 15.999 20.084 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -2.090 18.348 18.251 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -3.724 17.823 17.833 1.00 0.00 H new ATOM 404 N ASP A 67 -5.155 13.402 20.903 1.00 0.00 N0 ATOM 405 CA ASP A 67 -6.327 12.637 21.304 1.00 0.00 C0 ATOM 406 C ASP A 67 -6.168 11.163 20.957 1.00 0.00 C0 ATOM 407 O ASP A 67 -6.955 10.607 20.190 1.00 0.00 O0 ATOM 408 CB ASP A 67 -7.587 13.193 20.633 1.00 0.00 C0 ATOM 409 CG ASP A 67 -8.871 12.700 21.284 1.00 0.00 C0 ATOM 410 OD1 ASP A 67 -8.829 12.331 22.433 1.00 0.00 O0 ATOM 411 OD2 ASP A 67 -9.884 12.699 20.625 1.00 0.00 O0 ATOM 0 H ASP A 67 -4.725 13.937 21.657 1.00 0.00 H new ATOM 0 HA ASP A 67 -6.427 12.729 22.386 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -7.562 14.282 20.670 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -7.587 12.910 19.580 1.00 0.00 H new ATOM 416 N VAL A 68 -5.146 10.533 21.526 1.00 0.00 N0 ATOM 417 CA VAL A 68 -4.921 9.106 21.331 1.00 0.00 C0 ATOM 418 C VAL A 68 -5.784 8.278 22.275 1.00 0.00 C0 ATOM 419 O VAL A 68 -5.823 8.534 23.478 1.00 0.00 O0 ATOM 420 CB VAL A 68 -3.438 8.762 21.562 1.00 0.00 C0 ATOM 421 CG1 VAL A 68 -3.201 7.270 21.381 1.00 0.00 C0 ATOM 422 CG2 VAL A 68 -2.564 9.565 20.611 1.00 0.00 C0 ATOM 0 H VAL A 68 -4.459 10.989 22.127 1.00 0.00 H new ATOM 0 HA VAL A 68 -5.196 8.865 20.304 1.00 0.00 H new ATOM 0 HB VAL A 68 -3.172 9.024 22.586 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -2.147 7.046 21.548 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -3.808 6.716 22.097 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -3.478 6.978 20.368 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -1.517 9.316 20.781 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -2.831 9.326 19.582 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -2.717 10.630 20.788 1.00 0.00 H new ATOM 432 N ALA A 69 -6.474 7.287 21.722 1.00 0.00 N0 ATOM 433 CA ALA A 69 -7.474 6.537 22.472 1.00 0.00 C0 ATOM 434 C ALA A 69 -6.845 5.820 23.662 1.00 0.00 C0 ATOM 435 O ALA A 69 -5.694 5.389 23.601 1.00 0.00 O0 ATOM 436 CB ALA A 69 -8.179 5.540 21.565 1.00 0.00 C0 ATOM 0 H ALA A 69 -6.359 6.984 20.755 1.00 0.00 H new ATOM 0 HA ALA A 69 -8.209 7.245 22.855 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -8.923 4.988 22.140 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -8.671 6.073 20.752 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -7.449 4.844 21.153 1.00 0.00 H new ATOM 442 N PRO A 70 -7.610 5.694 24.740 1.00 0.00 N0 ATOM 443 CA PRO A 70 -7.143 4.996 25.933 1.00 0.00 C0 ATOM 444 C PRO A 70 -6.677 3.585 25.598 1.00 0.00 C0 ATOM 445 O PRO A 70 -7.390 2.823 24.947 1.00 0.00 O0 ATOM 446 CB PRO A 70 -8.382 4.981 26.832 1.00 0.00 C0 ATOM 447 CG PRO A 70 -9.154 6.187 26.411 1.00 0.00 C0 ATOM 448 CD PRO A 70 -8.974 6.245 24.918 1.00 0.00 C0 ATOM 0 HA PRO A 70 -6.283 5.474 26.403 1.00 0.00 H new ATOM 0 HB2 PRO A 70 -8.962 4.069 26.695 1.00 0.00 H new ATOM 0 HB3 PRO A 70 -8.110 5.030 27.886 1.00 0.00 H new ATOM 0 HG2 PRO A 70 -10.206 6.099 26.681 1.00 0.00 H new ATOM 0 HG3 PRO A 70 -8.776 7.089 26.892 1.00 0.00 H new ATOM 0 HD2 PRO A 70 -9.723 5.651 24.395 1.00 0.00 H new ATOM 0 HD3 PRO A 70 -9.053 7.264 24.539 1.00 0.00 H new ATOM 456 N LEU A 71 -5.474 3.244 26.046 1.00 0.00 N0 ATOM 457 CA LEU A 71 -4.887 1.940 25.755 1.00 0.00 C0 ATOM 458 C LEU A 71 -4.944 1.633 24.264 1.00 0.00 C0 ATOM 459 O LEU A 71 -5.096 0.478 23.864 1.00 0.00 O0 ATOM 460 CB LEU A 71 -5.621 0.844 26.537 1.00 0.00 C0 ATOM 461 CG LEU A 71 -5.633 1.011 28.062 1.00 0.00 C0 ATOM 462 CD1 LEU A 71 -6.455 -0.109 28.690 1.00 0.00 C0 ATOM 463 CD2 LEU A 71 -4.205 0.998 28.585 1.00 0.00 C0 ATOM 0 H LEU A 71 -4.885 3.853 26.613 1.00 0.00 H new ATOM 0 HA LEU A 71 -3.841 1.966 26.062 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -6.652 0.801 26.186 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -5.163 -0.116 26.298 1.00 0.00 H new ATOM 0 HG LEU A 71 -6.089 1.964 28.329 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -6.464 0.010 29.774 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -7.477 -0.066 28.312 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -6.013 -1.072 28.434 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -4.213 1.117 29.668 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -3.732 0.051 28.327 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -3.645 1.818 28.135 1.00 0.00 H new ATOM 475 N GLY A 72 -4.820 2.671 23.446 1.00 0.00 N0 ATOM 476 CA GLY A 72 -4.891 2.518 21.998 1.00 0.00 C0 ATOM 477 C GLY A 72 -3.652 3.090 21.321 1.00 0.00 C0 ATOM 478 O GLY A 72 -2.622 3.295 21.962 1.00 0.00 O0 ATOM 0 H GLY A 72 -4.670 3.629 23.761 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -4.991 1.462 21.746 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -5.780 3.022 21.620 1.00 0.00 H new ATOM 482 N SER A 73 -3.759 3.344 20.022 1.00 0.00 N0 ATOM 483 CA SER A 73 -2.633 3.848 19.245 1.00 0.00 C0 ATOM 484 C SER A 73 -3.102 4.746 18.108 1.00 0.00 C0 ATOM 485 O SER A 73 -4.287 4.777 17.779 1.00 0.00 O0 ATOM 486 CB SER A 73 -1.826 2.690 18.685 1.00 0.00 C0 ATOM 487 OG SER A 73 -2.567 1.975 17.735 1.00 0.00 O0 ATOM 0 H SER A 73 -4.615 3.209 19.484 1.00 0.00 H new ATOM 0 HA SER A 73 -2.006 4.441 19.911 1.00 0.00 H new ATOM 0 HB2 SER A 73 -0.911 3.067 18.229 1.00 0.00 H new ATOM 0 HB3 SER A 73 -1.528 2.024 19.495 1.00 0.00 H new ATOM 0 HG SER A 73 -2.026 1.235 17.387 1.00 0.00 H new ATOM 493 N SER A 74 -2.167 5.478 17.513 1.00 0.00 N0 ATOM 494 CA SER A 74 -2.480 6.362 16.397 1.00 0.00 C0 ATOM 495 C SER A 74 -1.417 6.274 15.308 1.00 0.00 C0 ATOM 496 O SER A 74 -0.345 6.866 15.426 1.00 0.00 O0 ATOM 497 CB SER A 74 -2.602 7.793 16.881 1.00 0.00 C0 ATOM 498 OG SER A 74 -2.904 8.658 15.822 1.00 0.00 O0 ATOM 0 H SER A 74 -1.184 5.476 17.786 1.00 0.00 H new ATOM 0 HA SER A 74 -3.432 6.042 15.973 1.00 0.00 H new ATOM 0 HB2 SER A 74 -3.380 7.858 17.641 1.00 0.00 H new ATOM 0 HB3 SER A 74 -1.669 8.102 17.352 1.00 0.00 H new ATOM 0 HG SER A 74 -2.979 9.575 16.160 1.00 0.00 H new ATOM 504 N ASP A 75 -1.722 5.529 14.250 1.00 0.00 N0 ATOM 505 CA ASP A 75 -0.766 5.303 13.174 1.00 0.00 C0 ATOM 506 C ASP A 75 -0.660 6.522 12.266 1.00 0.00 C0 ATOM 507 O ASP A 75 -1.619 7.277 12.112 1.00 0.00 O0 ATOM 508 CB ASP A 75 -1.168 4.078 12.347 1.00 0.00 C0 ATOM 509 CG ASP A 75 -1.088 2.779 13.138 1.00 0.00 C0 ATOM 510 OD1 ASP A 75 -0.535 2.792 14.211 1.00 0.00 O0 ATOM 511 OD2 ASP A 75 -1.581 1.785 12.660 1.00 0.00 O0 ATOM 0 H ASP A 75 -2.624 5.072 14.116 1.00 0.00 H new ATOM 0 HA ASP A 75 0.208 5.125 13.630 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -2.185 4.212 11.979 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -0.520 4.007 11.474 1.00 0.00 H new ATOM 516 N PHE A 76 0.512 6.706 11.666 1.00 0.00 N0 ATOM 517 CA PHE A 76 0.709 7.762 10.679 1.00 0.00 C0 ATOM 518 C PHE A 76 1.626 7.298 9.555 1.00 0.00 C0 ATOM 519 O PHE A 76 2.726 6.803 9.802 1.00 0.00 O0 ATOM 520 CB PHE A 76 1.294 9.010 11.340 1.00 0.00 C0 ATOM 521 CG PHE A 76 1.381 10.197 10.423 1.00 0.00 C0 ATOM 522 CD1 PHE A 76 0.269 10.992 10.187 1.00 0.00 C0 ATOM 523 CD2 PHE A 76 2.573 10.520 9.795 1.00 0.00 C0 ATOM 524 CE1 PHE A 76 0.349 12.083 9.343 1.00 0.00 C0 ATOM 525 CE2 PHE A 76 2.657 11.611 8.952 1.00 0.00 C0 ATOM 526 CZ PHE A 76 1.542 12.394 8.725 1.00 0.00 C0 ATOM 0 H PHE A 76 1.340 6.138 11.846 1.00 0.00 H new ATOM 0 HA PHE A 76 -0.265 8.005 10.254 1.00 0.00 H new ATOM 0 HB2 PHE A 76 0.682 9.273 12.203 1.00 0.00 H new ATOM 0 HB3 PHE A 76 2.291 8.778 11.715 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -0.669 10.756 10.668 1.00 0.00 H new ATOM 0 HD2 PHE A 76 3.448 9.911 9.967 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -0.524 12.693 9.167 1.00 0.00 H new ATOM 0 HE2 PHE A 76 3.594 11.852 8.471 1.00 0.00 H new ATOM 0 HZ PHE A 76 1.604 13.247 8.066 1.00 0.00 H new ATOM 536 N LYS A 77 1.169 7.461 8.319 1.00 0.00 N0 ATOM 537 CA LYS A 77 1.930 7.025 7.154 1.00 0.00 C0 ATOM 538 C LYS A 77 2.320 8.208 6.277 1.00 0.00 C0 ATOM 539 O LYS A 77 1.972 9.352 6.568 1.00 0.00 O0 ATOM 540 CB LYS A 77 1.132 6.007 6.340 1.00 0.00 C0 ATOM 541 CG LYS A 77 0.800 4.724 7.091 1.00 0.00 C0 ATOM 542 CD LYS A 77 -0.040 3.785 6.237 1.00 0.00 C0 ATOM 543 CE LYS A 77 -0.406 2.521 6.999 1.00 0.00 C0 ATOM 544 NZ LYS A 77 -1.335 1.654 6.225 1.00 0.00 N0 ATOM 0 H LYS A 77 0.272 7.893 8.097 1.00 0.00 H new ATOM 0 HA LYS A 77 2.843 6.550 7.513 1.00 0.00 H new ATOM 0 HB2 LYS A 77 0.203 6.472 6.010 1.00 0.00 H new ATOM 0 HB3 LYS A 77 1.697 5.753 5.443 1.00 0.00 H new ATOM 0 HG2 LYS A 77 1.722 4.224 7.386 1.00 0.00 H new ATOM 0 HG3 LYS A 77 0.261 4.965 8.007 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -0.949 4.296 5.918 1.00 0.00 H new ATOM 0 HD3 LYS A 77 0.511 3.521 5.334 1.00 0.00 H new ATOM 0 HE2 LYS A 77 0.501 1.963 7.233 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -0.868 2.791 7.949 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -1.559 0.803 6.780 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -2.211 2.177 6.023 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -0.885 1.375 5.330 1.00 0.00 H new ATOM 558 N PHE A 78 3.044 7.925 5.199 1.00 0.00 N0 ATOM 559 CA PHE A 78 3.406 8.950 4.228 1.00 0.00 C0 ATOM 560 C PHE A 78 4.318 10.001 4.849 1.00 0.00 C0 ATOM 561 O PHE A 78 4.274 11.172 4.478 1.00 0.00 O0 ATOM 562 CB PHE A 78 2.151 9.625 3.670 1.00 0.00 C0 ATOM 563 CG PHE A 78 1.202 8.677 2.994 1.00 0.00 C0 ATOM 564 CD1 PHE A 78 0.097 8.179 3.670 1.00 0.00 C0 ATOM 565 CD2 PHE A 78 1.413 8.279 1.683 1.00 0.00 C0 ATOM 566 CE1 PHE A 78 -0.776 7.306 3.050 1.00 0.00 C0 ATOM 567 CE2 PHE A 78 0.540 7.407 1.060 1.00 0.00 C0 ATOM 568 CZ PHE A 78 -0.556 6.920 1.745 1.00 0.00 C0 ATOM 0 H PHE A 78 3.392 6.992 4.976 1.00 0.00 H new ATOM 0 HA PHE A 78 3.944 8.460 3.416 1.00 0.00 H new ATOM 0 HB2 PHE A 78 1.629 10.129 4.483 1.00 0.00 H new ATOM 0 HB3 PHE A 78 2.450 10.394 2.958 1.00 0.00 H new ATOM 0 HD1 PHE A 78 -0.083 8.477 4.692 1.00 0.00 H new ATOM 0 HD2 PHE A 78 2.269 8.654 1.142 1.00 0.00 H new ATOM 0 HE1 PHE A 78 -1.632 6.926 3.588 1.00 0.00 H new ATOM 0 HE2 PHE A 78 0.715 7.106 0.038 1.00 0.00 H new ATOM 0 HZ PHE A 78 -1.239 6.239 1.260 1.00 0.00 H new ATOM 578 N LEU A 79 5.146 9.571 5.796 1.00 0.00 N0 ATOM 579 CA LEU A 79 6.057 10.478 6.486 1.00 0.00 C0 ATOM 580 C LEU A 79 7.475 10.345 5.947 1.00 0.00 C0 ATOM 581 O LEU A 79 8.108 9.298 6.083 1.00 0.00 O0 ATOM 582 CB LEU A 79 6.048 10.193 7.993 1.00 0.00 C0 ATOM 583 CG LEU A 79 6.973 11.075 8.841 1.00 0.00 C0 ATOM 584 CD1 LEU A 79 6.509 12.522 8.762 1.00 0.00 C0 ATOM 585 CD2 LEU A 79 6.969 10.578 10.280 1.00 0.00 C0 ATOM 0 H LEU A 79 5.205 8.600 6.103 1.00 0.00 H new ATOM 0 HA LEU A 79 5.714 11.497 6.309 1.00 0.00 H new ATOM 0 HB2 LEU A 79 5.028 10.309 8.360 1.00 0.00 H new ATOM 0 HB3 LEU A 79 6.326 9.151 8.149 1.00 0.00 H new ATOM 0 HG LEU A 79 7.993 11.020 8.460 1.00 0.00 H new ATOM 0 HD11 LEU A 79 7.167 13.148 9.365 1.00 0.00 H new ATOM 0 HD12 LEU A 79 6.538 12.857 7.725 1.00 0.00 H new ATOM 0 HD13 LEU A 79 5.489 12.598 9.139 1.00 0.00 H new ATOM 0 HD21 LEU A 79 7.626 11.204 10.883 1.00 0.00 H new ATOM 0 HD22 LEU A 79 5.956 10.626 10.679 1.00 0.00 H new ATOM 0 HD23 LEU A 79 7.322 9.547 10.310 1.00 0.00 H new ATOM 597 N PRO A 80 7.972 11.414 5.335 1.00 0.00 N0 ATOM 598 CA PRO A 80 9.342 11.447 4.839 1.00 0.00 C0 ATOM 599 C PRO A 80 10.336 11.115 5.945 1.00 0.00 C0 ATOM 600 O PRO A 80 10.302 11.711 7.023 1.00 0.00 O0 ATOM 601 CB PRO A 80 9.500 12.892 4.353 1.00 0.00 C0 ATOM 602 CG PRO A 80 8.115 13.310 3.994 1.00 0.00 C0 ATOM 603 CD PRO A 80 7.248 12.675 5.049 1.00 0.00 C0 ATOM 0 HA PRO A 80 9.535 10.713 4.056 1.00 0.00 H new ATOM 0 HB2 PRO A 80 9.920 13.530 5.131 1.00 0.00 H new ATOM 0 HB3 PRO A 80 10.169 12.953 3.495 1.00 0.00 H new ATOM 0 HG2 PRO A 80 8.014 14.395 3.997 1.00 0.00 H new ATOM 0 HG3 PRO A 80 7.842 12.967 2.996 1.00 0.00 H new ATOM 0 HD2 PRO A 80 7.160 13.303 5.935 1.00 0.00 H new ATOM 0 HD3 PRO A 80 6.237 12.490 4.687 1.00 0.00 H new ATOM 611 N PRO A 81 11.220 10.160 5.673 1.00 0.00 N0 ATOM 612 CA PRO A 81 12.266 9.793 6.619 1.00 0.00 C0 ATOM 613 C PRO A 81 13.112 11.001 7.002 1.00 0.00 C0 ATOM 614 O PRO A 81 13.337 11.897 6.188 1.00 0.00 O0 ATOM 615 CB PRO A 81 13.081 8.753 5.844 1.00 0.00 C0 ATOM 616 CG PRO A 81 12.113 8.182 4.867 1.00 0.00 C0 ATOM 617 CD PRO A 81 11.264 9.355 4.452 1.00 0.00 C0 ATOM 0 HA PRO A 81 11.880 9.411 7.564 1.00 0.00 H new ATOM 0 HB2 PRO A 81 13.933 9.210 5.340 1.00 0.00 H new ATOM 0 HB3 PRO A 81 13.478 7.984 6.507 1.00 0.00 H new ATOM 0 HG2 PRO A 81 12.625 7.740 4.012 1.00 0.00 H new ATOM 0 HG3 PRO A 81 11.510 7.395 5.319 1.00 0.00 H new ATOM 0 HD2 PRO A 81 11.707 9.903 3.620 1.00 0.00 H new ATOM 0 HD3 PRO A 81 10.269 9.044 4.135 1.00 0.00 H new ATOM 625 N GLY A 82 13.581 11.019 8.246 1.00 0.00 N0 ATOM 626 CA GLY A 82 14.393 12.122 8.742 1.00 0.00 C0 ATOM 627 C GLY A 82 14.319 12.220 10.260 1.00 0.00 C0 ATOM 628 O GLY A 82 13.705 11.381 10.917 1.00 0.00 O0 ATOM 0 H GLY A 82 13.412 10.281 8.929 1.00 0.00 H new ATOM 0 HA2 GLY A 82 15.429 11.982 8.434 1.00 0.00 H new ATOM 0 HA3 GLY A 82 14.052 13.057 8.297 1.00 0.00 H new ATOM 632 N SER A 83 14.950 13.253 10.812 1.00 0.00 N0 ATOM 633 CA SER A 83 14.945 13.472 12.253 1.00 0.00 C0 ATOM 634 C SER A 83 13.710 14.252 12.685 1.00 0.00 C0 ATOM 635 O SER A 83 13.443 15.341 12.177 1.00 0.00 O0 ATOM 636 CB SER A 83 16.196 14.216 12.673 1.00 0.00 C0 ATOM 637 OG SER A 83 16.149 14.554 14.032 1.00 0.00 O0 ATOM 0 H SER A 83 15.471 13.951 10.282 1.00 0.00 H new ATOM 0 HA SER A 83 14.924 12.498 12.742 1.00 0.00 H new ATOM 0 HB2 SER A 83 17.073 13.598 12.479 1.00 0.00 H new ATOM 0 HB3 SER A 83 16.304 15.120 12.074 1.00 0.00 H new ATOM 0 HG SER A 83 16.968 15.032 14.279 1.00 0.00 H new ATOM 643 N TYR A 84 12.961 13.690 13.628 1.00 0.00 N0 ATOM 644 CA TYR A 84 11.793 14.364 14.183 1.00 0.00 C0 ATOM 645 C TYR A 84 11.822 14.351 15.706 1.00 0.00 C0 ATOM 646 O TYR A 84 12.259 13.378 16.320 1.00 0.00 O0 ATOM 647 CB TYR A 84 10.506 13.714 13.671 1.00 0.00 C0 ATOM 648 CG TYR A 84 10.323 13.819 12.173 1.00 0.00 C0 ATOM 649 CD1 TYR A 84 10.838 12.837 11.341 1.00 0.00 C0 ATOM 650 CD2 TYR A 84 9.640 14.897 11.632 1.00 0.00 C0 ATOM 651 CE1 TYR A 84 10.671 12.932 9.973 1.00 0.00 C0 ATOM 652 CE2 TYR A 84 9.474 14.994 10.263 1.00 0.00 C0 ATOM 653 CZ TYR A 84 9.987 14.015 9.436 1.00 0.00 C0 ATOM 654 OH TYR A 84 9.819 14.111 8.073 1.00 0.00 O0 ATOM 0 H TYR A 84 13.143 12.768 14.024 1.00 0.00 H new ATOM 0 HA TYR A 84 11.818 15.403 13.853 1.00 0.00 H new ATOM 0 HB2 TYR A 84 10.504 12.662 13.955 1.00 0.00 H new ATOM 0 HB3 TYR A 84 9.653 14.180 14.165 1.00 0.00 H new ATOM 0 HD1 TYR A 84 11.370 11.997 11.763 1.00 0.00 H new ATOM 0 HD2 TYR A 84 9.237 15.661 12.280 1.00 0.00 H new ATOM 0 HE1 TYR A 84 11.071 12.167 9.324 1.00 0.00 H new ATOM 0 HE2 TYR A 84 8.944 15.835 9.841 1.00 0.00 H new ATOM 0 HH TYR A 84 10.114 13.279 7.648 1.00 0.00 H new ATOM 664 N THR A 85 11.353 15.439 16.310 1.00 0.00 N0 ATOM 665 CA THR A 85 11.323 15.553 17.764 1.00 0.00 C0 ATOM 666 C THR A 85 9.944 15.219 18.314 1.00 0.00 C0 ATOM 667 O THR A 85 8.987 15.969 18.118 1.00 0.00 O0 ATOM 668 CB THR A 85 11.732 16.968 18.215 1.00 0.00 C0 ATOM 669 OG1 THR A 85 13.064 17.249 17.768 1.00 0.00 O0 ATOM 670 CG2 THR A 85 11.677 17.079 19.732 1.00 0.00 C0 ATOM 0 H THR A 85 10.989 16.253 15.815 1.00 0.00 H new ATOM 0 HA THR A 85 12.041 14.835 18.160 1.00 0.00 H new ATOM 0 HB THR A 85 11.037 17.687 17.781 1.00 0.00 H new ATOM 0 HG1 THR A 85 13.322 18.150 18.054 1.00 0.00 H new ATOM 0 HG21 THR A 85 11.969 18.085 20.034 1.00 0.00 H new ATOM 0 HG22 THR A 85 10.662 16.877 20.075 1.00 0.00 H new ATOM 0 HG23 THR A 85 12.360 16.355 20.175 1.00 0.00 H new ATOM 678 N ALA A 86 9.846 14.089 19.005 1.00 0.00 N0 ATOM 679 CA ALA A 86 8.592 13.675 19.625 1.00 0.00 C0 ATOM 680 C ALA A 86 8.307 14.483 20.885 1.00 0.00 C0 ATOM 681 O ALA A 86 9.229 14.945 21.559 1.00 0.00 O0 ATOM 682 CB ALA A 86 8.626 12.188 19.948 1.00 0.00 C0 ATOM 0 H ALA A 86 10.621 13.442 19.150 1.00 0.00 H new ATOM 0 HA ALA A 86 7.788 13.864 18.914 1.00 0.00 H new ATOM 0 HB1 ALA A 86 7.683 11.894 20.410 1.00 0.00 H new ATOM 0 HB2 ALA A 86 8.773 11.619 19.030 1.00 0.00 H new ATOM 0 HB3 ALA A 86 9.446 11.984 20.636 1.00 0.00 H new ATOM 688 N GLN A 87 7.028 14.652 21.198 1.00 0.00 N0 ATOM 689 CA GLN A 87 6.620 15.417 22.370 1.00 0.00 C0 ATOM 690 C GLN A 87 5.529 14.693 23.148 1.00 0.00 C0 ATOM 691 O GLN A 87 4.432 14.470 22.636 1.00 0.00 O0 ATOM 692 CB GLN A 87 6.132 16.809 21.957 1.00 0.00 C0 ATOM 693 CG GLN A 87 5.702 17.687 23.119 1.00 0.00 C0 ATOM 694 CD GLN A 87 6.865 18.076 24.012 1.00 0.00 C0 ATOM 695 OE1 GLN A 87 7.860 18.639 23.547 1.00 0.00 O0 ATOM 696 NE2 GLN A 87 6.746 17.778 25.300 1.00 0.00 N0 ATOM 0 H GLN A 87 6.254 14.269 20.655 1.00 0.00 H new ATOM 0 HA GLN A 87 7.490 15.522 23.018 1.00 0.00 H new ATOM 0 HB2 GLN A 87 6.928 17.314 21.410 1.00 0.00 H new ATOM 0 HB3 GLN A 87 5.293 16.699 21.270 1.00 0.00 H new ATOM 0 HG2 GLN A 87 5.227 18.589 22.733 1.00 0.00 H new ATOM 0 HG3 GLN A 87 4.953 17.160 23.711 1.00 0.00 H new ATOM 0 HE21 GLN A 87 5.905 17.312 25.640 1.00 0.00 H new ATOM 0 HE22 GLN A 87 7.496 18.015 25.950 1.00 0.00 H new ATOM 705 N VAL A 88 5.838 14.329 24.388 1.00 0.00 N0 ATOM 706 CA VAL A 88 4.843 13.757 25.288 1.00 0.00 C0 ATOM 707 C VAL A 88 4.804 14.506 26.613 1.00 0.00 C0 ATOM 708 O VAL A 88 5.705 14.373 27.439 1.00 0.00 O0 ATOM 709 CB VAL A 88 5.151 12.271 25.552 1.00 0.00 C0 ATOM 710 CG1 VAL A 88 4.114 11.669 26.488 1.00 0.00 C0 ATOM 711 CG2 VAL A 88 5.197 11.511 24.235 1.00 0.00 C0 ATOM 0 H VAL A 88 6.770 14.420 24.793 1.00 0.00 H new ATOM 0 HA VAL A 88 3.870 13.849 24.806 1.00 0.00 H new ATOM 0 HB VAL A 88 6.125 12.192 26.035 1.00 0.00 H new ATOM 0 HG11 VAL A 88 4.348 10.619 26.663 1.00 0.00 H new ATOM 0 HG12 VAL A 88 4.125 12.206 27.436 1.00 0.00 H new ATOM 0 HG13 VAL A 88 3.125 11.750 26.036 1.00 0.00 H new ATOM 0 HG21 VAL A 88 5.415 10.461 24.428 1.00 0.00 H new ATOM 0 HG22 VAL A 88 4.233 11.595 23.733 1.00 0.00 H new ATOM 0 HG23 VAL A 88 5.976 11.932 23.599 1.00 0.00 H new ATOM 721 N GLY A 89 3.753 15.297 26.810 1.00 0.00 N0 ATOM 722 CA GLY A 89 3.606 16.088 28.026 1.00 0.00 C0 ATOM 723 C GLY A 89 4.673 17.171 28.111 1.00 0.00 C0 ATOM 724 O GLY A 89 4.654 18.136 27.348 1.00 0.00 O0 ATOM 0 H GLY A 89 2.990 15.407 26.142 1.00 0.00 H new ATOM 0 HA2 GLY A 89 2.617 16.546 28.048 1.00 0.00 H new ATOM 0 HA3 GLY A 89 3.675 15.437 28.897 1.00 0.00 H new ATOM 728 N GLN A 90 5.604 17.005 29.045 1.00 0.00 N0 ATOM 729 CA GLN A 90 6.692 17.961 29.220 1.00 0.00 C0 ATOM 730 C GLN A 90 8.040 17.323 28.913 1.00 0.00 C0 ATOM 731 O GLN A 90 9.086 17.837 29.306 1.00 0.00 O0 ATOM 732 CB GLN A 90 6.691 18.516 30.646 1.00 0.00 C0 ATOM 733 CG GLN A 90 5.431 19.279 31.017 1.00 0.00 C0 ATOM 734 CD GLN A 90 5.242 20.529 30.176 1.00 0.00 C0 ATOM 735 OE1 GLN A 90 6.175 21.313 29.987 1.00 0.00 O0 ATOM 736 NE2 GLN A 90 4.029 20.721 29.667 1.00 0.00 N0 ATOM 0 H GLN A 90 5.627 16.217 29.693 1.00 0.00 H new ATOM 0 HA GLN A 90 6.532 18.779 28.518 1.00 0.00 H new ATOM 0 HB2 GLN A 90 6.821 17.690 31.345 1.00 0.00 H new ATOM 0 HB3 GLN A 90 7.550 19.175 30.768 1.00 0.00 H new ATOM 0 HG2 GLN A 90 4.566 18.628 30.894 1.00 0.00 H new ATOM 0 HG3 GLN A 90 5.474 19.556 32.070 1.00 0.00 H new ATOM 0 HE21 GLN A 90 3.287 20.046 29.849 1.00 0.00 H new ATOM 0 HE22 GLN A 90 3.841 21.544 29.094 1.00 0.00 H new ATOM 745 N GLN A 91 8.009 16.198 28.204 1.00 0.00 N0 ATOM 746 CA GLN A 91 9.230 15.481 27.850 1.00 0.00 C0 ATOM 747 C GLN A 91 9.301 15.225 26.351 1.00 0.00 C0 ATOM 748 O GLN A 91 8.461 14.520 25.791 1.00 0.00 O0 ATOM 749 CB GLN A 91 9.311 14.156 28.612 1.00 0.00 C0 ATOM 750 CG GLN A 91 10.521 13.309 28.258 1.00 0.00 C0 ATOM 751 CD GLN A 91 11.822 13.931 28.725 1.00 0.00 C0 ATOM 752 OE1 GLN A 91 12.048 14.100 29.927 1.00 0.00 O0 ATOM 753 NE2 GLN A 91 12.686 14.277 27.780 1.00 0.00 N0 ATOM 0 H GLN A 91 7.151 15.763 27.863 1.00 0.00 H new ATOM 0 HA GLN A 91 10.078 16.105 28.131 1.00 0.00 H new ATOM 0 HB2 GLN A 91 9.328 14.365 29.682 1.00 0.00 H new ATOM 0 HB3 GLN A 91 8.407 13.580 28.414 1.00 0.00 H new ATOM 0 HG2 GLN A 91 10.413 12.321 28.706 1.00 0.00 H new ATOM 0 HG3 GLN A 91 10.557 13.167 27.178 1.00 0.00 H new ATOM 0 HE21 GLN A 91 12.458 14.119 26.798 1.00 0.00 H new ATOM 0 HE22 GLN A 91 13.578 14.701 28.035 1.00 0.00 H new ATOM 762 N SER A 92 10.309 15.801 25.705 1.00 0.00 N0 ATOM 763 CA SER A 92 10.536 15.578 24.283 1.00 0.00 C0 ATOM 764 C SER A 92 11.452 14.385 24.050 1.00 0.00 C0 ATOM 765 O SER A 92 12.244 14.019 24.920 1.00 0.00 O0 ATOM 766 CB SER A 92 11.135 16.818 23.648 1.00 0.00 C0 ATOM 767 OG SER A 92 12.422 17.064 24.146 1.00 0.00 O0 ATOM 0 H SER A 92 10.983 16.427 26.145 1.00 0.00 H new ATOM 0 HA SER A 92 9.573 15.364 23.820 1.00 0.00 H new ATOM 0 HB2 SER A 92 11.177 16.693 22.566 1.00 0.00 H new ATOM 0 HB3 SER A 92 10.494 17.678 23.845 1.00 0.00 H new ATOM 0 HG SER A 92 12.789 17.867 23.721 1.00 0.00 H new ATOM 773 N LEU A 93 11.341 13.780 22.873 1.00 0.00 N0 ATOM 774 CA LEU A 93 12.156 12.621 22.527 1.00 0.00 C0 ATOM 775 C LEU A 93 12.596 12.674 21.069 1.00 0.00 C0 ATOM 776 O LEU A 93 11.955 12.091 20.195 1.00 0.00 O0 ATOM 777 CB LEU A 93 11.374 11.328 22.784 1.00 0.00 C0 ATOM 778 CG LEU A 93 11.041 11.033 24.252 1.00 0.00 C0 ATOM 779 CD1 LEU A 93 10.108 9.832 24.331 1.00 0.00 C0 ATOM 780 CD2 LEU A 93 12.327 10.777 25.023 1.00 0.00 C0 ATOM 0 H LEU A 93 10.694 14.073 22.141 1.00 0.00 H new ATOM 0 HA LEU A 93 13.046 12.637 23.156 1.00 0.00 H new ATOM 0 HB2 LEU A 93 10.442 11.371 22.221 1.00 0.00 H new ATOM 0 HB3 LEU A 93 11.949 10.492 22.386 1.00 0.00 H new ATOM 0 HG LEU A 93 10.537 11.890 24.698 1.00 0.00 H new ATOM 0 HD11 LEU A 93 9.872 9.623 25.374 1.00 0.00 H new ATOM 0 HD12 LEU A 93 9.189 10.049 23.787 1.00 0.00 H new ATOM 0 HD13 LEU A 93 10.595 8.963 23.888 1.00 0.00 H new ATOM 0 HD21 LEU A 93 12.090 10.567 26.066 1.00 0.00 H new ATOM 0 HD22 LEU A 93 12.847 9.922 24.590 1.00 0.00 H new ATOM 0 HD23 LEU A 93 12.967 11.658 24.966 1.00 0.00 H new ATOM 792 N PRO A 94 13.695 13.376 20.813 1.00 0.00 N0 ATOM 793 CA PRO A 94 14.287 13.413 19.481 1.00 0.00 C0 ATOM 794 C PRO A 94 14.584 12.008 18.971 1.00 0.00 C0 ATOM 795 O PRO A 94 15.214 11.207 19.663 1.00 0.00 O0 ATOM 796 CB PRO A 94 15.573 14.217 19.699 1.00 0.00 C0 ATOM 797 CG PRO A 94 15.279 15.062 20.890 1.00 0.00 C0 ATOM 798 CD PRO A 94 14.459 14.172 21.786 1.00 0.00 C0 ATOM 0 HA PRO A 94 13.632 13.854 18.729 1.00 0.00 H new ATOM 0 HB2 PRO A 94 16.426 13.563 19.876 1.00 0.00 H new ATOM 0 HB3 PRO A 94 15.814 14.827 18.828 1.00 0.00 H new ATOM 0 HG2 PRO A 94 16.195 15.387 21.383 1.00 0.00 H new ATOM 0 HG3 PRO A 94 14.730 15.962 20.613 1.00 0.00 H new ATOM 0 HD2 PRO A 94 15.085 13.547 22.423 1.00 0.00 H new ATOM 0 HD3 PRO A 94 13.807 14.746 22.445 1.00 0.00 H new ATOM 806 N VAL A 95 14.129 11.714 17.760 1.00 0.00 N0 ATOM 807 CA VAL A 95 14.305 10.392 17.172 1.00 0.00 C0 ATOM 808 C VAL A 95 14.481 10.479 15.662 1.00 0.00 C0 ATOM 809 O VAL A 95 13.754 11.204 14.982 1.00 0.00 O0 ATOM 810 CB VAL A 95 13.092 9.499 17.494 1.00 0.00 C0 ATOM 811 CG1 VAL A 95 11.818 10.106 16.927 1.00 0.00 C0 ATOM 812 CG2 VAL A 95 13.317 8.100 16.940 1.00 0.00 C0 ATOM 0 H VAL A 95 13.633 12.376 17.163 1.00 0.00 H new ATOM 0 HA VAL A 95 15.206 9.955 17.603 1.00 0.00 H new ATOM 0 HB VAL A 95 12.980 9.431 18.576 1.00 0.00 H new ATOM 0 HG11 VAL A 95 10.971 9.462 17.164 1.00 0.00 H new ATOM 0 HG12 VAL A 95 11.658 11.091 17.365 1.00 0.00 H new ATOM 0 HG13 VAL A 95 11.910 10.201 15.845 1.00 0.00 H new ATOM 0 HG21 VAL A 95 12.455 7.474 17.171 1.00 0.00 H new ATOM 0 HG22 VAL A 95 13.447 8.153 15.859 1.00 0.00 H new ATOM 0 HG23 VAL A 95 14.210 7.669 17.392 1.00 0.00 H new ATOM 822 N LYS A 96 15.450 9.734 15.140 1.00 0.00 N0 ATOM 823 CA LYS A 96 15.630 9.609 13.698 1.00 0.00 C0 ATOM 824 C LYS A 96 14.765 8.491 13.130 1.00 0.00 C0 ATOM 825 O LYS A 96 14.854 7.343 13.565 1.00 0.00 O0 ATOM 826 CB LYS A 96 17.101 9.360 13.363 1.00 0.00 C0 ATOM 827 CG LYS A 96 17.399 9.274 11.870 1.00 0.00 C0 ATOM 828 CD LYS A 96 18.883 9.059 11.616 1.00 0.00 C0 ATOM 829 CE LYS A 96 19.178 8.935 10.127 1.00 0.00 C0 ATOM 830 NZ LYS A 96 20.623 8.702 9.865 1.00 0.00 N0 ATOM 0 H LYS A 96 16.124 9.207 15.695 1.00 0.00 H new ATOM 0 HA LYS A 96 15.317 10.547 13.239 1.00 0.00 H new ATOM 0 HB2 LYS A 96 17.701 10.161 13.796 1.00 0.00 H new ATOM 0 HB3 LYS A 96 17.418 8.432 13.839 1.00 0.00 H new ATOM 0 HG2 LYS A 96 16.830 8.455 11.430 1.00 0.00 H new ATOM 0 HG3 LYS A 96 17.072 10.190 11.378 1.00 0.00 H new ATOM 0 HD2 LYS A 96 19.450 9.892 12.033 1.00 0.00 H new ATOM 0 HD3 LYS A 96 19.215 8.158 12.131 1.00 0.00 H new ATOM 0 HE2 LYS A 96 18.596 8.113 9.709 1.00 0.00 H new ATOM 0 HE3 LYS A 96 18.859 9.844 9.617 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 20.782 8.623 8.840 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 21.177 9.498 10.241 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 20.923 7.821 10.330 1.00 0.00 H new ATOM 844 N LEU A 97 13.928 8.833 12.158 1.00 0.00 N0 ATOM 845 CA LEU A 97 13.019 7.866 11.555 1.00 0.00 C0 ATOM 846 C LEU A 97 13.559 7.354 10.227 1.00 0.00 C0 ATOM 847 O LEU A 97 13.489 8.044 9.209 1.00 0.00 O0 ATOM 848 CB LEU A 97 11.638 8.501 11.342 1.00 0.00 C0 ATOM 849 CG LEU A 97 11.008 9.158 12.578 1.00 0.00 C0 ATOM 850 CD1 LEU A 97 9.616 9.667 12.229 1.00 0.00 C0 ATOM 851 CD2 LEU A 97 10.955 8.150 13.715 1.00 0.00 C0 ATOM 0 H LEU A 97 13.860 9.774 11.770 1.00 0.00 H new ATOM 0 HA LEU A 97 12.929 7.020 12.237 1.00 0.00 H new ATOM 0 HB2 LEU A 97 11.722 9.253 10.557 1.00 0.00 H new ATOM 0 HB3 LEU A 97 10.958 7.732 10.976 1.00 0.00 H new ATOM 0 HG LEU A 97 11.612 10.007 12.899 1.00 0.00 H new ATOM 0 HD11 LEU A 97 9.169 10.134 13.107 1.00 0.00 H new ATOM 0 HD12 LEU A 97 9.687 10.400 11.425 1.00 0.00 H new ATOM 0 HD13 LEU A 97 8.994 8.833 11.905 1.00 0.00 H new ATOM 0 HD21 LEU A 97 10.508 8.615 14.593 1.00 0.00 H new ATOM 0 HD22 LEU A 97 10.354 7.292 13.413 1.00 0.00 H new ATOM 0 HD23 LEU A 97 11.965 7.819 13.955 1.00 0.00 H new ATOM 863 N ASP A 98 14.098 6.140 10.243 1.00 0.00 N0 ATOM 864 CA ASP A 98 14.672 5.542 9.043 1.00 0.00 C0 ATOM 865 C ASP A 98 13.584 5.102 8.073 1.00 0.00 C0 ATOM 866 O ASP A 98 12.449 4.844 8.473 1.00 0.00 O0 ATOM 867 CB ASP A 98 15.550 4.343 9.410 1.00 0.00 C0 ATOM 868 CG ASP A 98 16.859 4.749 10.076 1.00 0.00 C0 ATOM 869 OD1 ASP A 98 17.215 5.900 9.988 1.00 0.00 O0 ATOM 870 OD2 ASP A 98 17.489 3.904 10.665 1.00 0.00 O0 ATOM 0 H ASP A 98 14.150 5.550 11.074 1.00 0.00 H new ATOM 0 HA ASP A 98 15.284 6.301 8.556 1.00 0.00 H new ATOM 0 HB2 ASP A 98 14.996 3.685 10.080 1.00 0.00 H new ATOM 0 HB3 ASP A 98 15.769 3.770 8.509 1.00 0.00 H new ATOM 875 N PRO A 99 13.936 5.019 6.794 1.00 0.00 N0 ATOM 876 CA PRO A 99 12.997 4.590 5.766 1.00 0.00 C0 ATOM 877 C PRO A 99 12.678 3.106 5.896 1.00 0.00 C0 ATOM 878 O PRO A 99 13.510 2.319 6.346 1.00 0.00 O0 ATOM 879 CB PRO A 99 13.747 4.896 4.464 1.00 0.00 C0 ATOM 880 CG PRO A 99 15.185 4.804 4.841 1.00 0.00 C0 ATOM 881 CD PRO A 99 15.247 5.384 6.230 1.00 0.00 C0 ATOM 0 HA PRO A 99 12.031 5.092 5.827 1.00 0.00 H new ATOM 0 HB2 PRO A 99 13.494 4.181 3.681 1.00 0.00 H new ATOM 0 HB3 PRO A 99 13.497 5.887 4.084 1.00 0.00 H new ATOM 0 HG2 PRO A 99 15.534 3.772 4.826 1.00 0.00 H new ATOM 0 HG3 PRO A 99 15.814 5.364 4.148 1.00 0.00 H new ATOM 0 HD2 PRO A 99 16.068 4.961 6.809 1.00 0.00 H new ATOM 0 HD3 PRO A 99 15.393 6.464 6.211 1.00 0.00 H new ATOM 889 N ASP A 100 11.467 2.729 5.496 1.00 0.00 N0 ATOM 890 CA ASP A 100 11.039 1.337 5.557 1.00 0.00 C0 ATOM 891 C ASP A 100 11.193 0.776 6.966 1.00 0.00 C0 ATOM 892 O ASP A 100 11.689 -0.333 7.152 1.00 0.00 O0 ATOM 893 CB ASP A 100 11.841 0.483 4.573 1.00 0.00 C0 ATOM 894 CG ASP A 100 11.575 0.851 3.118 1.00 0.00 C0 ATOM 895 OD1 ASP A 100 10.453 1.167 2.801 1.00 0.00 O0 ATOM 896 OD2 ASP A 100 12.496 0.808 2.339 1.00 0.00 O0 ATOM 0 H ASP A 100 10.765 3.370 5.126 1.00 0.00 H new ATOM 0 HA ASP A 100 9.985 1.304 5.282 1.00 0.00 H new ATOM 0 HB2 ASP A 100 12.904 0.597 4.783 1.00 0.00 H new ATOM 0 HB3 ASP A 100 11.596 -0.568 4.728 1.00 0.00 H new ATOM 901 N SER A 101 10.762 1.551 7.957 1.00 0.00 N0 ATOM 902 CA SER A 101 10.859 1.139 9.350 1.00 0.00 C0 ATOM 903 C SER A 101 9.758 1.771 10.191 1.00 0.00 C0 ATOM 904 O SER A 101 9.326 2.893 9.923 1.00 0.00 O0 ATOM 905 CB SER A 101 12.216 1.512 9.914 1.00 0.00 C0 ATOM 906 OG SER A 101 12.327 1.124 11.255 1.00 0.00 O0 ATOM 0 H SER A 101 10.341 2.470 7.819 1.00 0.00 H new ATOM 0 HA SER A 101 10.738 0.056 9.387 1.00 0.00 H new ATOM 0 HB2 SER A 101 13.001 1.035 9.328 1.00 0.00 H new ATOM 0 HB3 SER A 101 12.365 2.588 9.830 1.00 0.00 H new ATOM 0 HG SER A 101 11.743 0.355 11.422 1.00 0.00 H new ATOM 912 N TYR A 102 9.307 1.048 11.209 1.00 0.00 N0 ATOM 913 CA TYR A 102 8.197 1.500 12.038 1.00 0.00 C0 ATOM 914 C TYR A 102 8.684 1.964 13.406 1.00 0.00 C0 ATOM 915 O TYR A 102 9.577 1.360 13.995 1.00 0.00 O0 ATOM 916 CB TYR A 102 7.157 0.389 12.198 1.00 0.00 C0 ATOM 917 CG TYR A 102 6.423 0.053 10.918 1.00 0.00 C0 ATOM 918 CD1 TYR A 102 7.060 -0.671 9.921 1.00 0.00 C0 ATOM 919 CD2 TYR A 102 5.111 0.470 10.742 1.00 0.00 C0 ATOM 920 CE1 TYR A 102 6.388 -0.978 8.753 1.00 0.00 C0 ATOM 921 CE2 TYR A 102 4.440 0.165 9.573 1.00 0.00 C0 ATOM 922 CZ TYR A 102 5.074 -0.557 8.582 1.00 0.00 C0 ATOM 923 OH TYR A 102 4.406 -0.861 7.418 1.00 0.00 O0 ATOM 0 H TYR A 102 9.694 0.144 11.480 1.00 0.00 H new ATOM 0 HA TYR A 102 7.732 2.348 11.536 1.00 0.00 H new ATOM 0 HB2 TYR A 102 7.652 -0.509 12.569 1.00 0.00 H new ATOM 0 HB3 TYR A 102 6.432 0.689 12.954 1.00 0.00 H new ATOM 0 HD1 TYR A 102 8.081 -0.995 10.057 1.00 0.00 H new ATOM 0 HD2 TYR A 102 4.614 1.033 11.519 1.00 0.00 H new ATOM 0 HE1 TYR A 102 6.882 -1.543 7.976 1.00 0.00 H new ATOM 0 HE2 TYR A 102 3.420 0.491 9.435 1.00 0.00 H new ATOM 0 HH TYR A 102 3.498 -0.496 7.457 1.00 0.00 H new ATOM 933 N TYR A 103 8.091 3.043 13.903 1.00 0.00 N0 ATOM 934 CA TYR A 103 8.428 3.564 15.223 1.00 0.00 C0 ATOM 935 C TYR A 103 7.178 3.796 16.061 1.00 0.00 C0 ATOM 936 O TYR A 103 6.145 4.225 15.547 1.00 0.00 O0 ATOM 937 CB TYR A 103 9.231 4.861 15.098 1.00 0.00 C0 ATOM 938 CG TYR A 103 10.567 4.689 14.410 1.00 0.00 C0 ATOM 939 CD1 TYR A 103 10.636 4.665 13.025 1.00 0.00 C0 ATOM 940 CD2 TYR A 103 11.723 4.554 15.164 1.00 0.00 C0 ATOM 941 CE1 TYR A 103 11.857 4.508 12.396 1.00 0.00 C0 ATOM 942 CE2 TYR A 103 12.943 4.397 14.536 1.00 0.00 C0 ATOM 943 CZ TYR A 103 13.012 4.373 13.159 1.00 0.00 C0 ATOM 944 OH TYR A 103 14.226 4.216 12.532 1.00 0.00 O0 ATOM 0 H TYR A 103 7.373 3.575 13.411 1.00 0.00 H new ATOM 0 HA TYR A 103 9.040 2.818 15.730 1.00 0.00 H new ATOM 0 HB2 TYR A 103 8.640 5.591 14.545 1.00 0.00 H new ATOM 0 HB3 TYR A 103 9.396 5.272 16.094 1.00 0.00 H new ATOM 0 HD1 TYR A 103 9.736 4.769 12.438 1.00 0.00 H new ATOM 0 HD2 TYR A 103 11.669 4.572 16.243 1.00 0.00 H new ATOM 0 HE1 TYR A 103 11.914 4.490 11.318 1.00 0.00 H new ATOM 0 HE2 TYR A 103 13.843 4.293 15.124 1.00 0.00 H new ATOM 0 HH TYR A 103 14.934 4.137 13.205 1.00 0.00 H new ATOM 954 N THR A 104 7.276 3.508 17.355 1.00 0.00 N0 ATOM 955 CA THR A 104 6.158 3.699 18.269 1.00 0.00 C0 ATOM 956 C THR A 104 6.518 4.669 19.388 1.00 0.00 C0 ATOM 957 O THR A 104 7.519 4.488 20.080 1.00 0.00 O0 ATOM 958 CB THR A 104 5.703 2.357 18.875 1.00 0.00 C0 ATOM 959 OG1 THR A 104 5.299 1.469 17.826 1.00 0.00 O0 ATOM 960 CG2 THR A 104 4.540 2.571 19.832 1.00 0.00 C0 ATOM 0 H THR A 104 8.120 3.141 17.794 1.00 0.00 H new ATOM 0 HA THR A 104 5.337 4.122 17.690 1.00 0.00 H new ATOM 0 HB THR A 104 6.537 1.922 19.426 1.00 0.00 H new ATOM 0 HG1 THR A 104 5.829 0.646 17.872 1.00 0.00 H new ATOM 0 HG21 THR A 104 4.232 1.613 20.250 1.00 0.00 H new ATOM 0 HG22 THR A 104 4.850 3.236 20.638 1.00 0.00 H new ATOM 0 HG23 THR A 104 3.704 3.018 19.294 1.00 0.00 H new ATOM 968 N LEU A 105 5.696 5.698 19.558 1.00 0.00 N0 ATOM 969 CA LEU A 105 5.880 6.654 20.644 1.00 0.00 C0 ATOM 970 C LEU A 105 5.040 6.278 21.857 1.00 0.00 C0 ATOM 971 O LEU A 105 3.844 6.565 21.909 1.00 0.00 O0 ATOM 972 CB LEU A 105 5.508 8.066 20.174 1.00 0.00 C0 ATOM 973 CG LEU A 105 5.642 9.174 21.228 1.00 0.00 C0 ATOM 974 CD1 LEU A 105 7.090 9.263 21.688 1.00 0.00 C0 ATOM 975 CD2 LEU A 105 5.173 10.495 20.638 1.00 0.00 C0 ATOM 0 H LEU A 105 4.895 5.892 18.957 1.00 0.00 H new ATOM 0 HA LEU A 105 6.930 6.633 20.934 1.00 0.00 H new ATOM 0 HB2 LEU A 105 6.137 8.323 19.321 1.00 0.00 H new ATOM 0 HB3 LEU A 105 4.478 8.051 19.818 1.00 0.00 H new ATOM 0 HG LEU A 105 5.020 8.944 22.093 1.00 0.00 H new ATOM 0 HD11 LEU A 105 7.186 10.050 22.436 1.00 0.00 H new ATOM 0 HD12 LEU A 105 7.393 8.310 22.122 1.00 0.00 H new ATOM 0 HD13 LEU A 105 7.729 9.493 20.836 1.00 0.00 H new ATOM 0 HD21 LEU A 105 5.268 11.282 21.386 1.00 0.00 H new ATOM 0 HD22 LEU A 105 5.784 10.743 19.770 1.00 0.00 H new ATOM 0 HD23 LEU A 105 4.130 10.408 20.334 1.00 0.00 H new ATOM 987 N VAL A 106 5.672 5.635 22.832 1.00 0.00 N0 ATOM 988 CA VAL A 106 4.978 5.184 24.033 1.00 0.00 C0 ATOM 989 C VAL A 106 4.754 6.337 25.003 1.00 0.00 C0 ATOM 990 O VAL A 106 5.687 6.799 25.659 1.00 0.00 O0 ATOM 991 CB VAL A 106 5.784 4.077 24.735 1.00 0.00 C0 ATOM 992 CG1 VAL A 106 5.094 3.650 26.022 1.00 0.00 C0 ATOM 993 CG2 VAL A 106 5.957 2.891 23.797 1.00 0.00 C0 ATOM 0 H VAL A 106 6.668 5.414 22.814 1.00 0.00 H new ATOM 0 HA VAL A 106 4.009 4.790 23.727 1.00 0.00 H new ATOM 0 HB VAL A 106 6.769 4.465 24.993 1.00 0.00 H new ATOM 0 HG11 VAL A 106 5.678 2.867 26.505 1.00 0.00 H new ATOM 0 HG12 VAL A 106 5.011 4.506 26.692 1.00 0.00 H new ATOM 0 HG13 VAL A 106 4.098 3.271 25.792 1.00 0.00 H new ATOM 0 HG21 VAL A 106 6.528 2.110 24.299 1.00 0.00 H new ATOM 0 HG22 VAL A 106 4.978 2.502 23.518 1.00 0.00 H new ATOM 0 HG23 VAL A 106 6.489 3.210 22.901 1.00 0.00 H new ATOM 1003 N SER A 107 3.510 6.798 25.090 1.00 0.00 N0 ATOM 1004 CA SER A 107 3.154 7.868 26.014 1.00 0.00 C0 ATOM 1005 C SER A 107 2.463 7.316 27.255 1.00 0.00 C0 ATOM 1006 O SER A 107 1.986 6.181 27.259 1.00 0.00 O0 ATOM 1007 CB SER A 107 2.248 8.871 25.325 1.00 0.00 C0 ATOM 1008 OG SER A 107 1.040 8.278 24.942 1.00 0.00 O0 ATOM 0 H SER A 107 2.732 6.447 24.532 1.00 0.00 H new ATOM 0 HA SER A 107 4.073 8.364 26.326 1.00 0.00 H new ATOM 0 HB2 SER A 107 2.050 9.707 25.995 1.00 0.00 H new ATOM 0 HB3 SER A 107 2.751 9.278 24.448 1.00 0.00 H new ATOM 0 HG SER A 107 1.145 7.304 24.923 1.00 0.00 H new ATOM 1014 N GLN A 108 2.411 8.128 28.307 1.00 0.00 N0 ATOM 1015 CA GLN A 108 1.781 7.720 29.557 1.00 0.00 C0 ATOM 1016 C GLN A 108 1.289 8.929 30.344 1.00 0.00 C0 ATOM 1017 O GLN A 108 2.011 9.912 30.505 1.00 0.00 O0 ATOM 1018 CB GLN A 108 2.756 6.904 30.409 1.00 0.00 C0 ATOM 1019 CG GLN A 108 2.166 6.391 31.712 1.00 0.00 C0 ATOM 1020 CD GLN A 108 3.141 5.529 32.490 1.00 0.00 C0 ATOM 1021 OE1 GLN A 108 4.356 5.611 32.294 1.00 0.00 O0 ATOM 1022 NE2 GLN A 108 2.613 4.693 33.378 1.00 0.00 N0 ATOM 0 H GLN A 108 2.798 9.072 28.318 1.00 0.00 H new ATOM 0 HA GLN A 108 0.921 7.098 29.308 1.00 0.00 H new ATOM 0 HB2 GLN A 108 3.109 6.055 29.824 1.00 0.00 H new ATOM 0 HB3 GLN A 108 3.627 7.520 30.635 1.00 0.00 H new ATOM 0 HG2 GLN A 108 1.862 7.237 32.328 1.00 0.00 H new ATOM 0 HG3 GLN A 108 1.266 5.814 31.498 1.00 0.00 H new ATOM 0 HE21 GLN A 108 1.602 4.658 33.507 1.00 0.00 H new ATOM 0 HE22 GLN A 108 3.219 4.086 33.930 1.00 0.00 H new ATOM 1031 N PRO A 109 0.056 8.849 30.832 1.00 0.00 N0 ATOM 1032 CA PRO A 109 -0.528 9.928 31.621 1.00 0.00 C0 ATOM 1033 C PRO A 109 0.322 10.233 32.848 1.00 0.00 C0 ATOM 1034 O PRO A 109 0.274 9.512 33.843 1.00 0.00 O0 ATOM 1035 CB PRO A 109 -1.900 9.366 32.009 1.00 0.00 C0 ATOM 1036 CG PRO A 109 -2.215 8.390 30.930 1.00 0.00 C0 ATOM 1037 CD PRO A 109 -0.892 7.742 30.612 1.00 0.00 C0 ATOM 0 HA PRO A 109 -0.594 10.873 31.081 1.00 0.00 H new ATOM 0 HB2 PRO A 109 -1.871 8.883 32.986 1.00 0.00 H new ATOM 0 HB3 PRO A 109 -2.651 10.154 32.065 1.00 0.00 H new ATOM 0 HG2 PRO A 109 -2.948 7.655 31.261 1.00 0.00 H new ATOM 0 HG3 PRO A 109 -2.635 8.887 30.055 1.00 0.00 H new ATOM 0 HD2 PRO A 109 -0.686 6.894 31.265 1.00 0.00 H new ATOM 0 HD3 PRO A 109 -0.855 7.372 29.587 1.00 0.00 H new ATOM 1045 N GLY A 110 1.099 11.308 32.770 1.00 0.00 N0 ATOM 1046 CA GLY A 110 1.903 11.757 33.901 1.00 0.00 C0 ATOM 1047 C GLY A 110 3.075 10.817 34.152 1.00 0.00 C0 ATOM 1048 O GLY A 110 3.615 10.763 35.256 1.00 0.00 O0 ATOM 0 H GLY A 110 1.189 11.885 31.934 1.00 0.00 H new ATOM 0 HA2 GLY A 110 2.275 12.763 33.709 1.00 0.00 H new ATOM 0 HA3 GLY A 110 1.280 11.812 34.794 1.00 0.00 H new ATOM 1052 N GLY A 111 3.463 10.076 33.120 1.00 0.00 N0 ATOM 1053 CA GLY A 111 4.549 9.110 33.236 1.00 0.00 C0 ATOM 1054 C GLY A 111 5.701 9.461 32.304 1.00 0.00 C0 ATOM 1055 O GLY A 111 5.752 10.559 31.750 1.00 0.00 O0 ATOM 0 H GLY A 111 3.041 10.126 32.193 1.00 0.00 H new ATOM 0 HA2 GLY A 111 4.906 9.083 34.265 1.00 0.00 H new ATOM 0 HA3 GLY A 111 4.178 8.112 33.000 1.00 0.00 H new ATOM 1059 N LYS A 112 6.626 8.522 32.138 1.00 0.00 N0 ATOM 1060 CA LYS A 112 7.784 8.732 31.275 1.00 0.00 C0 ATOM 1061 C LYS A 112 7.591 8.064 29.920 1.00 0.00 C0 ATOM 1062 O LYS A 112 7.336 6.863 29.840 1.00 0.00 O0 ATOM 1063 CB LYS A 112 9.054 8.206 31.946 1.00 0.00 C0 ATOM 1064 CG LYS A 112 10.329 8.427 31.140 1.00 0.00 C0 ATOM 1065 CD LYS A 112 11.550 7.910 31.886 1.00 0.00 C0 ATOM 1066 CE LYS A 112 12.821 8.114 31.076 1.00 0.00 C0 ATOM 1067 NZ LYS A 112 14.025 7.614 31.794 1.00 0.00 N0 ATOM 0 H LYS A 112 6.597 7.608 32.589 1.00 0.00 H new ATOM 0 HA LYS A 112 7.888 9.805 31.113 1.00 0.00 H new ATOM 0 HB2 LYS A 112 9.164 8.689 32.917 1.00 0.00 H new ATOM 0 HB3 LYS A 112 8.937 7.138 32.132 1.00 0.00 H new ATOM 0 HG2 LYS A 112 10.246 7.921 30.178 1.00 0.00 H new ATOM 0 HG3 LYS A 112 10.450 9.490 30.931 1.00 0.00 H new ATOM 0 HD2 LYS A 112 11.639 8.425 32.842 1.00 0.00 H new ATOM 0 HD3 LYS A 112 11.423 6.850 32.106 1.00 0.00 H new ATOM 0 HE2 LYS A 112 12.729 7.598 30.120 1.00 0.00 H new ATOM 0 HE3 LYS A 112 12.944 9.174 30.856 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 14.869 7.772 31.208 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 14.129 8.123 32.695 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 13.920 6.597 31.982 1.00 0.00 H new ATOM 1081 N PRO A 113 7.713 8.851 28.856 1.00 0.00 N0 ATOM 1082 CA PRO A 113 7.543 8.337 27.501 1.00 0.00 C0 ATOM 1083 C PRO A 113 8.757 7.530 27.060 1.00 0.00 C0 ATOM 1084 O PRO A 113 9.852 7.693 27.599 1.00 0.00 O0 ATOM 1085 CB PRO A 113 7.380 9.613 26.668 1.00 0.00 C0 ATOM 1086 CG PRO A 113 8.176 10.635 27.405 1.00 0.00 C0 ATOM 1087 CD PRO A 113 7.942 10.317 28.858 1.00 0.00 C0 ATOM 0 HA PRO A 113 6.700 7.653 27.401 1.00 0.00 H new ATOM 0 HB2 PRO A 113 7.751 9.476 25.652 1.00 0.00 H new ATOM 0 HB3 PRO A 113 6.333 9.905 26.588 1.00 0.00 H new ATOM 0 HG2 PRO A 113 9.234 10.574 27.150 1.00 0.00 H new ATOM 0 HG3 PRO A 113 7.848 11.645 27.162 1.00 0.00 H new ATOM 0 HD2 PRO A 113 8.800 10.589 29.472 1.00 0.00 H new ATOM 0 HD3 PRO A 113 7.082 10.858 29.254 1.00 0.00 H new ATOM 1095 N GLN A 114 8.556 6.659 26.079 1.00 0.00 N0 ATOM 1096 CA GLN A 114 9.613 5.762 25.621 1.00 0.00 C0 ATOM 1097 C GLN A 114 9.577 5.596 24.107 1.00 0.00 C0 ATOM 1098 O GLN A 114 8.537 5.270 23.533 1.00 0.00 O0 ATOM 1099 CB GLN A 114 9.490 4.397 26.300 1.00 0.00 C0 ATOM 1100 CG GLN A 114 10.493 3.366 25.813 1.00 0.00 C0 ATOM 1101 CD GLN A 114 11.913 3.699 26.228 1.00 0.00 C0 ATOM 1102 OE1 GLN A 114 12.205 3.863 27.416 1.00 0.00 O0 ATOM 1103 NE2 GLN A 114 12.805 3.805 25.250 1.00 0.00 N0 ATOM 0 H GLN A 114 7.670 6.554 25.584 1.00 0.00 H new ATOM 0 HA GLN A 114 10.569 6.209 25.894 1.00 0.00 H new ATOM 0 HB2 GLN A 114 9.612 4.526 27.375 1.00 0.00 H new ATOM 0 HB3 GLN A 114 8.483 4.013 26.138 1.00 0.00 H new ATOM 0 HG2 GLN A 114 10.223 2.386 26.207 1.00 0.00 H new ATOM 0 HG3 GLN A 114 10.441 3.298 24.726 1.00 0.00 H new ATOM 0 HE21 GLN A 114 12.519 3.661 24.281 1.00 0.00 H new ATOM 0 HE22 GLN A 114 13.776 4.030 25.467 1.00 0.00 H new ATOM 1112 N LEU A 115 10.716 5.824 23.465 1.00 0.00 N0 ATOM 1113 CA LEU A 115 10.863 5.544 22.041 1.00 0.00 C0 ATOM 1114 C LEU A 115 11.017 4.049 21.786 1.00 0.00 C0 ATOM 1115 O LEU A 115 11.785 3.370 22.467 1.00 0.00 O0 ATOM 1116 CB LEU A 115 12.076 6.294 21.476 1.00 0.00 C0 ATOM 1117 CG LEU A 115 11.990 7.824 21.515 1.00 0.00 C0 ATOM 1118 CD1 LEU A 115 13.324 8.419 21.082 1.00 0.00 C0 ATOM 1119 CD2 LEU A 115 10.863 8.293 20.606 1.00 0.00 C0 ATOM 0 H LEU A 115 11.553 6.203 23.908 1.00 0.00 H new ATOM 0 HA LEU A 115 9.959 5.887 21.537 1.00 0.00 H new ATOM 0 HB2 LEU A 115 12.962 5.984 22.030 1.00 0.00 H new ATOM 0 HB3 LEU A 115 12.222 5.983 20.442 1.00 0.00 H new ATOM 0 HG LEU A 115 11.776 8.159 22.530 1.00 0.00 H new ATOM 0 HD11 LEU A 115 13.263 9.507 21.110 1.00 0.00 H new ATOM 0 HD12 LEU A 115 14.109 8.082 21.759 1.00 0.00 H new ATOM 0 HD13 LEU A 115 13.555 8.094 20.068 1.00 0.00 H new ATOM 0 HD21 LEU A 115 10.802 9.381 20.634 1.00 0.00 H new ATOM 0 HD22 LEU A 115 11.060 7.967 19.585 1.00 0.00 H new ATOM 0 HD23 LEU A 115 9.919 7.868 20.948 1.00 0.00 H new ATOM 1131 N VAL A 116 10.282 3.544 20.802 1.00 0.00 N0 ATOM 1132 CA VAL A 116 10.398 2.148 20.399 1.00 0.00 C0 ATOM 1133 C VAL A 116 10.616 2.024 18.897 1.00 0.00 C0 ATOM 1134 O VAL A 116 9.834 2.546 18.101 1.00 0.00 O0 ATOM 1135 CB VAL A 116 9.128 1.370 20.796 1.00 0.00 C0 ATOM 1136 CG1 VAL A 116 9.223 -0.075 20.331 1.00 0.00 C0 ATOM 1137 CG2 VAL A 116 8.928 1.442 22.302 1.00 0.00 C0 ATOM 0 H VAL A 116 9.599 4.081 20.268 1.00 0.00 H new ATOM 0 HA VAL A 116 11.262 1.726 20.913 1.00 0.00 H new ATOM 0 HB VAL A 116 8.266 1.825 20.308 1.00 0.00 H new ATOM 0 HG11 VAL A 116 8.318 -0.610 20.619 1.00 0.00 H new ATOM 0 HG12 VAL A 116 9.331 -0.102 19.247 1.00 0.00 H new ATOM 0 HG13 VAL A 116 10.088 -0.550 20.793 1.00 0.00 H new ATOM 0 HG21 VAL A 116 8.029 0.890 22.576 1.00 0.00 H new ATOM 0 HG22 VAL A 116 9.790 1.004 22.805 1.00 0.00 H new ATOM 0 HG23 VAL A 116 8.821 2.483 22.606 1.00 0.00 H new ATOM 1147 N ALA A 117 11.684 1.330 18.515 1.00 0.00 N0 ATOM 1148 CA ALA A 117 11.951 1.049 17.109 1.00 0.00 C0 ATOM 1149 C ALA A 117 11.462 -0.342 16.724 1.00 0.00 C0 ATOM 1150 O ALA A 117 11.675 -1.309 17.456 1.00 0.00 O0 ATOM 1151 CB ALA A 117 13.437 1.188 16.813 1.00 0.00 C0 ATOM 0 H ALA A 117 12.378 0.952 19.160 1.00 0.00 H new ATOM 0 HA ALA A 117 11.404 1.777 16.510 1.00 0.00 H new ATOM 0 HB1 ALA A 117 13.620 0.975 15.760 1.00 0.00 H new ATOM 0 HB2 ALA A 117 13.759 2.204 17.039 1.00 0.00 H new ATOM 0 HB3 ALA A 117 13.998 0.484 17.428 1.00 0.00 H new ATOM 1157 N GLU A 118 10.808 -0.436 15.571 1.00 0.00 N0 ATOM 1158 CA GLU A 118 10.257 -1.702 15.105 1.00 0.00 C0 ATOM 1159 C GLU A 118 10.691 -1.998 13.673 1.00 0.00 C0 ATOM 1160 O GLU A 118 10.923 -1.081 12.884 1.00 0.00 O0 ATOM 1161 CB GLU A 118 8.730 -1.684 15.190 1.00 0.00 C0 ATOM 1162 CG GLU A 118 8.183 -1.461 16.594 1.00 0.00 C0 ATOM 1163 CD GLU A 118 6.681 -1.499 16.648 1.00 0.00 C0 ATOM 1164 OE1 GLU A 118 6.082 -1.943 15.698 1.00 0.00 O0 ATOM 1165 OE2 GLU A 118 6.132 -1.082 17.641 1.00 0.00 O0 ATOM 0 H GLU A 118 10.647 0.351 14.942 1.00 0.00 H new ATOM 0 HA GLU A 118 10.642 -2.490 15.752 1.00 0.00 H new ATOM 0 HB2 GLU A 118 8.351 -0.899 14.536 1.00 0.00 H new ATOM 0 HB3 GLU A 118 8.345 -2.630 14.809 1.00 0.00 H new ATOM 0 HG2 GLU A 118 8.585 -2.224 17.261 1.00 0.00 H new ATOM 0 HG3 GLU A 118 8.531 -0.497 16.965 1.00 0.00 H new ATOM 1172 N PRO A 119 10.796 -3.282 13.346 1.00 0.00 N0 ATOM 1173 CA PRO A 119 11.160 -3.699 11.998 1.00 0.00 C0 ATOM 1174 C PRO A 119 10.246 -3.063 10.958 1.00 0.00 C0 ATOM 1175 O PRO A 119 10.435 -1.931 10.604 1.00 0.00 O0 ATOM 1176 CB PRO A 119 10.984 -5.220 12.048 1.00 0.00 C0 ATOM 1177 CG PRO A 119 11.236 -5.569 13.475 1.00 0.00 C0 ATOM 1178 CD PRO A 119 10.611 -4.441 14.253 1.00 0.00 C0 ATOM 0 HA PRO A 119 12.167 -3.397 11.711 1.00 0.00 H new ATOM 0 HB2 PRO A 119 9.982 -5.516 11.736 1.00 0.00 H new ATOM 0 HB3 PRO A 119 11.686 -5.724 11.384 1.00 0.00 H new ATOM 0 HG2 PRO A 119 10.787 -6.528 13.735 1.00 0.00 H new ATOM 0 HG3 PRO A 119 12.303 -5.651 13.682 1.00 0.00 H new ATOM 0 HD2 PRO A 119 9.558 -4.628 14.463 1.00 0.00 H new ATOM 0 HD3 PRO A 119 11.105 -4.288 15.213 1.00 0.00 H new