USER MOD reduce.3.24.130724 H: found=0, std=0, add=573, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 575 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 111 ASN : amide:sc= 0.669 X(o=1.3,f=0.9) USER MOD Set 1.2: A 115 THR OG1 : rot 180:sc= 0.597 USER MOD Set 2.1: A 98 THR OG1 : rot 94:sc= 2.15 USER MOD Set 2.2: A 103 TYR OH : rot -179:sc= 0.986 USER MOD Single : A 79 SER OG : rot 180:sc= 0.00155 USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 83 SER OG : rot -50:sc= 0.367 USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 CYS SG : rot 180:sc= 0.0035 USER MOD Single : A 102 TYR OH : rot 180:sc= 0 USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 LYS NZ :NH3+ 175:sc= 1.25 (180deg=1.13) USER MOD Single : A 117 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 GLN : amide:sc= 0 X(o=0,f=-0.18) USER MOD Single : A 121 TYR OH : rot 180:sc= 0 USER MOD Single : A 127 CYS SG : rot 180:sc= 0 USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 MET CE :methyl -166:sc= -0.0451 (180deg=-0.0978) USER MOD Single : A 132 HIS : no HD1:sc= 0 X(o=0,f=-0.0023) USER MOD Single : A 134 LYS NZ :NH3+ -109:sc= 0.258 (180deg=0) USER MOD Single : A 136 MET CE :methyl 167:sc= -0.0772 (180deg=-0.341) USER MOD Single : A 141 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 143 GLN : amide:sc= -1.33 K(o=-1.3,f=0.026) USER MOD Single : A 150 LYS NZ :NH3+ 172:sc= 1.22 (180deg=1.17) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 78 4.130 15.416 -16.043 1.00 0.00 N ATOM 2 CA GLY A 78 2.768 15.986 -16.057 1.00 0.00 C ATOM 3 C GLY A 78 2.053 15.763 -14.733 1.00 0.00 C ATOM 4 O GLY A 78 2.192 14.709 -14.112 1.00 0.00 O ATOM 0 HA2 GLY A 78 2.822 17.054 -16.266 1.00 0.00 H new ATOM 0 HA3 GLY A 78 2.192 15.532 -16.863 1.00 0.00 H new ATOM 10 N SER A 79 1.257 16.745 -14.297 1.00 0.00 N ATOM 11 CA SER A 79 0.508 16.752 -13.022 1.00 0.00 C ATOM 12 C SER A 79 -0.762 15.871 -12.991 1.00 0.00 C ATOM 13 O SER A 79 -1.515 15.904 -12.014 1.00 0.00 O ATOM 14 CB SER A 79 0.160 18.205 -12.660 1.00 0.00 C ATOM 15 OG SER A 79 -0.590 18.822 -13.697 1.00 0.00 O ATOM 0 H SER A 79 1.106 17.595 -14.841 1.00 0.00 H new ATOM 0 HA SER A 79 1.168 16.300 -12.282 1.00 0.00 H new ATOM 0 HB2 SER A 79 -0.411 18.226 -11.732 1.00 0.00 H new ATOM 0 HB3 SER A 79 1.076 18.769 -12.484 1.00 0.00 H new ATOM 0 HG SER A 79 -0.801 19.745 -13.443 1.00 0.00 H new ATOM 21 N SER A 80 -1.012 15.071 -14.036 1.00 0.00 N ATOM 22 CA SER A 80 -2.164 14.154 -14.164 1.00 0.00 C ATOM 23 C SER A 80 -2.241 13.063 -13.072 1.00 0.00 C ATOM 24 O SER A 80 -3.308 12.489 -12.828 1.00 0.00 O ATOM 25 CB SER A 80 -2.129 13.515 -15.561 1.00 0.00 C ATOM 26 OG SER A 80 -3.372 12.920 -15.895 1.00 0.00 O ATOM 0 H SER A 80 -0.397 15.040 -14.849 1.00 0.00 H new ATOM 0 HA SER A 80 -3.064 14.753 -14.025 1.00 0.00 H new ATOM 0 HB2 SER A 80 -1.877 14.273 -16.302 1.00 0.00 H new ATOM 0 HB3 SER A 80 -1.343 12.761 -15.597 1.00 0.00 H new ATOM 0 HG SER A 80 -3.315 12.525 -16.790 1.00 0.00 H new ATOM 32 N GLY A 81 -1.133 12.800 -12.369 1.00 0.00 N ATOM 33 CA GLY A 81 -1.042 11.893 -11.216 1.00 0.00 C ATOM 34 C GLY A 81 0.053 12.307 -10.224 1.00 0.00 C ATOM 35 O GLY A 81 0.766 13.291 -10.445 1.00 0.00 O ATOM 0 H GLY A 81 -0.237 13.231 -12.597 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -2.003 11.868 -10.701 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -0.843 10.881 -11.569 1.00 0.00 H new ATOM 39 N SER A 82 0.187 11.564 -9.118 1.00 0.00 N ATOM 40 CA SER A 82 1.108 11.900 -8.012 1.00 0.00 C ATOM 41 C SER A 82 2.590 11.946 -8.425 1.00 0.00 C ATOM 42 O SER A 82 3.359 12.716 -7.845 1.00 0.00 O ATOM 43 CB SER A 82 0.921 10.912 -6.852 1.00 0.00 C ATOM 44 OG SER A 82 1.441 11.439 -5.641 1.00 0.00 O ATOM 0 H SER A 82 -0.342 10.706 -8.959 1.00 0.00 H new ATOM 0 HA SER A 82 0.846 12.911 -7.698 1.00 0.00 H new ATOM 0 HB2 SER A 82 -0.139 10.688 -6.729 1.00 0.00 H new ATOM 0 HB3 SER A 82 1.421 9.972 -7.087 1.00 0.00 H new ATOM 0 HG SER A 82 1.308 10.791 -4.918 1.00 0.00 H new ATOM 50 N SER A 83 2.982 11.162 -9.441 1.00 0.00 N ATOM 51 CA SER A 83 4.293 11.188 -10.121 1.00 0.00 C ATOM 52 C SER A 83 5.532 11.191 -9.193 1.00 0.00 C ATOM 53 O SER A 83 6.564 11.785 -9.522 1.00 0.00 O ATOM 54 CB SER A 83 4.295 12.351 -11.130 1.00 0.00 C ATOM 55 OG SER A 83 5.382 12.251 -12.034 1.00 0.00 O ATOM 0 H SER A 83 2.362 10.454 -9.834 1.00 0.00 H new ATOM 0 HA SER A 83 4.403 10.237 -10.641 1.00 0.00 H new ATOM 0 HB2 SER A 83 3.357 12.354 -11.686 1.00 0.00 H new ATOM 0 HB3 SER A 83 4.351 13.299 -10.595 1.00 0.00 H new ATOM 0 HG SER A 83 6.214 12.120 -11.532 1.00 0.00 H new ATOM 61 N GLY A 84 5.440 10.547 -8.022 1.00 0.00 N ATOM 62 CA GLY A 84 6.459 10.628 -6.964 1.00 0.00 C ATOM 63 C GLY A 84 6.358 9.544 -5.882 1.00 0.00 C ATOM 64 O GLY A 84 6.701 9.796 -4.725 1.00 0.00 O ATOM 0 H GLY A 84 4.650 9.950 -7.779 1.00 0.00 H new ATOM 0 HA2 GLY A 84 7.445 10.569 -7.425 1.00 0.00 H new ATOM 0 HA3 GLY A 84 6.388 11.605 -6.486 1.00 0.00 H new ATOM 68 N PHE A 85 5.854 8.357 -6.233 1.00 0.00 N ATOM 69 CA PHE A 85 5.804 7.194 -5.338 1.00 0.00 C ATOM 70 C PHE A 85 7.215 6.649 -5.036 1.00 0.00 C ATOM 71 O PHE A 85 8.065 6.575 -5.928 1.00 0.00 O ATOM 72 CB PHE A 85 4.944 6.095 -5.982 1.00 0.00 C ATOM 73 CG PHE A 85 3.523 6.514 -6.318 1.00 0.00 C ATOM 74 CD1 PHE A 85 2.558 6.614 -5.297 1.00 0.00 C ATOM 75 CD2 PHE A 85 3.162 6.803 -7.650 1.00 0.00 C ATOM 76 CE1 PHE A 85 1.238 6.989 -5.606 1.00 0.00 C ATOM 77 CE2 PHE A 85 1.842 7.178 -7.958 1.00 0.00 C ATOM 78 CZ PHE A 85 0.878 7.266 -6.937 1.00 0.00 C ATOM 0 H PHE A 85 5.464 8.173 -7.158 1.00 0.00 H new ATOM 0 HA PHE A 85 5.362 7.508 -4.392 1.00 0.00 H new ATOM 0 HB2 PHE A 85 5.434 5.758 -6.895 1.00 0.00 H new ATOM 0 HB3 PHE A 85 4.906 5.240 -5.307 1.00 0.00 H new ATOM 0 HD1 PHE A 85 2.832 6.402 -4.274 1.00 0.00 H new ATOM 0 HD2 PHE A 85 3.901 6.736 -8.435 1.00 0.00 H new ATOM 0 HE1 PHE A 85 0.500 7.064 -4.821 1.00 0.00 H new ATOM 0 HE2 PHE A 85 1.568 7.399 -8.979 1.00 0.00 H new ATOM 0 HZ PHE A 85 -0.138 7.546 -7.175 1.00 0.00 H new ATOM 88 N ASP A 86 7.454 6.215 -3.795 1.00 0.00 N ATOM 89 CA ASP A 86 8.714 5.609 -3.336 1.00 0.00 C ATOM 90 C ASP A 86 8.475 4.597 -2.202 1.00 0.00 C ATOM 91 O ASP A 86 7.651 4.825 -1.308 1.00 0.00 O ATOM 92 CB ASP A 86 9.668 6.698 -2.809 1.00 0.00 C ATOM 93 CG ASP A 86 10.409 7.451 -3.924 1.00 0.00 C ATOM 94 OD1 ASP A 86 11.261 6.827 -4.604 1.00 0.00 O ATOM 95 OD2 ASP A 86 10.197 8.678 -4.077 1.00 0.00 O ATOM 0 H ASP A 86 6.754 6.276 -3.055 1.00 0.00 H new ATOM 0 HA ASP A 86 9.152 5.095 -4.192 1.00 0.00 H new ATOM 0 HB2 ASP A 86 9.099 7.412 -2.214 1.00 0.00 H new ATOM 0 HB3 ASP A 86 10.399 6.239 -2.143 1.00 0.00 H new ATOM 100 N PHE A 87 9.231 3.495 -2.211 1.00 0.00 N ATOM 101 CA PHE A 87 9.300 2.540 -1.099 1.00 0.00 C ATOM 102 C PHE A 87 10.179 3.068 0.052 1.00 0.00 C ATOM 103 O PHE A 87 11.058 3.916 -0.148 1.00 0.00 O ATOM 104 CB PHE A 87 9.868 1.208 -1.608 1.00 0.00 C ATOM 105 CG PHE A 87 8.924 0.386 -2.472 1.00 0.00 C ATOM 106 CD1 PHE A 87 7.933 -0.408 -1.863 1.00 0.00 C ATOM 107 CD2 PHE A 87 9.059 0.364 -3.875 1.00 0.00 C ATOM 108 CE1 PHE A 87 7.086 -1.214 -2.643 1.00 0.00 C ATOM 109 CE2 PHE A 87 8.214 -0.446 -4.657 1.00 0.00 C ATOM 110 CZ PHE A 87 7.227 -1.236 -4.040 1.00 0.00 C ATOM 0 H PHE A 87 9.821 3.237 -3.002 1.00 0.00 H new ATOM 0 HA PHE A 87 8.291 2.398 -0.712 1.00 0.00 H new ATOM 0 HB2 PHE A 87 10.772 1.413 -2.181 1.00 0.00 H new ATOM 0 HB3 PHE A 87 10.164 0.606 -0.749 1.00 0.00 H new ATOM 0 HD1 PHE A 87 7.823 -0.397 -0.789 1.00 0.00 H new ATOM 0 HD2 PHE A 87 9.814 0.971 -4.352 1.00 0.00 H new ATOM 0 HE1 PHE A 87 6.326 -1.817 -2.168 1.00 0.00 H new ATOM 0 HE2 PHE A 87 8.324 -0.461 -5.731 1.00 0.00 H new ATOM 0 HZ PHE A 87 6.579 -1.858 -4.640 1.00 0.00 H new ATOM 120 N LYS A 88 9.981 2.529 1.259 1.00 0.00 N ATOM 121 CA LYS A 88 10.848 2.735 2.433 1.00 0.00 C ATOM 122 C LYS A 88 12.057 1.787 2.404 1.00 0.00 C ATOM 123 O LYS A 88 12.003 0.702 1.818 1.00 0.00 O ATOM 124 CB LYS A 88 10.033 2.483 3.721 1.00 0.00 C ATOM 125 CG LYS A 88 8.840 3.429 3.942 1.00 0.00 C ATOM 126 CD LYS A 88 9.307 4.812 4.406 1.00 0.00 C ATOM 127 CE LYS A 88 8.137 5.767 4.674 1.00 0.00 C ATOM 128 NZ LYS A 88 7.453 6.189 3.422 1.00 0.00 N ATOM 0 H LYS A 88 9.189 1.917 1.457 1.00 0.00 H new ATOM 0 HA LYS A 88 11.215 3.761 2.413 1.00 0.00 H new ATOM 0 HB2 LYS A 88 9.663 1.458 3.702 1.00 0.00 H new ATOM 0 HB3 LYS A 88 10.703 2.565 4.577 1.00 0.00 H new ATOM 0 HG2 LYS A 88 8.273 3.526 3.016 1.00 0.00 H new ATOM 0 HG3 LYS A 88 8.167 3.002 4.685 1.00 0.00 H new ATOM 0 HD2 LYS A 88 9.901 4.706 5.314 1.00 0.00 H new ATOM 0 HD3 LYS A 88 9.959 5.245 3.648 1.00 0.00 H new ATOM 0 HE2 LYS A 88 7.417 5.280 5.332 1.00 0.00 H new ATOM 0 HE3 LYS A 88 8.504 6.649 5.200 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 6.670 6.833 3.654 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 8.131 6.678 2.803 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 7.079 5.352 2.932 1.00 0.00 H new ATOM 142 N ALA A 89 13.144 2.164 3.078 1.00 0.00 N ATOM 143 CA ALA A 89 14.256 1.249 3.348 1.00 0.00 C ATOM 144 C ALA A 89 13.850 0.259 4.462 1.00 0.00 C ATOM 145 O ALA A 89 13.241 0.652 5.463 1.00 0.00 O ATOM 146 CB ALA A 89 15.491 2.070 3.738 1.00 0.00 C ATOM 0 H ALA A 89 13.279 3.104 3.450 1.00 0.00 H new ATOM 0 HA ALA A 89 14.499 0.666 2.460 1.00 0.00 H new ATOM 0 HB1 ALA A 89 16.325 1.398 3.941 1.00 0.00 H new ATOM 0 HB2 ALA A 89 15.756 2.740 2.920 1.00 0.00 H new ATOM 0 HB3 ALA A 89 15.271 2.656 4.630 1.00 0.00 H new ATOM 152 N GLY A 90 14.159 -1.027 4.287 1.00 0.00 N ATOM 153 CA GLY A 90 13.755 -2.113 5.189 1.00 0.00 C ATOM 154 C GLY A 90 12.279 -2.529 5.080 1.00 0.00 C ATOM 155 O GLY A 90 11.822 -3.340 5.885 1.00 0.00 O ATOM 0 H GLY A 90 14.712 -1.353 3.494 1.00 0.00 H new ATOM 0 HA2 GLY A 90 14.379 -2.984 4.988 1.00 0.00 H new ATOM 0 HA3 GLY A 90 13.956 -1.807 6.216 1.00 0.00 H new ATOM 159 N GLU A 91 11.516 -1.982 4.123 1.00 0.00 N ATOM 160 CA GLU A 91 10.088 -2.289 3.948 1.00 0.00 C ATOM 161 C GLU A 91 9.866 -3.751 3.535 1.00 0.00 C ATOM 162 O GLU A 91 10.510 -4.236 2.601 1.00 0.00 O ATOM 163 CB GLU A 91 9.463 -1.366 2.882 1.00 0.00 C ATOM 164 CG GLU A 91 8.017 -0.991 3.231 1.00 0.00 C ATOM 165 CD GLU A 91 7.297 -0.284 2.068 1.00 0.00 C ATOM 166 OE1 GLU A 91 7.804 0.753 1.581 1.00 0.00 O ATOM 167 OE2 GLU A 91 6.203 -0.746 1.659 1.00 0.00 O ATOM 0 H GLU A 91 11.874 -1.310 3.444 1.00 0.00 H new ATOM 0 HA GLU A 91 9.606 -2.123 4.911 1.00 0.00 H new ATOM 0 HB2 GLU A 91 10.061 -0.460 2.790 1.00 0.00 H new ATOM 0 HB3 GLU A 91 9.486 -1.863 1.912 1.00 0.00 H new ATOM 0 HG2 GLU A 91 7.466 -1.892 3.502 1.00 0.00 H new ATOM 0 HG3 GLU A 91 8.014 -0.341 4.106 1.00 0.00 H new ATOM 174 N GLU A 92 8.942 -4.449 4.199 1.00 0.00 N ATOM 175 CA GLU A 92 8.476 -5.769 3.756 1.00 0.00 C ATOM 176 C GLU A 92 7.511 -5.619 2.564 1.00 0.00 C ATOM 177 O GLU A 92 6.556 -4.839 2.607 1.00 0.00 O ATOM 178 CB GLU A 92 7.792 -6.523 4.901 1.00 0.00 C ATOM 179 CG GLU A 92 8.783 -6.996 5.973 1.00 0.00 C ATOM 180 CD GLU A 92 8.099 -7.821 7.080 1.00 0.00 C ATOM 181 OE1 GLU A 92 7.101 -7.350 7.673 1.00 0.00 O ATOM 182 OE2 GLU A 92 8.582 -8.941 7.378 1.00 0.00 O ATOM 0 H GLU A 92 8.496 -4.119 5.055 1.00 0.00 H new ATOM 0 HA GLU A 92 9.343 -6.348 3.440 1.00 0.00 H new ATOM 0 HB2 GLU A 92 7.046 -5.876 5.362 1.00 0.00 H new ATOM 0 HB3 GLU A 92 7.261 -7.385 4.497 1.00 0.00 H new ATOM 0 HG2 GLU A 92 9.562 -7.597 5.504 1.00 0.00 H new ATOM 0 HG3 GLU A 92 9.273 -6.130 6.419 1.00 0.00 H new ATOM 189 N VAL A 93 7.761 -6.379 1.498 1.00 0.00 N ATOM 190 CA VAL A 93 7.116 -6.266 0.176 1.00 0.00 C ATOM 191 C VAL A 93 6.929 -7.646 -0.474 1.00 0.00 C ATOM 192 O VAL A 93 7.362 -8.665 0.071 1.00 0.00 O ATOM 193 CB VAL A 93 7.934 -5.333 -0.753 1.00 0.00 C ATOM 194 CG1 VAL A 93 7.967 -3.891 -0.232 1.00 0.00 C ATOM 195 CG2 VAL A 93 9.374 -5.816 -0.986 1.00 0.00 C ATOM 0 H VAL A 93 8.452 -7.129 1.527 1.00 0.00 H new ATOM 0 HA VAL A 93 6.128 -5.830 0.324 1.00 0.00 H new ATOM 0 HB VAL A 93 7.411 -5.362 -1.709 1.00 0.00 H new ATOM 0 HG11 VAL A 93 8.551 -3.271 -0.913 1.00 0.00 H new ATOM 0 HG12 VAL A 93 6.950 -3.503 -0.170 1.00 0.00 H new ATOM 0 HG13 VAL A 93 8.424 -3.872 0.757 1.00 0.00 H new ATOM 0 HG21 VAL A 93 9.890 -5.117 -1.645 1.00 0.00 H new ATOM 0 HG22 VAL A 93 9.898 -5.870 -0.032 1.00 0.00 H new ATOM 0 HG23 VAL A 93 9.356 -6.804 -1.447 1.00 0.00 H new ATOM 205 N LEU A 94 6.303 -7.683 -1.654 1.00 0.00 N ATOM 206 CA LEU A 94 6.125 -8.878 -2.483 1.00 0.00 C ATOM 207 C LEU A 94 6.909 -8.723 -3.791 1.00 0.00 C ATOM 208 O LEU A 94 6.831 -7.684 -4.447 1.00 0.00 O ATOM 209 CB LEU A 94 4.624 -9.068 -2.777 1.00 0.00 C ATOM 210 CG LEU A 94 3.774 -9.505 -1.573 1.00 0.00 C ATOM 211 CD1 LEU A 94 2.305 -9.586 -1.988 1.00 0.00 C ATOM 212 CD2 LEU A 94 4.183 -10.875 -1.024 1.00 0.00 C ATOM 0 H LEU A 94 5.891 -6.850 -2.074 1.00 0.00 H new ATOM 0 HA LEU A 94 6.501 -9.754 -1.955 1.00 0.00 H new ATOM 0 HB2 LEU A 94 4.224 -8.131 -3.163 1.00 0.00 H new ATOM 0 HB3 LEU A 94 4.516 -9.811 -3.567 1.00 0.00 H new ATOM 0 HG LEU A 94 3.932 -8.761 -0.792 1.00 0.00 H new ATOM 0 HD11 LEU A 94 1.702 -9.896 -1.134 1.00 0.00 H new ATOM 0 HD12 LEU A 94 1.970 -8.608 -2.333 1.00 0.00 H new ATOM 0 HD13 LEU A 94 2.194 -10.312 -2.793 1.00 0.00 H new ATOM 0 HD21 LEU A 94 3.549 -11.131 -0.175 1.00 0.00 H new ATOM 0 HD22 LEU A 94 4.068 -11.628 -1.803 1.00 0.00 H new ATOM 0 HD23 LEU A 94 5.224 -10.842 -0.702 1.00 0.00 H new ATOM 224 N ALA A 95 7.651 -9.754 -4.192 1.00 0.00 N ATOM 225 CA ALA A 95 8.461 -9.724 -5.410 1.00 0.00 C ATOM 226 C ALA A 95 8.577 -11.102 -6.086 1.00 0.00 C ATOM 227 O ALA A 95 8.399 -12.147 -5.452 1.00 0.00 O ATOM 228 CB ALA A 95 9.830 -9.128 -5.054 1.00 0.00 C ATOM 0 H ALA A 95 7.708 -10.635 -3.681 1.00 0.00 H new ATOM 0 HA ALA A 95 7.969 -9.097 -6.154 1.00 0.00 H new ATOM 0 HB1 ALA A 95 10.455 -9.094 -5.946 1.00 0.00 H new ATOM 0 HB2 ALA A 95 9.697 -8.118 -4.665 1.00 0.00 H new ATOM 0 HB3 ALA A 95 10.311 -9.748 -4.297 1.00 0.00 H new ATOM 234 N ARG A 96 8.844 -11.100 -7.397 1.00 0.00 N ATOM 235 CA ARG A 96 8.994 -12.306 -8.232 1.00 0.00 C ATOM 236 C ARG A 96 10.349 -12.993 -7.994 1.00 0.00 C ATOM 237 O ARG A 96 11.350 -12.316 -7.758 1.00 0.00 O ATOM 238 CB ARG A 96 8.820 -11.891 -9.706 1.00 0.00 C ATOM 239 CG ARG A 96 8.780 -13.092 -10.660 1.00 0.00 C ATOM 240 CD ARG A 96 8.473 -12.669 -12.101 1.00 0.00 C ATOM 241 NE ARG A 96 8.439 -13.841 -13.001 1.00 0.00 N ATOM 242 CZ ARG A 96 9.468 -14.438 -13.580 1.00 0.00 C ATOM 243 NH1 ARG A 96 10.695 -14.020 -13.433 1.00 0.00 N ATOM 244 NH2 ARG A 96 9.284 -15.485 -14.329 1.00 0.00 N ATOM 0 H ARG A 96 8.966 -10.236 -7.925 1.00 0.00 H new ATOM 0 HA ARG A 96 8.232 -13.038 -7.963 1.00 0.00 H new ATOM 0 HB2 ARG A 96 7.899 -11.318 -9.811 1.00 0.00 H new ATOM 0 HB3 ARG A 96 9.640 -11.232 -9.993 1.00 0.00 H new ATOM 0 HG2 ARG A 96 9.738 -13.611 -10.631 1.00 0.00 H new ATOM 0 HG3 ARG A 96 8.024 -13.800 -10.321 1.00 0.00 H new ATOM 0 HD2 ARG A 96 7.514 -12.152 -12.136 1.00 0.00 H new ATOM 0 HD3 ARG A 96 9.229 -11.963 -12.446 1.00 0.00 H new ATOM 0 HE ARG A 96 7.518 -14.234 -13.198 1.00 0.00 H new ATOM 0 HH11 ARG A 96 10.890 -13.203 -12.854 1.00 0.00 H new ATOM 0 HH12 ARG A 96 11.460 -14.510 -13.897 1.00 0.00 H new ATOM 0 HH21 ARG A 96 8.343 -15.850 -14.473 1.00 0.00 H new ATOM 0 HH22 ARG A 96 10.081 -15.941 -14.773 1.00 0.00 H new ATOM 258 N TRP A 97 10.399 -14.325 -8.123 1.00 0.00 N ATOM 259 CA TRP A 97 11.655 -15.099 -8.049 1.00 0.00 C ATOM 260 C TRP A 97 11.712 -16.325 -8.981 1.00 0.00 C ATOM 261 O TRP A 97 12.773 -16.602 -9.546 1.00 0.00 O ATOM 262 CB TRP A 97 11.902 -15.521 -6.593 1.00 0.00 C ATOM 263 CG TRP A 97 13.330 -15.777 -6.211 1.00 0.00 C ATOM 264 CD1 TRP A 97 13.909 -16.988 -6.037 1.00 0.00 C ATOM 265 CD2 TRP A 97 14.360 -14.797 -5.869 1.00 0.00 C ATOM 266 NE1 TRP A 97 15.211 -16.826 -5.603 1.00 0.00 N ATOM 267 CE2 TRP A 97 15.525 -15.495 -5.432 1.00 0.00 C ATOM 268 CE3 TRP A 97 14.416 -13.387 -5.855 1.00 0.00 C ATOM 269 CZ2 TRP A 97 16.658 -14.828 -4.941 1.00 0.00 C ATOM 270 CZ3 TRP A 97 15.537 -12.709 -5.336 1.00 0.00 C ATOM 271 CH2 TRP A 97 16.638 -13.430 -4.845 1.00 0.00 C ATOM 0 H TRP A 97 9.572 -14.901 -8.282 1.00 0.00 H new ATOM 0 HA TRP A 97 12.445 -14.437 -8.404 1.00 0.00 H new ATOM 0 HB2 TRP A 97 11.506 -14.744 -5.939 1.00 0.00 H new ATOM 0 HB3 TRP A 97 11.327 -16.426 -6.396 1.00 0.00 H new ATOM 0 HD1 TRP A 97 13.426 -17.938 -6.211 1.00 0.00 H new ATOM 0 HE1 TRP A 97 15.858 -17.595 -5.431 1.00 0.00 H new ATOM 0 HE3 TRP A 97 13.586 -12.818 -6.248 1.00 0.00 H new ATOM 0 HZ2 TRP A 97 17.534 -15.385 -4.641 1.00 0.00 H new ATOM 0 HZ3 TRP A 97 15.550 -11.629 -5.316 1.00 0.00 H new ATOM 0 HH2 TRP A 97 17.468 -12.907 -4.394 1.00 0.00 H new ATOM 282 N THR A 98 10.593 -17.036 -9.190 1.00 0.00 N ATOM 283 CA THR A 98 10.548 -18.282 -9.995 1.00 0.00 C ATOM 284 C THR A 98 9.324 -18.420 -10.910 1.00 0.00 C ATOM 285 O THR A 98 9.408 -19.068 -11.954 1.00 0.00 O ATOM 286 CB THR A 98 10.583 -19.539 -9.100 1.00 0.00 C ATOM 287 OG1 THR A 98 9.427 -19.630 -8.291 1.00 0.00 O ATOM 288 CG2 THR A 98 11.790 -19.590 -8.163 1.00 0.00 C ATOM 0 H THR A 98 9.687 -16.768 -8.807 1.00 0.00 H new ATOM 0 HA THR A 98 11.436 -18.205 -10.622 1.00 0.00 H new ATOM 0 HB THR A 98 10.642 -20.371 -9.802 1.00 0.00 H new ATOM 0 HG1 THR A 98 8.756 -20.186 -8.740 1.00 0.00 H new ATOM 0 HG21 THR A 98 11.748 -20.500 -7.565 1.00 0.00 H new ATOM 0 HG22 THR A 98 12.708 -19.584 -8.751 1.00 0.00 H new ATOM 0 HG23 THR A 98 11.776 -18.722 -7.504 1.00 0.00 H new ATOM 296 N ASP A 99 8.188 -17.822 -10.541 1.00 0.00 N ATOM 297 CA ASP A 99 6.869 -18.025 -11.160 1.00 0.00 C ATOM 298 C ASP A 99 6.021 -16.741 -11.074 1.00 0.00 C ATOM 299 O ASP A 99 6.437 -15.744 -10.480 1.00 0.00 O ATOM 300 CB ASP A 99 6.145 -19.174 -10.424 1.00 0.00 C ATOM 301 CG ASP A 99 6.829 -20.538 -10.603 1.00 0.00 C ATOM 302 OD1 ASP A 99 6.525 -21.240 -11.597 1.00 0.00 O ATOM 303 OD2 ASP A 99 7.650 -20.920 -9.734 1.00 0.00 O ATOM 0 H ASP A 99 8.158 -17.154 -9.770 1.00 0.00 H new ATOM 0 HA ASP A 99 7.004 -18.276 -12.212 1.00 0.00 H new ATOM 0 HB2 ASP A 99 6.092 -18.939 -9.361 1.00 0.00 H new ATOM 0 HB3 ASP A 99 5.119 -19.239 -10.787 1.00 0.00 H new ATOM 308 N CYS A 100 4.802 -16.758 -11.625 1.00 0.00 N ATOM 309 CA CYS A 100 3.825 -15.669 -11.476 1.00 0.00 C ATOM 310 C CYS A 100 3.396 -15.410 -10.013 1.00 0.00 C ATOM 311 O CYS A 100 2.861 -14.339 -9.711 1.00 0.00 O ATOM 312 CB CYS A 100 2.600 -15.977 -12.352 1.00 0.00 C ATOM 313 SG CYS A 100 3.077 -16.117 -14.103 1.00 0.00 S ATOM 0 H CYS A 100 4.461 -17.534 -12.192 1.00 0.00 H new ATOM 0 HA CYS A 100 4.312 -14.750 -11.803 1.00 0.00 H new ATOM 0 HB2 CYS A 100 2.135 -16.906 -12.022 1.00 0.00 H new ATOM 0 HB3 CYS A 100 1.856 -15.189 -12.235 1.00 0.00 H new ATOM 0 HG CYS A 100 2.025 -16.380 -14.820 1.00 0.00 H new ATOM 319 N ARG A 101 3.631 -16.364 -9.095 1.00 0.00 N ATOM 320 CA ARG A 101 3.469 -16.191 -7.644 1.00 0.00 C ATOM 321 C ARG A 101 4.595 -15.317 -7.079 1.00 0.00 C ATOM 322 O ARG A 101 5.762 -15.715 -7.087 1.00 0.00 O ATOM 323 CB ARG A 101 3.459 -17.562 -6.941 1.00 0.00 C ATOM 324 CG ARG A 101 2.226 -18.405 -7.295 1.00 0.00 C ATOM 325 CD ARG A 101 2.242 -19.728 -6.521 1.00 0.00 C ATOM 326 NE ARG A 101 1.048 -20.544 -6.819 1.00 0.00 N ATOM 327 CZ ARG A 101 0.743 -21.714 -6.286 1.00 0.00 C ATOM 328 NH1 ARG A 101 1.508 -22.301 -5.406 1.00 0.00 N ATOM 329 NH2 ARG A 101 -0.353 -22.329 -6.630 1.00 0.00 N ATOM 0 H ARG A 101 3.947 -17.300 -9.350 1.00 0.00 H new ATOM 0 HA ARG A 101 2.517 -15.694 -7.460 1.00 0.00 H new ATOM 0 HB2 ARG A 101 4.360 -18.112 -7.215 1.00 0.00 H new ATOM 0 HB3 ARG A 101 3.493 -17.412 -5.862 1.00 0.00 H new ATOM 0 HG2 ARG A 101 1.318 -17.850 -7.059 1.00 0.00 H new ATOM 0 HG3 ARG A 101 2.209 -18.604 -8.367 1.00 0.00 H new ATOM 0 HD2 ARG A 101 3.141 -20.289 -6.777 1.00 0.00 H new ATOM 0 HD3 ARG A 101 2.287 -19.524 -5.451 1.00 0.00 H new ATOM 0 HE ARG A 101 0.394 -20.167 -7.505 1.00 0.00 H new ATOM 0 HH11 ARG A 101 2.376 -21.856 -5.107 1.00 0.00 H new ATOM 0 HH12 ARG A 101 1.238 -23.205 -5.017 1.00 0.00 H new ATOM 0 HH21 ARG A 101 -0.981 -21.907 -7.314 1.00 0.00 H new ATOM 0 HH22 ARG A 101 -0.583 -23.232 -6.215 1.00 0.00 H new ATOM 343 N TYR A 102 4.247 -14.132 -6.583 1.00 0.00 N ATOM 344 CA TYR A 102 5.158 -13.286 -5.802 1.00 0.00 C ATOM 345 C TYR A 102 5.376 -13.894 -4.402 1.00 0.00 C ATOM 346 O TYR A 102 4.478 -14.547 -3.860 1.00 0.00 O ATOM 347 CB TYR A 102 4.581 -11.868 -5.671 1.00 0.00 C ATOM 348 CG TYR A 102 4.138 -11.226 -6.975 1.00 0.00 C ATOM 349 CD1 TYR A 102 5.060 -10.517 -7.770 1.00 0.00 C ATOM 350 CD2 TYR A 102 2.797 -11.345 -7.396 1.00 0.00 C ATOM 351 CE1 TYR A 102 4.650 -9.936 -8.986 1.00 0.00 C ATOM 352 CE2 TYR A 102 2.387 -10.779 -8.617 1.00 0.00 C ATOM 353 CZ TYR A 102 3.311 -10.070 -9.415 1.00 0.00 C ATOM 354 OH TYR A 102 2.896 -9.501 -10.578 1.00 0.00 O ATOM 0 H TYR A 102 3.320 -13.726 -6.710 1.00 0.00 H new ATOM 0 HA TYR A 102 6.116 -13.233 -6.319 1.00 0.00 H new ATOM 0 HB2 TYR A 102 3.728 -11.901 -4.993 1.00 0.00 H new ATOM 0 HB3 TYR A 102 5.332 -11.229 -5.207 1.00 0.00 H new ATOM 0 HD1 TYR A 102 6.085 -10.419 -7.446 1.00 0.00 H new ATOM 0 HD2 TYR A 102 2.083 -11.872 -6.780 1.00 0.00 H new ATOM 0 HE1 TYR A 102 5.359 -9.389 -9.590 1.00 0.00 H new ATOM 0 HE2 TYR A 102 1.364 -10.887 -8.944 1.00 0.00 H new ATOM 0 HH TYR A 102 1.946 -9.696 -10.717 1.00 0.00 H new ATOM 364 N TYR A 103 6.531 -13.630 -3.787 1.00 0.00 N ATOM 365 CA TYR A 103 6.902 -14.134 -2.455 1.00 0.00 C ATOM 366 C TYR A 103 7.402 -12.985 -1.550 1.00 0.00 C ATOM 367 O TYR A 103 7.850 -11.955 -2.071 1.00 0.00 O ATOM 368 CB TYR A 103 7.978 -15.230 -2.592 1.00 0.00 C ATOM 369 CG TYR A 103 7.758 -16.295 -3.659 1.00 0.00 C ATOM 370 CD1 TYR A 103 6.558 -17.034 -3.704 1.00 0.00 C ATOM 371 CD2 TYR A 103 8.780 -16.565 -4.592 1.00 0.00 C ATOM 372 CE1 TYR A 103 6.370 -18.019 -4.695 1.00 0.00 C ATOM 373 CE2 TYR A 103 8.602 -17.560 -5.573 1.00 0.00 C ATOM 374 CZ TYR A 103 7.393 -18.285 -5.629 1.00 0.00 C ATOM 375 OH TYR A 103 7.224 -19.254 -6.567 1.00 0.00 O ATOM 0 H TYR A 103 7.254 -13.046 -4.208 1.00 0.00 H new ATOM 0 HA TYR A 103 6.018 -14.565 -1.985 1.00 0.00 H new ATOM 0 HB2 TYR A 103 8.932 -14.743 -2.793 1.00 0.00 H new ATOM 0 HB3 TYR A 103 8.073 -15.732 -1.629 1.00 0.00 H new ATOM 0 HD1 TYR A 103 5.781 -16.845 -2.978 1.00 0.00 H new ATOM 0 HD2 TYR A 103 9.704 -16.006 -4.554 1.00 0.00 H new ATOM 0 HE1 TYR A 103 5.442 -18.570 -4.739 1.00 0.00 H new ATOM 0 HE2 TYR A 103 9.390 -17.768 -6.282 1.00 0.00 H new ATOM 0 HH TYR A 103 8.030 -19.317 -7.121 1.00 0.00 H new ATOM 385 N PRO A 104 7.329 -13.121 -0.208 1.00 0.00 N ATOM 386 CA PRO A 104 7.712 -12.053 0.714 1.00 0.00 C ATOM 387 C PRO A 104 9.228 -11.803 0.748 1.00 0.00 C ATOM 388 O PRO A 104 10.040 -12.734 0.779 1.00 0.00 O ATOM 389 CB PRO A 104 7.167 -12.469 2.084 1.00 0.00 C ATOM 390 CG PRO A 104 7.095 -13.991 1.999 1.00 0.00 C ATOM 391 CD PRO A 104 6.758 -14.240 0.531 1.00 0.00 C ATOM 0 HA PRO A 104 7.293 -11.100 0.390 1.00 0.00 H new ATOM 0 HB2 PRO A 104 7.823 -12.144 2.891 1.00 0.00 H new ATOM 0 HB3 PRO A 104 6.187 -12.032 2.274 1.00 0.00 H new ATOM 0 HG2 PRO A 104 8.040 -14.456 2.280 1.00 0.00 H new ATOM 0 HG3 PRO A 104 6.331 -14.396 2.662 1.00 0.00 H new ATOM 0 HD2 PRO A 104 7.176 -15.187 0.190 1.00 0.00 H new ATOM 0 HD3 PRO A 104 5.680 -14.296 0.382 1.00 0.00 H new ATOM 399 N ALA A 105 9.594 -10.523 0.799 1.00 0.00 N ATOM 400 CA ALA A 105 10.969 -10.031 0.883 1.00 0.00 C ATOM 401 C ALA A 105 11.043 -8.695 1.651 1.00 0.00 C ATOM 402 O ALA A 105 10.013 -8.087 1.948 1.00 0.00 O ATOM 403 CB ALA A 105 11.503 -9.876 -0.551 1.00 0.00 C ATOM 0 H ALA A 105 8.910 -9.767 0.782 1.00 0.00 H new ATOM 0 HA ALA A 105 11.583 -10.741 1.437 1.00 0.00 H new ATOM 0 HB1 ALA A 105 12.529 -9.510 -0.520 1.00 0.00 H new ATOM 0 HB2 ALA A 105 11.478 -10.842 -1.055 1.00 0.00 H new ATOM 0 HB3 ALA A 105 10.881 -9.166 -1.096 1.00 0.00 H new ATOM 409 N LYS A 106 12.259 -8.216 1.930 1.00 0.00 N ATOM 410 CA LYS A 106 12.556 -6.880 2.484 1.00 0.00 C ATOM 411 C LYS A 106 13.446 -6.096 1.517 1.00 0.00 C ATOM 412 O LYS A 106 14.357 -6.679 0.925 1.00 0.00 O ATOM 413 CB LYS A 106 13.286 -7.019 3.829 1.00 0.00 C ATOM 414 CG LYS A 106 12.342 -7.453 4.956 1.00 0.00 C ATOM 415 CD LYS A 106 13.046 -7.564 6.318 1.00 0.00 C ATOM 416 CE LYS A 106 14.181 -8.600 6.370 1.00 0.00 C ATOM 417 NZ LYS A 106 13.686 -9.988 6.175 1.00 0.00 N ATOM 0 H LYS A 106 13.103 -8.767 1.771 1.00 0.00 H new ATOM 0 HA LYS A 106 11.615 -6.349 2.629 1.00 0.00 H new ATOM 0 HB2 LYS A 106 14.091 -7.747 3.730 1.00 0.00 H new ATOM 0 HB3 LYS A 106 13.748 -6.067 4.090 1.00 0.00 H new ATOM 0 HG2 LYS A 106 11.524 -6.737 5.033 1.00 0.00 H new ATOM 0 HG3 LYS A 106 11.900 -8.416 4.702 1.00 0.00 H new ATOM 0 HD2 LYS A 106 13.451 -6.587 6.583 1.00 0.00 H new ATOM 0 HD3 LYS A 106 12.305 -7.818 7.076 1.00 0.00 H new ATOM 0 HE2 LYS A 106 14.918 -8.368 5.601 1.00 0.00 H new ATOM 0 HE3 LYS A 106 14.691 -8.530 7.331 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 14.486 -10.651 6.218 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 13.002 -10.221 6.923 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 13.223 -10.064 5.247 1.00 0.00 H new ATOM 431 N ILE A 107 13.217 -4.790 1.370 1.00 0.00 N ATOM 432 CA ILE A 107 14.067 -3.897 0.560 1.00 0.00 C ATOM 433 C ILE A 107 15.317 -3.503 1.358 1.00 0.00 C ATOM 434 O ILE A 107 15.240 -2.751 2.327 1.00 0.00 O ATOM 435 CB ILE A 107 13.280 -2.660 0.063 1.00 0.00 C ATOM 436 CG1 ILE A 107 12.110 -3.129 -0.837 1.00 0.00 C ATOM 437 CG2 ILE A 107 14.203 -1.710 -0.724 1.00 0.00 C ATOM 438 CD1 ILE A 107 11.158 -2.018 -1.284 1.00 0.00 C ATOM 0 H ILE A 107 12.431 -4.312 1.811 1.00 0.00 H new ATOM 0 HA ILE A 107 14.389 -4.434 -0.332 1.00 0.00 H new ATOM 0 HB ILE A 107 12.887 -2.118 0.923 1.00 0.00 H new ATOM 0 HG12 ILE A 107 12.523 -3.612 -1.723 1.00 0.00 H new ATOM 0 HG13 ILE A 107 11.537 -3.884 -0.299 1.00 0.00 H new ATOM 0 HG21 ILE A 107 13.631 -0.847 -1.065 1.00 0.00 H new ATOM 0 HG22 ILE A 107 15.016 -1.375 -0.079 1.00 0.00 H new ATOM 0 HG23 ILE A 107 14.616 -2.235 -1.585 1.00 0.00 H new ATOM 0 HD11 ILE A 107 10.372 -2.442 -1.909 1.00 0.00 H new ATOM 0 HD12 ILE A 107 10.711 -1.548 -0.408 1.00 0.00 H new ATOM 0 HD13 ILE A 107 11.712 -1.272 -1.853 1.00 0.00 H new ATOM 450 N GLU A 108 16.481 -4.003 0.949 1.00 0.00 N ATOM 451 CA GLU A 108 17.777 -3.710 1.575 1.00 0.00 C ATOM 452 C GLU A 108 18.401 -2.389 1.084 1.00 0.00 C ATOM 453 O GLU A 108 19.091 -1.716 1.854 1.00 0.00 O ATOM 454 CB GLU A 108 18.752 -4.868 1.297 1.00 0.00 C ATOM 455 CG GLU A 108 18.318 -6.209 1.909 1.00 0.00 C ATOM 456 CD GLU A 108 18.171 -6.128 3.443 1.00 0.00 C ATOM 457 OE1 GLU A 108 19.184 -5.860 4.136 1.00 0.00 O ATOM 458 OE2 GLU A 108 17.046 -6.312 3.962 1.00 0.00 O ATOM 0 H GLU A 108 16.555 -4.639 0.155 1.00 0.00 H new ATOM 0 HA GLU A 108 17.597 -3.600 2.644 1.00 0.00 H new ATOM 0 HB2 GLU A 108 18.858 -4.989 0.219 1.00 0.00 H new ATOM 0 HB3 GLU A 108 19.735 -4.603 1.686 1.00 0.00 H new ATOM 0 HG2 GLU A 108 17.369 -6.517 1.470 1.00 0.00 H new ATOM 0 HG3 GLU A 108 19.050 -6.976 1.656 1.00 0.00 H new ATOM 465 N ALA A 109 18.151 -1.998 -0.174 1.00 0.00 N ATOM 466 CA ALA A 109 18.608 -0.734 -0.769 1.00 0.00 C ATOM 467 C ALA A 109 17.753 -0.321 -1.984 1.00 0.00 C ATOM 468 O ALA A 109 17.036 -1.142 -2.562 1.00 0.00 O ATOM 469 CB ALA A 109 20.088 -0.866 -1.169 1.00 0.00 C ATOM 0 H ALA A 109 17.610 -2.569 -0.824 1.00 0.00 H new ATOM 0 HA ALA A 109 18.496 0.053 -0.023 1.00 0.00 H new ATOM 0 HB1 ALA A 109 20.430 0.070 -1.611 1.00 0.00 H new ATOM 0 HB2 ALA A 109 20.685 -1.090 -0.285 1.00 0.00 H new ATOM 0 HB3 ALA A 109 20.198 -1.672 -1.895 1.00 0.00 H new ATOM 475 N ILE A 110 17.860 0.949 -2.394 1.00 0.00 N ATOM 476 CA ILE A 110 17.014 1.601 -3.411 1.00 0.00 C ATOM 477 C ILE A 110 17.900 2.393 -4.393 1.00 0.00 C ATOM 478 O ILE A 110 18.896 2.999 -3.985 1.00 0.00 O ATOM 479 CB ILE A 110 15.971 2.519 -2.710 1.00 0.00 C ATOM 480 CG1 ILE A 110 15.092 1.713 -1.716 1.00 0.00 C ATOM 481 CG2 ILE A 110 15.103 3.255 -3.750 1.00 0.00 C ATOM 482 CD1 ILE A 110 14.015 2.510 -0.973 1.00 0.00 C ATOM 0 H ILE A 110 18.566 1.579 -2.013 1.00 0.00 H new ATOM 0 HA ILE A 110 16.470 0.849 -3.983 1.00 0.00 H new ATOM 0 HB ILE A 110 16.515 3.268 -2.135 1.00 0.00 H new ATOM 0 HG12 ILE A 110 14.605 0.906 -2.264 1.00 0.00 H new ATOM 0 HG13 ILE A 110 15.746 1.248 -0.978 1.00 0.00 H new ATOM 0 HG21 ILE A 110 14.381 3.891 -3.237 1.00 0.00 H new ATOM 0 HG22 ILE A 110 15.740 3.869 -4.386 1.00 0.00 H new ATOM 0 HG23 ILE A 110 14.573 2.526 -4.363 1.00 0.00 H new ATOM 0 HD11 ILE A 110 13.464 1.845 -0.308 1.00 0.00 H new ATOM 0 HD12 ILE A 110 14.486 3.300 -0.388 1.00 0.00 H new ATOM 0 HD13 ILE A 110 13.328 2.953 -1.694 1.00 0.00 H new ATOM 494 N ASN A 111 17.530 2.419 -5.679 1.00 0.00 N ATOM 495 CA ASN A 111 18.245 3.114 -6.758 1.00 0.00 C ATOM 496 C ASN A 111 17.274 3.891 -7.671 1.00 0.00 C ATOM 497 O ASN A 111 16.240 3.359 -8.085 1.00 0.00 O ATOM 498 CB ASN A 111 19.059 2.077 -7.553 1.00 0.00 C ATOM 499 CG ASN A 111 19.869 2.702 -8.679 1.00 0.00 C ATOM 500 OD1 ASN A 111 20.469 3.758 -8.533 1.00 0.00 O ATOM 501 ND2 ASN A 111 19.901 2.088 -9.840 1.00 0.00 N ATOM 0 H ASN A 111 16.693 1.939 -6.010 1.00 0.00 H new ATOM 0 HA ASN A 111 18.920 3.854 -6.328 1.00 0.00 H new ATOM 0 HB2 ASN A 111 19.732 1.553 -6.875 1.00 0.00 H new ATOM 0 HB3 ASN A 111 18.382 1.331 -7.969 1.00 0.00 H new ATOM 0 HD21 ASN A 111 20.425 2.492 -10.616 1.00 0.00 H new ATOM 0 HD22 ASN A 111 19.402 1.207 -9.965 1.00 0.00 H new ATOM 508 N LYS A 112 17.651 5.142 -7.983 1.00 0.00 N ATOM 509 CA LYS A 112 16.911 6.227 -8.667 1.00 0.00 C ATOM 510 C LYS A 112 15.853 5.759 -9.687 1.00 0.00 C ATOM 511 O LYS A 112 16.146 5.596 -10.872 1.00 0.00 O ATOM 512 CB LYS A 112 17.955 7.217 -9.241 1.00 0.00 C ATOM 513 CG LYS A 112 17.485 8.674 -9.385 1.00 0.00 C ATOM 514 CD LYS A 112 16.470 8.917 -10.508 1.00 0.00 C ATOM 515 CE LYS A 112 16.136 10.412 -10.577 1.00 0.00 C ATOM 516 NZ LYS A 112 14.971 10.663 -11.461 1.00 0.00 N ATOM 0 H LYS A 112 18.589 5.458 -7.735 1.00 0.00 H new ATOM 0 HA LYS A 112 16.285 6.737 -7.935 1.00 0.00 H new ATOM 0 HB2 LYS A 112 18.835 7.201 -8.599 1.00 0.00 H new ATOM 0 HB3 LYS A 112 18.269 6.857 -10.221 1.00 0.00 H new ATOM 0 HG2 LYS A 112 17.044 8.993 -8.441 1.00 0.00 H new ATOM 0 HG3 LYS A 112 18.356 9.306 -9.559 1.00 0.00 H new ATOM 0 HD2 LYS A 112 16.878 8.580 -11.461 1.00 0.00 H new ATOM 0 HD3 LYS A 112 15.564 8.339 -10.326 1.00 0.00 H new ATOM 0 HE2 LYS A 112 15.923 10.786 -9.576 1.00 0.00 H new ATOM 0 HE3 LYS A 112 17.001 10.964 -10.946 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 14.716 11.671 -11.422 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 15.215 10.406 -12.439 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 14.164 10.089 -11.143 1.00 0.00 H new ATOM 530 N GLU A 113 14.624 5.547 -9.204 1.00 0.00 N ATOM 531 CA GLU A 113 13.449 5.007 -9.919 1.00 0.00 C ATOM 532 C GLU A 113 13.750 3.867 -10.924 1.00 0.00 C ATOM 533 O GLU A 113 13.174 3.825 -12.017 1.00 0.00 O ATOM 534 CB GLU A 113 12.611 6.143 -10.548 1.00 0.00 C ATOM 535 CG GLU A 113 12.018 7.137 -9.535 1.00 0.00 C ATOM 536 CD GLU A 113 12.941 8.339 -9.280 1.00 0.00 C ATOM 537 OE1 GLU A 113 12.961 9.268 -10.124 1.00 0.00 O ATOM 538 OE2 GLU A 113 13.643 8.375 -8.240 1.00 0.00 O ATOM 0 H GLU A 113 14.402 5.762 -8.232 1.00 0.00 H new ATOM 0 HA GLU A 113 12.849 4.518 -9.152 1.00 0.00 H new ATOM 0 HB2 GLU A 113 13.237 6.692 -11.252 1.00 0.00 H new ATOM 0 HB3 GLU A 113 11.797 5.701 -11.123 1.00 0.00 H new ATOM 0 HG2 GLU A 113 11.055 7.494 -9.902 1.00 0.00 H new ATOM 0 HG3 GLU A 113 11.829 6.622 -8.593 1.00 0.00 H new ATOM 545 N GLY A 114 14.646 2.934 -10.579 1.00 0.00 N ATOM 546 CA GLY A 114 15.129 1.908 -11.518 1.00 0.00 C ATOM 547 C GLY A 114 15.480 0.537 -10.933 1.00 0.00 C ATOM 548 O GLY A 114 15.318 -0.465 -11.633 1.00 0.00 O ATOM 0 H GLY A 114 15.056 2.867 -9.647 1.00 0.00 H new ATOM 0 HA2 GLY A 114 14.366 1.764 -12.283 1.00 0.00 H new ATOM 0 HA3 GLY A 114 16.014 2.298 -12.020 1.00 0.00 H new ATOM 552 N THR A 115 15.940 0.444 -9.680 1.00 0.00 N ATOM 553 CA THR A 115 16.385 -0.830 -9.082 1.00 0.00 C ATOM 554 C THR A 115 16.226 -0.857 -7.562 1.00 0.00 C ATOM 555 O THR A 115 16.239 0.183 -6.902 1.00 0.00 O ATOM 556 CB THR A 115 17.867 -1.139 -9.404 1.00 0.00 C ATOM 557 OG1 THR A 115 18.394 -0.384 -10.477 1.00 0.00 O ATOM 558 CG2 THR A 115 18.036 -2.603 -9.790 1.00 0.00 C ATOM 0 H THR A 115 16.016 1.243 -9.051 1.00 0.00 H new ATOM 0 HA THR A 115 15.739 -1.586 -9.528 1.00 0.00 H new ATOM 0 HB THR A 115 18.405 -0.881 -8.492 1.00 0.00 H new ATOM 0 HG1 THR A 115 19.331 -0.631 -10.621 1.00 0.00 H new ATOM 0 HG21 THR A 115 19.084 -2.802 -10.013 1.00 0.00 H new ATOM 0 HG22 THR A 115 17.714 -3.237 -8.964 1.00 0.00 H new ATOM 0 HG23 THR A 115 17.431 -2.819 -10.670 1.00 0.00 H new ATOM 566 N PHE A 116 16.129 -2.060 -7.000 1.00 0.00 N ATOM 567 CA PHE A 116 15.983 -2.318 -5.568 1.00 0.00 C ATOM 568 C PHE A 116 16.767 -3.581 -5.198 1.00 0.00 C ATOM 569 O PHE A 116 16.590 -4.627 -5.827 1.00 0.00 O ATOM 570 CB PHE A 116 14.492 -2.505 -5.233 1.00 0.00 C ATOM 571 CG PHE A 116 13.605 -1.329 -5.598 1.00 0.00 C ATOM 572 CD1 PHE A 116 13.137 -1.170 -6.918 1.00 0.00 C ATOM 573 CD2 PHE A 116 13.296 -0.355 -4.632 1.00 0.00 C ATOM 574 CE1 PHE A 116 12.419 -0.017 -7.279 1.00 0.00 C ATOM 575 CE2 PHE A 116 12.559 0.787 -4.987 1.00 0.00 C ATOM 576 CZ PHE A 116 12.127 0.963 -6.314 1.00 0.00 C ATOM 0 H PHE A 116 16.151 -2.917 -7.552 1.00 0.00 H new ATOM 0 HA PHE A 116 16.374 -1.475 -4.998 1.00 0.00 H new ATOM 0 HB2 PHE A 116 14.126 -3.392 -5.750 1.00 0.00 H new ATOM 0 HB3 PHE A 116 14.396 -2.697 -4.164 1.00 0.00 H new ATOM 0 HD1 PHE A 116 13.331 -1.936 -7.654 1.00 0.00 H new ATOM 0 HD2 PHE A 116 13.627 -0.486 -3.612 1.00 0.00 H new ATOM 0 HE1 PHE A 116 12.091 0.116 -8.299 1.00 0.00 H new ATOM 0 HE2 PHE A 116 12.324 1.531 -4.240 1.00 0.00 H new ATOM 0 HZ PHE A 116 11.573 1.848 -6.591 1.00 0.00 H new ATOM 586 N THR A 117 17.640 -3.498 -4.195 1.00 0.00 N ATOM 587 CA THR A 117 18.275 -4.690 -3.598 1.00 0.00 C ATOM 588 C THR A 117 17.298 -5.275 -2.584 1.00 0.00 C ATOM 589 O THR A 117 16.711 -4.532 -1.795 1.00 0.00 O ATOM 590 CB THR A 117 19.607 -4.350 -2.917 1.00 0.00 C ATOM 591 OG1 THR A 117 20.459 -3.708 -3.844 1.00 0.00 O ATOM 592 CG2 THR A 117 20.362 -5.588 -2.429 1.00 0.00 C ATOM 0 H THR A 117 17.930 -2.617 -3.771 1.00 0.00 H new ATOM 0 HA THR A 117 18.501 -5.410 -4.384 1.00 0.00 H new ATOM 0 HB THR A 117 19.358 -3.720 -2.063 1.00 0.00 H new ATOM 0 HG1 THR A 117 21.310 -3.489 -3.409 1.00 0.00 H new ATOM 0 HG21 THR A 117 21.295 -5.282 -1.957 1.00 0.00 H new ATOM 0 HG22 THR A 117 19.749 -6.127 -1.706 1.00 0.00 H new ATOM 0 HG23 THR A 117 20.580 -6.238 -3.276 1.00 0.00 H new ATOM 600 N VAL A 118 17.107 -6.592 -2.594 1.00 0.00 N ATOM 601 CA VAL A 118 16.049 -7.277 -1.839 1.00 0.00 C ATOM 602 C VAL A 118 16.539 -8.580 -1.208 1.00 0.00 C ATOM 603 O VAL A 118 17.329 -9.319 -1.800 1.00 0.00 O ATOM 604 CB VAL A 118 14.807 -7.554 -2.721 1.00 0.00 C ATOM 605 CG1 VAL A 118 14.011 -6.271 -2.991 1.00 0.00 C ATOM 606 CG2 VAL A 118 15.139 -8.202 -4.073 1.00 0.00 C ATOM 0 H VAL A 118 17.691 -7.229 -3.136 1.00 0.00 H new ATOM 0 HA VAL A 118 15.763 -6.599 -1.035 1.00 0.00 H new ATOM 0 HB VAL A 118 14.213 -8.260 -2.142 1.00 0.00 H new ATOM 0 HG11 VAL A 118 13.147 -6.503 -3.613 1.00 0.00 H new ATOM 0 HG12 VAL A 118 13.674 -5.846 -2.045 1.00 0.00 H new ATOM 0 HG13 VAL A 118 14.646 -5.551 -3.507 1.00 0.00 H new ATOM 0 HG21 VAL A 118 14.219 -8.365 -4.634 1.00 0.00 H new ATOM 0 HG22 VAL A 118 15.798 -7.544 -4.640 1.00 0.00 H new ATOM 0 HG23 VAL A 118 15.636 -9.157 -3.906 1.00 0.00 H new ATOM 616 N GLN A 119 16.023 -8.875 -0.013 1.00 0.00 N ATOM 617 CA GLN A 119 16.302 -10.086 0.760 1.00 0.00 C ATOM 618 C GLN A 119 15.003 -10.864 0.983 1.00 0.00 C ATOM 619 O GLN A 119 14.115 -10.413 1.712 1.00 0.00 O ATOM 620 CB GLN A 119 16.990 -9.717 2.087 1.00 0.00 C ATOM 621 CG GLN A 119 17.321 -10.965 2.927 1.00 0.00 C ATOM 622 CD GLN A 119 18.080 -10.642 4.214 1.00 0.00 C ATOM 623 OE1 GLN A 119 18.928 -9.762 4.282 1.00 0.00 O ATOM 624 NE2 GLN A 119 17.804 -11.343 5.295 1.00 0.00 N ATOM 0 H GLN A 119 15.372 -8.250 0.462 1.00 0.00 H new ATOM 0 HA GLN A 119 16.985 -10.730 0.207 1.00 0.00 H new ATOM 0 HB2 GLN A 119 17.907 -9.165 1.880 1.00 0.00 H new ATOM 0 HB3 GLN A 119 16.342 -9.055 2.660 1.00 0.00 H new ATOM 0 HG2 GLN A 119 16.395 -11.481 3.179 1.00 0.00 H new ATOM 0 HG3 GLN A 119 17.915 -11.653 2.325 1.00 0.00 H new ATOM 0 HE21 GLN A 119 17.100 -12.081 5.259 1.00 0.00 H new ATOM 0 HE22 GLN A 119 18.294 -11.148 6.168 1.00 0.00 H new ATOM 633 N PHE A 120 14.878 -12.018 0.332 1.00 0.00 N ATOM 634 CA PHE A 120 13.716 -12.905 0.449 1.00 0.00 C ATOM 635 C PHE A 120 13.725 -13.686 1.775 1.00 0.00 C ATOM 636 O PHE A 120 14.753 -13.782 2.452 1.00 0.00 O ATOM 637 CB PHE A 120 13.659 -13.834 -0.776 1.00 0.00 C ATOM 638 CG PHE A 120 13.011 -13.191 -1.994 1.00 0.00 C ATOM 639 CD1 PHE A 120 13.592 -12.061 -2.606 1.00 0.00 C ATOM 640 CD2 PHE A 120 11.802 -13.708 -2.503 1.00 0.00 C ATOM 641 CE1 PHE A 120 12.967 -11.451 -3.708 1.00 0.00 C ATOM 642 CE2 PHE A 120 11.194 -13.112 -3.623 1.00 0.00 C ATOM 643 CZ PHE A 120 11.781 -11.991 -4.229 1.00 0.00 C ATOM 0 H PHE A 120 15.593 -12.372 -0.304 1.00 0.00 H new ATOM 0 HA PHE A 120 12.809 -12.301 0.466 1.00 0.00 H new ATOM 0 HB2 PHE A 120 14.671 -14.145 -1.034 1.00 0.00 H new ATOM 0 HB3 PHE A 120 13.106 -14.736 -0.513 1.00 0.00 H new ATOM 0 HD1 PHE A 120 14.521 -11.662 -2.226 1.00 0.00 H new ATOM 0 HD2 PHE A 120 11.341 -14.564 -2.032 1.00 0.00 H new ATOM 0 HE1 PHE A 120 13.399 -10.567 -4.153 1.00 0.00 H new ATOM 0 HE2 PHE A 120 10.274 -13.518 -4.017 1.00 0.00 H new ATOM 0 HZ PHE A 120 11.320 -11.543 -5.097 1.00 0.00 H new ATOM 653 N TYR A 121 12.577 -14.267 2.139 1.00 0.00 N ATOM 654 CA TYR A 121 12.373 -15.026 3.384 1.00 0.00 C ATOM 655 C TYR A 121 13.376 -16.179 3.620 1.00 0.00 C ATOM 656 O TYR A 121 13.649 -16.537 4.768 1.00 0.00 O ATOM 657 CB TYR A 121 10.927 -15.549 3.418 1.00 0.00 C ATOM 658 CG TYR A 121 10.630 -16.665 2.428 1.00 0.00 C ATOM 659 CD1 TYR A 121 10.251 -16.366 1.103 1.00 0.00 C ATOM 660 CD2 TYR A 121 10.763 -18.009 2.830 1.00 0.00 C ATOM 661 CE1 TYR A 121 10.019 -17.404 0.180 1.00 0.00 C ATOM 662 CE2 TYR A 121 10.527 -19.050 1.912 1.00 0.00 C ATOM 663 CZ TYR A 121 10.156 -18.751 0.583 1.00 0.00 C ATOM 664 OH TYR A 121 9.931 -19.759 -0.301 1.00 0.00 O ATOM 0 H TYR A 121 11.738 -14.223 1.561 1.00 0.00 H new ATOM 0 HA TYR A 121 12.560 -14.331 4.202 1.00 0.00 H new ATOM 0 HB2 TYR A 121 10.708 -15.907 4.424 1.00 0.00 H new ATOM 0 HB3 TYR A 121 10.250 -14.718 3.221 1.00 0.00 H new ATOM 0 HD1 TYR A 121 10.138 -15.337 0.795 1.00 0.00 H new ATOM 0 HD2 TYR A 121 11.047 -18.241 3.846 1.00 0.00 H new ATOM 0 HE1 TYR A 121 9.736 -17.170 -0.836 1.00 0.00 H new ATOM 0 HE2 TYR A 121 10.630 -20.079 2.225 1.00 0.00 H new ATOM 0 HH TYR A 121 10.071 -20.621 0.143 1.00 0.00 H new ATOM 674 N ASP A 122 13.950 -16.747 2.553 1.00 0.00 N ATOM 675 CA ASP A 122 14.994 -17.783 2.605 1.00 0.00 C ATOM 676 C ASP A 122 16.355 -17.275 3.142 1.00 0.00 C ATOM 677 O ASP A 122 17.170 -18.068 3.620 1.00 0.00 O ATOM 678 CB ASP A 122 15.149 -18.357 1.188 1.00 0.00 C ATOM 679 CG ASP A 122 16.139 -19.530 1.128 1.00 0.00 C ATOM 680 OD1 ASP A 122 15.811 -20.627 1.644 1.00 0.00 O ATOM 681 OD2 ASP A 122 17.235 -19.368 0.537 1.00 0.00 O ATOM 0 H ASP A 122 13.694 -16.492 1.599 1.00 0.00 H new ATOM 0 HA ASP A 122 14.680 -18.548 3.315 1.00 0.00 H new ATOM 0 HB2 ASP A 122 14.176 -18.690 0.827 1.00 0.00 H new ATOM 0 HB3 ASP A 122 15.486 -17.568 0.516 1.00 0.00 H new ATOM 686 N GLY A 123 16.608 -15.962 3.072 1.00 0.00 N ATOM 687 CA GLY A 123 17.845 -15.295 3.508 1.00 0.00 C ATOM 688 C GLY A 123 18.753 -14.841 2.354 1.00 0.00 C ATOM 689 O GLY A 123 19.649 -14.020 2.563 1.00 0.00 O ATOM 0 H GLY A 123 15.926 -15.305 2.693 1.00 0.00 H new ATOM 0 HA2 GLY A 123 17.583 -14.427 4.113 1.00 0.00 H new ATOM 0 HA3 GLY A 123 18.405 -15.975 4.151 1.00 0.00 H new ATOM 693 N VAL A 124 18.523 -15.353 1.139 1.00 0.00 N ATOM 694 CA VAL A 124 19.213 -14.959 -0.106 1.00 0.00 C ATOM 695 C VAL A 124 19.009 -13.471 -0.440 1.00 0.00 C ATOM 696 O VAL A 124 17.949 -12.906 -0.154 1.00 0.00 O ATOM 697 CB VAL A 124 18.761 -15.877 -1.265 1.00 0.00 C ATOM 698 CG1 VAL A 124 17.276 -15.720 -1.626 1.00 0.00 C ATOM 699 CG2 VAL A 124 19.607 -15.688 -2.531 1.00 0.00 C ATOM 0 H VAL A 124 17.826 -16.081 0.985 1.00 0.00 H new ATOM 0 HA VAL A 124 20.285 -15.087 0.043 1.00 0.00 H new ATOM 0 HB VAL A 124 18.912 -16.886 -0.882 1.00 0.00 H new ATOM 0 HG11 VAL A 124 17.028 -16.393 -2.446 1.00 0.00 H new ATOM 0 HG12 VAL A 124 16.663 -15.964 -0.758 1.00 0.00 H new ATOM 0 HG13 VAL A 124 17.082 -14.691 -1.930 1.00 0.00 H new ATOM 0 HG21 VAL A 124 19.247 -16.357 -3.313 1.00 0.00 H new ATOM 0 HG22 VAL A 124 19.527 -14.656 -2.871 1.00 0.00 H new ATOM 0 HG23 VAL A 124 20.649 -15.917 -2.310 1.00 0.00 H new ATOM 709 N ILE A 125 20.008 -12.845 -1.075 1.00 0.00 N ATOM 710 CA ILE A 125 20.008 -11.424 -1.462 1.00 0.00 C ATOM 711 C ILE A 125 20.400 -11.282 -2.941 1.00 0.00 C ATOM 712 O ILE A 125 21.443 -11.785 -3.368 1.00 0.00 O ATOM 713 CB ILE A 125 20.951 -10.577 -0.565 1.00 0.00 C ATOM 714 CG1 ILE A 125 20.691 -10.826 0.939 1.00 0.00 C ATOM 715 CG2 ILE A 125 20.786 -9.078 -0.898 1.00 0.00 C ATOM 716 CD1 ILE A 125 21.565 -10.005 1.894 1.00 0.00 C ATOM 0 H ILE A 125 20.866 -13.326 -1.343 1.00 0.00 H new ATOM 0 HA ILE A 125 18.998 -11.041 -1.319 1.00 0.00 H new ATOM 0 HB ILE A 125 21.976 -10.884 -0.773 1.00 0.00 H new ATOM 0 HG12 ILE A 125 19.644 -10.609 1.152 1.00 0.00 H new ATOM 0 HG13 ILE A 125 20.846 -11.884 1.148 1.00 0.00 H new ATOM 0 HG21 ILE A 125 21.450 -8.489 -0.265 1.00 0.00 H new ATOM 0 HG22 ILE A 125 21.037 -8.908 -1.945 1.00 0.00 H new ATOM 0 HG23 ILE A 125 19.754 -8.777 -0.719 1.00 0.00 H new ATOM 0 HD11 ILE A 125 21.308 -10.250 2.924 1.00 0.00 H new ATOM 0 HD12 ILE A 125 22.615 -10.238 1.717 1.00 0.00 H new ATOM 0 HD13 ILE A 125 21.395 -8.942 1.721 1.00 0.00 H new ATOM 728 N ARG A 126 19.567 -10.568 -3.706 1.00 0.00 N ATOM 729 CA ARG A 126 19.770 -10.161 -5.115 1.00 0.00 C ATOM 730 C ARG A 126 19.190 -8.752 -5.326 1.00 0.00 C ATOM 731 O ARG A 126 18.789 -8.094 -4.365 1.00 0.00 O ATOM 732 CB ARG A 126 19.116 -11.192 -6.068 1.00 0.00 C ATOM 733 CG ARG A 126 19.756 -12.595 -6.086 1.00 0.00 C ATOM 734 CD ARG A 126 21.191 -12.620 -6.631 1.00 0.00 C ATOM 735 NE ARG A 126 21.244 -12.247 -8.061 1.00 0.00 N ATOM 736 CZ ARG A 126 22.331 -12.009 -8.773 1.00 0.00 C ATOM 737 NH1 ARG A 126 23.528 -12.079 -8.263 1.00 0.00 N ATOM 738 NH2 ARG A 126 22.233 -11.694 -10.033 1.00 0.00 N ATOM 0 H ARG A 126 18.675 -10.234 -3.342 1.00 0.00 H new ATOM 0 HA ARG A 126 20.836 -10.133 -5.342 1.00 0.00 H new ATOM 0 HB2 ARG A 126 18.066 -11.296 -5.793 1.00 0.00 H new ATOM 0 HB3 ARG A 126 19.142 -10.789 -7.080 1.00 0.00 H new ATOM 0 HG2 ARG A 126 19.756 -12.996 -5.072 1.00 0.00 H new ATOM 0 HG3 ARG A 126 19.137 -13.258 -6.691 1.00 0.00 H new ATOM 0 HD2 ARG A 126 21.811 -11.934 -6.054 1.00 0.00 H new ATOM 0 HD3 ARG A 126 21.612 -13.617 -6.500 1.00 0.00 H new ATOM 0 HE ARG A 126 20.351 -12.165 -8.547 1.00 0.00 H new ATOM 0 HH11 ARG A 126 23.650 -12.325 -7.281 1.00 0.00 H new ATOM 0 HH12 ARG A 126 24.343 -11.888 -8.846 1.00 0.00 H new ATOM 0 HH21 ARG A 126 21.315 -11.630 -10.473 1.00 0.00 H new ATOM 0 HH22 ARG A 126 23.074 -11.511 -10.580 1.00 0.00 H new ATOM 752 N CYS A 127 19.113 -8.283 -6.570 1.00 0.00 N ATOM 753 CA CYS A 127 18.424 -7.042 -6.930 1.00 0.00 C ATOM 754 C CYS A 127 17.447 -7.244 -8.100 1.00 0.00 C ATOM 755 O CYS A 127 17.644 -8.109 -8.957 1.00 0.00 O ATOM 756 CB CYS A 127 19.454 -5.930 -7.195 1.00 0.00 C ATOM 757 SG CYS A 127 20.574 -6.370 -8.560 1.00 0.00 S ATOM 0 H CYS A 127 19.533 -8.760 -7.368 1.00 0.00 H new ATOM 0 HA CYS A 127 17.806 -6.728 -6.088 1.00 0.00 H new ATOM 0 HB2 CYS A 127 18.935 -5.001 -7.433 1.00 0.00 H new ATOM 0 HB3 CYS A 127 20.035 -5.748 -6.291 1.00 0.00 H new ATOM 0 HG CYS A 127 21.424 -5.405 -8.752 1.00 0.00 H new ATOM 763 N LEU A 128 16.391 -6.429 -8.124 1.00 0.00 N ATOM 764 CA LEU A 128 15.266 -6.499 -9.063 1.00 0.00 C ATOM 765 C LEU A 128 14.796 -5.089 -9.462 1.00 0.00 C ATOM 766 O LEU A 128 15.052 -4.103 -8.763 1.00 0.00 O ATOM 767 CB LEU A 128 14.102 -7.271 -8.402 1.00 0.00 C ATOM 768 CG LEU A 128 14.294 -8.788 -8.221 1.00 0.00 C ATOM 769 CD1 LEU A 128 13.088 -9.361 -7.476 1.00 0.00 C ATOM 770 CD2 LEU A 128 14.419 -9.529 -9.554 1.00 0.00 C ATOM 0 H LEU A 128 16.291 -5.664 -7.457 1.00 0.00 H new ATOM 0 HA LEU A 128 15.592 -7.017 -9.965 1.00 0.00 H new ATOM 0 HB2 LEU A 128 13.916 -6.832 -7.422 1.00 0.00 H new ATOM 0 HB3 LEU A 128 13.204 -7.110 -8.999 1.00 0.00 H new ATOM 0 HG LEU A 128 15.220 -8.928 -7.663 1.00 0.00 H new ATOM 0 HD11 LEU A 128 13.218 -10.435 -7.345 1.00 0.00 H new ATOM 0 HD12 LEU A 128 13.003 -8.884 -6.500 1.00 0.00 H new ATOM 0 HD13 LEU A 128 12.182 -9.173 -8.052 1.00 0.00 H new ATOM 0 HD21 LEU A 128 14.553 -10.594 -9.367 1.00 0.00 H new ATOM 0 HD22 LEU A 128 13.515 -9.374 -10.142 1.00 0.00 H new ATOM 0 HD23 LEU A 128 15.279 -9.147 -10.104 1.00 0.00 H new ATOM 782 N LYS A 129 14.081 -5.001 -10.588 1.00 0.00 N ATOM 783 CA LYS A 129 13.415 -3.778 -11.062 1.00 0.00 C ATOM 784 C LYS A 129 12.006 -3.649 -10.473 1.00 0.00 C ATOM 785 O LYS A 129 11.386 -4.640 -10.085 1.00 0.00 O ATOM 786 CB LYS A 129 13.339 -3.806 -12.601 1.00 0.00 C ATOM 787 CG LYS A 129 14.728 -3.722 -13.253 1.00 0.00 C ATOM 788 CD LYS A 129 14.617 -3.657 -14.784 1.00 0.00 C ATOM 789 CE LYS A 129 15.977 -3.427 -15.458 1.00 0.00 C ATOM 790 NZ LYS A 129 16.891 -4.591 -15.314 1.00 0.00 N ATOM 0 H LYS A 129 13.944 -5.796 -11.212 1.00 0.00 H new ATOM 0 HA LYS A 129 13.996 -2.916 -10.733 1.00 0.00 H new ATOM 0 HB2 LYS A 129 12.844 -4.722 -12.922 1.00 0.00 H new ATOM 0 HB3 LYS A 129 12.726 -2.974 -12.948 1.00 0.00 H new ATOM 0 HG2 LYS A 129 15.253 -2.840 -12.886 1.00 0.00 H new ATOM 0 HG3 LYS A 129 15.322 -4.590 -12.965 1.00 0.00 H new ATOM 0 HD2 LYS A 129 14.183 -4.586 -15.154 1.00 0.00 H new ATOM 0 HD3 LYS A 129 13.935 -2.853 -15.063 1.00 0.00 H new ATOM 0 HE2 LYS A 129 15.823 -3.220 -16.517 1.00 0.00 H new ATOM 0 HE3 LYS A 129 16.448 -2.544 -15.025 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 17.794 -4.384 -15.786 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 17.062 -4.775 -14.305 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 16.457 -5.429 -15.750 1.00 0.00 H new ATOM 804 N ARG A 130 11.445 -2.434 -10.508 1.00 0.00 N ATOM 805 CA ARG A 130 10.024 -2.143 -10.204 1.00 0.00 C ATOM 806 C ARG A 130 9.010 -2.941 -11.038 1.00 0.00 C ATOM 807 O ARG A 130 7.875 -3.128 -10.607 1.00 0.00 O ATOM 808 CB ARG A 130 9.750 -0.638 -10.291 1.00 0.00 C ATOM 809 CG ARG A 130 10.256 0.024 -11.579 1.00 0.00 C ATOM 810 CD ARG A 130 9.915 1.514 -11.509 1.00 0.00 C ATOM 811 NE ARG A 130 10.750 2.316 -12.422 1.00 0.00 N ATOM 812 CZ ARG A 130 10.553 2.595 -13.696 1.00 0.00 C ATOM 813 NH1 ARG A 130 9.510 2.183 -14.358 1.00 0.00 N ATOM 814 NH2 ARG A 130 11.435 3.315 -14.324 1.00 0.00 N ATOM 0 H ARG A 130 11.975 -1.598 -10.754 1.00 0.00 H new ATOM 0 HA ARG A 130 9.871 -2.482 -9.179 1.00 0.00 H new ATOM 0 HB2 ARG A 130 8.676 -0.471 -10.209 1.00 0.00 H new ATOM 0 HB3 ARG A 130 10.215 -0.146 -9.437 1.00 0.00 H new ATOM 0 HG2 ARG A 130 11.332 -0.116 -11.683 1.00 0.00 H new ATOM 0 HG3 ARG A 130 9.789 -0.433 -12.451 1.00 0.00 H new ATOM 0 HD2 ARG A 130 8.864 1.657 -11.759 1.00 0.00 H new ATOM 0 HD3 ARG A 130 10.051 1.869 -10.488 1.00 0.00 H new ATOM 0 HE ARG A 130 11.597 2.709 -12.012 1.00 0.00 H new ATOM 0 HH11 ARG A 130 8.800 1.618 -13.892 1.00 0.00 H new ATOM 0 HH12 ARG A 130 9.403 2.425 -15.343 1.00 0.00 H new ATOM 0 HH21 ARG A 130 12.261 3.653 -13.831 1.00 0.00 H new ATOM 0 HH22 ARG A 130 11.300 3.541 -15.309 1.00 0.00 H new ATOM 828 N MET A 131 9.425 -3.466 -12.196 1.00 0.00 N ATOM 829 CA MET A 131 8.656 -4.423 -13.009 1.00 0.00 C ATOM 830 C MET A 131 8.402 -5.775 -12.312 1.00 0.00 C ATOM 831 O MET A 131 7.561 -6.554 -12.767 1.00 0.00 O ATOM 832 CB MET A 131 9.383 -4.669 -14.343 1.00 0.00 C ATOM 833 CG MET A 131 9.562 -3.422 -15.221 1.00 0.00 C ATOM 834 SD MET A 131 8.029 -2.663 -15.839 1.00 0.00 S ATOM 835 CE MET A 131 7.784 -1.342 -14.618 1.00 0.00 C ATOM 0 H MET A 131 10.329 -3.233 -12.607 1.00 0.00 H new ATOM 0 HA MET A 131 7.679 -3.968 -13.171 1.00 0.00 H new ATOM 0 HB2 MET A 131 10.366 -5.091 -14.132 1.00 0.00 H new ATOM 0 HB3 MET A 131 8.829 -5.418 -14.909 1.00 0.00 H new ATOM 0 HG2 MET A 131 10.111 -2.674 -14.649 1.00 0.00 H new ATOM 0 HG3 MET A 131 10.183 -3.689 -16.076 1.00 0.00 H new ATOM 0 HE1 MET A 131 6.771 -0.948 -14.706 1.00 0.00 H new ATOM 0 HE2 MET A 131 7.932 -1.742 -13.615 1.00 0.00 H new ATOM 0 HE3 MET A 131 8.501 -0.542 -14.799 1.00 0.00 H new ATOM 845 N HIS A 132 9.103 -6.056 -11.207 1.00 0.00 N ATOM 846 CA HIS A 132 9.118 -7.356 -10.514 1.00 0.00 C ATOM 847 C HIS A 132 8.824 -7.255 -9.006 1.00 0.00 C ATOM 848 O HIS A 132 8.996 -8.240 -8.285 1.00 0.00 O ATOM 849 CB HIS A 132 10.476 -8.034 -10.775 1.00 0.00 C ATOM 850 CG HIS A 132 10.802 -8.211 -12.239 1.00 0.00 C ATOM 851 ND1 HIS A 132 11.881 -7.624 -12.910 1.00 0.00 N ATOM 852 CD2 HIS A 132 10.073 -8.943 -13.132 1.00 0.00 C ATOM 853 CE1 HIS A 132 11.776 -8.018 -14.190 1.00 0.00 C ATOM 854 NE2 HIS A 132 10.700 -8.810 -14.352 1.00 0.00 N ATOM 0 H HIS A 132 9.697 -5.362 -10.753 1.00 0.00 H new ATOM 0 HA HIS A 132 8.307 -7.961 -10.919 1.00 0.00 H new ATOM 0 HB2 HIS A 132 11.262 -7.442 -10.307 1.00 0.00 H new ATOM 0 HB3 HIS A 132 10.482 -9.011 -10.291 1.00 0.00 H new ATOM 0 HD2 HIS A 132 9.180 -9.514 -12.923 1.00 0.00 H new ATOM 0 HE1 HIS A 132 12.459 -7.738 -14.978 1.00 0.00 H new ATOM 0 HE2 HIS A 132 10.400 -9.238 -15.228 1.00 0.00 H new ATOM 862 N ILE A 133 8.375 -6.087 -8.526 1.00 0.00 N ATOM 863 CA ILE A 133 8.151 -5.775 -7.099 1.00 0.00 C ATOM 864 C ILE A 133 6.827 -5.012 -6.928 1.00 0.00 C ATOM 865 O ILE A 133 6.513 -4.115 -7.716 1.00 0.00 O ATOM 866 CB ILE A 133 9.319 -4.929 -6.521 1.00 0.00 C ATOM 867 CG1 ILE A 133 10.704 -5.575 -6.766 1.00 0.00 C ATOM 868 CG2 ILE A 133 9.119 -4.675 -5.010 1.00 0.00 C ATOM 869 CD1 ILE A 133 11.870 -4.666 -6.371 1.00 0.00 C ATOM 0 H ILE A 133 8.149 -5.303 -9.138 1.00 0.00 H new ATOM 0 HA ILE A 133 8.103 -6.716 -6.552 1.00 0.00 H new ATOM 0 HB ILE A 133 9.303 -3.979 -7.054 1.00 0.00 H new ATOM 0 HG12 ILE A 133 10.769 -6.505 -6.201 1.00 0.00 H new ATOM 0 HG13 ILE A 133 10.795 -5.835 -7.821 1.00 0.00 H new ATOM 0 HG21 ILE A 133 9.949 -4.081 -4.628 1.00 0.00 H new ATOM 0 HG22 ILE A 133 8.185 -4.137 -4.852 1.00 0.00 H new ATOM 0 HG23 ILE A 133 9.082 -5.628 -4.483 1.00 0.00 H new ATOM 0 HD11 ILE A 133 12.813 -5.177 -6.567 1.00 0.00 H new ATOM 0 HD12 ILE A 133 11.828 -3.746 -6.954 1.00 0.00 H new ATOM 0 HD13 ILE A 133 11.801 -4.426 -5.310 1.00 0.00 H new ATOM 881 N LYS A 134 6.075 -5.332 -5.867 1.00 0.00 N ATOM 882 CA LYS A 134 4.844 -4.648 -5.436 1.00 0.00 C ATOM 883 C LYS A 134 4.779 -4.549 -3.907 1.00 0.00 C ATOM 884 O LYS A 134 5.312 -5.399 -3.192 1.00 0.00 O ATOM 885 CB LYS A 134 3.605 -5.411 -5.947 1.00 0.00 C ATOM 886 CG LYS A 134 3.539 -5.533 -7.480 1.00 0.00 C ATOM 887 CD LYS A 134 2.192 -6.066 -7.985 1.00 0.00 C ATOM 888 CE LYS A 134 1.862 -7.456 -7.426 1.00 0.00 C ATOM 889 NZ LYS A 134 0.589 -7.974 -7.989 1.00 0.00 N ATOM 0 H LYS A 134 6.318 -6.111 -5.255 1.00 0.00 H new ATOM 0 HA LYS A 134 4.855 -3.642 -5.855 1.00 0.00 H new ATOM 0 HB2 LYS A 134 3.600 -6.410 -5.512 1.00 0.00 H new ATOM 0 HB3 LYS A 134 2.707 -4.905 -5.593 1.00 0.00 H new ATOM 0 HG2 LYS A 134 3.726 -4.555 -7.924 1.00 0.00 H new ATOM 0 HG3 LYS A 134 4.335 -6.195 -7.820 1.00 0.00 H new ATOM 0 HD2 LYS A 134 1.402 -5.369 -7.706 1.00 0.00 H new ATOM 0 HD3 LYS A 134 2.208 -6.111 -9.074 1.00 0.00 H new ATOM 0 HE2 LYS A 134 2.673 -8.146 -7.659 1.00 0.00 H new ATOM 0 HE3 LYS A 134 1.788 -7.406 -6.340 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 -0.144 -7.970 -7.251 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 0.287 -7.369 -8.779 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 0.731 -8.946 -8.331 1.00 0.00 H new ATOM 903 N ALA A 135 4.086 -3.537 -3.392 1.00 0.00 N ATOM 904 CA ALA A 135 3.752 -3.456 -1.972 1.00 0.00 C ATOM 905 C ALA A 135 2.781 -4.595 -1.596 1.00 0.00 C ATOM 906 O ALA A 135 1.868 -4.917 -2.365 1.00 0.00 O ATOM 907 CB ALA A 135 3.143 -2.077 -1.687 1.00 0.00 C ATOM 0 H ALA A 135 3.741 -2.752 -3.945 1.00 0.00 H new ATOM 0 HA ALA A 135 4.648 -3.574 -1.363 1.00 0.00 H new ATOM 0 HB1 ALA A 135 2.889 -2.003 -0.630 1.00 0.00 H new ATOM 0 HB2 ALA A 135 3.865 -1.301 -1.942 1.00 0.00 H new ATOM 0 HB3 ALA A 135 2.242 -1.946 -2.287 1.00 0.00 H new ATOM 913 N MET A 136 2.963 -5.212 -0.423 1.00 0.00 N ATOM 914 CA MET A 136 2.034 -6.238 0.072 1.00 0.00 C ATOM 915 C MET A 136 0.646 -5.635 0.408 1.00 0.00 C ATOM 916 O MET A 136 0.558 -4.437 0.709 1.00 0.00 O ATOM 917 CB MET A 136 2.667 -7.016 1.238 1.00 0.00 C ATOM 918 CG MET A 136 2.675 -6.291 2.587 1.00 0.00 C ATOM 919 SD MET A 136 3.196 -7.306 4.005 1.00 0.00 S ATOM 920 CE MET A 136 4.660 -8.149 3.341 1.00 0.00 C ATOM 0 H MET A 136 3.745 -5.020 0.203 1.00 0.00 H new ATOM 0 HA MET A 136 1.850 -6.961 -0.722 1.00 0.00 H new ATOM 0 HB2 MET A 136 2.133 -7.959 1.355 1.00 0.00 H new ATOM 0 HB3 MET A 136 3.695 -7.263 0.972 1.00 0.00 H new ATOM 0 HG2 MET A 136 3.337 -5.428 2.515 1.00 0.00 H new ATOM 0 HG3 MET A 136 1.673 -5.908 2.782 1.00 0.00 H new ATOM 0 HE1 MET A 136 5.211 -8.618 4.156 1.00 0.00 H new ATOM 0 HE2 MET A 136 4.348 -8.912 2.628 1.00 0.00 H new ATOM 0 HE3 MET A 136 5.301 -7.424 2.840 1.00 0.00 H new ATOM 930 N PRO A 137 -0.444 -6.426 0.356 1.00 0.00 N ATOM 931 CA PRO A 137 -1.804 -5.932 0.576 1.00 0.00 C ATOM 932 C PRO A 137 -2.074 -5.519 2.034 1.00 0.00 C ATOM 933 O PRO A 137 -1.336 -5.869 2.958 1.00 0.00 O ATOM 934 CB PRO A 137 -2.725 -7.069 0.115 1.00 0.00 C ATOM 935 CG PRO A 137 -1.883 -8.325 0.320 1.00 0.00 C ATOM 936 CD PRO A 137 -0.464 -7.842 0.026 1.00 0.00 C ATOM 0 HA PRO A 137 -1.978 -5.014 0.014 1.00 0.00 H new ATOM 0 HB2 PRO A 137 -3.643 -7.103 0.701 1.00 0.00 H new ATOM 0 HB3 PRO A 137 -3.017 -6.949 -0.928 1.00 0.00 H new ATOM 0 HG2 PRO A 137 -1.975 -8.711 1.335 1.00 0.00 H new ATOM 0 HG3 PRO A 137 -2.184 -9.127 -0.354 1.00 0.00 H new ATOM 0 HD2 PRO A 137 0.266 -8.391 0.621 1.00 0.00 H new ATOM 0 HD3 PRO A 137 -0.207 -8.002 -1.021 1.00 0.00 H new ATOM 944 N GLU A 138 -3.169 -4.783 2.236 1.00 0.00 N ATOM 945 CA GLU A 138 -3.702 -4.357 3.530 1.00 0.00 C ATOM 946 C GLU A 138 -3.948 -5.563 4.451 1.00 0.00 C ATOM 947 O GLU A 138 -4.838 -6.385 4.223 1.00 0.00 O ATOM 948 CB GLU A 138 -4.975 -3.524 3.306 1.00 0.00 C ATOM 949 CG GLU A 138 -5.515 -2.920 4.609 1.00 0.00 C ATOM 950 CD GLU A 138 -6.728 -2.013 4.336 1.00 0.00 C ATOM 951 OE1 GLU A 138 -7.877 -2.520 4.287 1.00 0.00 O ATOM 952 OE2 GLU A 138 -6.546 -0.782 4.170 1.00 0.00 O ATOM 0 H GLU A 138 -3.738 -4.450 1.458 1.00 0.00 H new ATOM 0 HA GLU A 138 -2.969 -3.729 4.037 1.00 0.00 H new ATOM 0 HB2 GLU A 138 -4.762 -2.723 2.598 1.00 0.00 H new ATOM 0 HB3 GLU A 138 -5.743 -4.153 2.854 1.00 0.00 H new ATOM 0 HG2 GLU A 138 -5.801 -3.719 5.293 1.00 0.00 H new ATOM 0 HG3 GLU A 138 -4.730 -2.345 5.100 1.00 0.00 H new ATOM 959 N ASP A 139 -3.121 -5.646 5.491 1.00 0.00 N ATOM 960 CA ASP A 139 -3.056 -6.746 6.469 1.00 0.00 C ATOM 961 C ASP A 139 -2.895 -8.134 5.807 1.00 0.00 C ATOM 962 O ASP A 139 -3.708 -9.046 6.000 1.00 0.00 O ATOM 963 CB ASP A 139 -4.223 -6.663 7.473 1.00 0.00 C ATOM 964 CG ASP A 139 -4.225 -5.350 8.273 1.00 0.00 C ATOM 965 OD1 ASP A 139 -3.258 -5.099 9.031 1.00 0.00 O ATOM 966 OD2 ASP A 139 -5.210 -4.577 8.178 1.00 0.00 O ATOM 0 H ASP A 139 -2.440 -4.913 5.690 1.00 0.00 H new ATOM 0 HA ASP A 139 -2.141 -6.618 7.048 1.00 0.00 H new ATOM 0 HB2 ASP A 139 -5.167 -6.758 6.936 1.00 0.00 H new ATOM 0 HB3 ASP A 139 -4.163 -7.504 8.163 1.00 0.00 H new ATOM 971 N ALA A 140 -1.842 -8.276 4.991 1.00 0.00 N ATOM 972 CA ALA A 140 -1.446 -9.513 4.306 1.00 0.00 C ATOM 973 C ALA A 140 -1.375 -10.758 5.224 1.00 0.00 C ATOM 974 O ALA A 140 -1.130 -10.658 6.432 1.00 0.00 O ATOM 975 CB ALA A 140 -0.094 -9.261 3.620 1.00 0.00 C ATOM 0 H ALA A 140 -1.216 -7.498 4.781 1.00 0.00 H new ATOM 0 HA ALA A 140 -2.223 -9.753 3.580 1.00 0.00 H new ATOM 0 HB1 ALA A 140 0.225 -10.165 3.102 1.00 0.00 H new ATOM 0 HB2 ALA A 140 -0.197 -8.448 2.901 1.00 0.00 H new ATOM 0 HB3 ALA A 140 0.650 -8.991 4.370 1.00 0.00 H new ATOM 981 N LYS A 141 -1.559 -11.949 4.632 1.00 0.00 N ATOM 982 CA LYS A 141 -1.615 -13.249 5.337 1.00 0.00 C ATOM 983 C LYS A 141 -0.320 -13.610 6.082 1.00 0.00 C ATOM 984 O LYS A 141 -0.383 -14.212 7.156 1.00 0.00 O ATOM 985 CB LYS A 141 -2.033 -14.333 4.320 1.00 0.00 C ATOM 986 CG LYS A 141 -2.363 -15.708 4.938 1.00 0.00 C ATOM 987 CD LYS A 141 -1.195 -16.713 5.000 1.00 0.00 C ATOM 988 CE LYS A 141 -0.667 -17.164 3.628 1.00 0.00 C ATOM 989 NZ LYS A 141 -1.662 -17.978 2.879 1.00 0.00 N ATOM 0 H LYS A 141 -1.677 -12.042 3.623 1.00 0.00 H new ATOM 0 HA LYS A 141 -2.359 -13.178 6.130 1.00 0.00 H new ATOM 0 HB2 LYS A 141 -2.905 -13.979 3.771 1.00 0.00 H new ATOM 0 HB3 LYS A 141 -1.229 -14.460 3.595 1.00 0.00 H new ATOM 0 HG2 LYS A 141 -2.736 -15.550 5.950 1.00 0.00 H new ATOM 0 HG3 LYS A 141 -3.174 -16.157 4.365 1.00 0.00 H new ATOM 0 HD2 LYS A 141 -0.375 -16.264 5.561 1.00 0.00 H new ATOM 0 HD3 LYS A 141 -1.518 -17.592 5.557 1.00 0.00 H new ATOM 0 HE2 LYS A 141 -0.400 -16.287 3.038 1.00 0.00 H new ATOM 0 HE3 LYS A 141 0.245 -17.745 3.765 1.00 0.00 H new ATOM 0 HZ1 LYS A 141 -1.261 -18.258 1.961 1.00 0.00 H new ATOM 0 HZ2 LYS A 141 -1.898 -18.829 3.428 1.00 0.00 H new ATOM 0 HZ3 LYS A 141 -2.523 -17.416 2.723 1.00 0.00 H new ATOM 1003 N GLY A 142 0.842 -13.249 5.530 1.00 0.00 N ATOM 1004 CA GLY A 142 2.156 -13.508 6.135 1.00 0.00 C ATOM 1005 C GLY A 142 2.417 -12.710 7.422 1.00 0.00 C ATOM 1006 O GLY A 142 1.788 -11.678 7.673 1.00 0.00 O ATOM 0 H GLY A 142 0.899 -12.761 4.636 1.00 0.00 H new ATOM 0 HA2 GLY A 142 2.240 -14.572 6.356 1.00 0.00 H new ATOM 0 HA3 GLY A 142 2.933 -13.271 5.408 1.00 0.00 H new ATOM 1010 N GLN A 143 3.364 -13.181 8.238 1.00 0.00 N ATOM 1011 CA GLN A 143 3.772 -12.520 9.487 1.00 0.00 C ATOM 1012 C GLN A 143 4.387 -11.130 9.216 1.00 0.00 C ATOM 1013 O GLN A 143 5.133 -10.949 8.251 1.00 0.00 O ATOM 1014 CB GLN A 143 4.754 -13.423 10.256 1.00 0.00 C ATOM 1015 CG GLN A 143 4.190 -14.801 10.656 1.00 0.00 C ATOM 1016 CD GLN A 143 3.026 -14.732 11.647 1.00 0.00 C ATOM 1017 OE1 GLN A 143 1.895 -14.405 11.311 1.00 0.00 O ATOM 1018 NE2 GLN A 143 3.245 -15.046 12.909 1.00 0.00 N ATOM 0 H GLN A 143 3.877 -14.042 8.050 1.00 0.00 H new ATOM 0 HA GLN A 143 2.885 -12.362 10.101 1.00 0.00 H new ATOM 0 HB2 GLN A 143 5.642 -13.574 9.643 1.00 0.00 H new ATOM 0 HB3 GLN A 143 5.074 -12.902 11.158 1.00 0.00 H new ATOM 0 HG2 GLN A 143 3.859 -15.322 9.757 1.00 0.00 H new ATOM 0 HG3 GLN A 143 4.991 -15.397 11.093 1.00 0.00 H new ATOM 0 HE21 GLN A 143 4.179 -15.321 13.211 1.00 0.00 H new ATOM 0 HE22 GLN A 143 2.480 -15.014 13.583 1.00 0.00 H new ATOM 1027 N ASP A 144 4.081 -10.152 10.075 1.00 0.00 N ATOM 1028 CA ASP A 144 4.367 -8.722 9.855 1.00 0.00 C ATOM 1029 C ASP A 144 4.638 -7.931 11.159 1.00 0.00 C ATOM 1030 O ASP A 144 4.227 -6.778 11.305 1.00 0.00 O ATOM 1031 CB ASP A 144 3.228 -8.101 9.016 1.00 0.00 C ATOM 1032 CG ASP A 144 1.892 -7.909 9.766 1.00 0.00 C ATOM 1033 OD1 ASP A 144 1.538 -8.720 10.657 1.00 0.00 O ATOM 1034 OD2 ASP A 144 1.158 -6.946 9.427 1.00 0.00 O ATOM 0 H ASP A 144 3.616 -10.332 10.965 1.00 0.00 H new ATOM 0 HA ASP A 144 5.303 -8.651 9.301 1.00 0.00 H new ATOM 0 HB2 ASP A 144 3.560 -7.132 8.642 1.00 0.00 H new ATOM 0 HB3 ASP A 144 3.051 -8.734 8.147 1.00 0.00 H new ATOM 1039 N TRP A 145 5.307 -8.567 12.130 1.00 0.00 N ATOM 1040 CA TRP A 145 5.607 -8.065 13.487 1.00 0.00 C ATOM 1041 C TRP A 145 6.630 -6.901 13.559 1.00 0.00 C ATOM 1042 O TRP A 145 7.553 -6.917 14.380 1.00 0.00 O ATOM 1043 CB TRP A 145 6.012 -9.255 14.377 1.00 0.00 C ATOM 1044 CG TRP A 145 4.981 -10.335 14.513 1.00 0.00 C ATOM 1045 CD1 TRP A 145 4.913 -11.456 13.759 1.00 0.00 C ATOM 1046 CD2 TRP A 145 3.870 -10.427 15.462 1.00 0.00 C ATOM 1047 NE1 TRP A 145 3.826 -12.214 14.147 1.00 0.00 N ATOM 1048 CE2 TRP A 145 3.147 -11.630 15.196 1.00 0.00 C ATOM 1049 CE3 TRP A 145 3.407 -9.626 16.531 1.00 0.00 C ATOM 1050 CZ2 TRP A 145 2.017 -12.007 15.937 1.00 0.00 C ATOM 1051 CZ3 TRP A 145 2.274 -9.995 17.282 1.00 0.00 C ATOM 1052 CH2 TRP A 145 1.578 -11.181 16.986 1.00 0.00 C ATOM 0 H TRP A 145 5.679 -9.506 11.984 1.00 0.00 H new ATOM 0 HA TRP A 145 4.692 -7.605 13.861 1.00 0.00 H new ATOM 0 HB2 TRP A 145 6.924 -9.695 13.973 1.00 0.00 H new ATOM 0 HB3 TRP A 145 6.253 -8.878 15.371 1.00 0.00 H new ATOM 0 HD1 TRP A 145 5.605 -11.719 12.972 1.00 0.00 H new ATOM 0 HE1 TRP A 145 3.558 -13.097 13.712 1.00 0.00 H new ATOM 0 HE3 TRP A 145 3.932 -8.714 16.776 1.00 0.00 H new ATOM 0 HZ2 TRP A 145 1.491 -12.921 15.704 1.00 0.00 H new ATOM 0 HZ3 TRP A 145 1.937 -9.363 18.091 1.00 0.00 H new ATOM 0 HH2 TRP A 145 0.708 -11.456 17.564 1.00 0.00 H new ATOM 1063 N ILE A 146 6.475 -5.878 12.713 1.00 0.00 N ATOM 1064 CA ILE A 146 7.278 -4.654 12.655 1.00 0.00 C ATOM 1065 C ILE A 146 6.383 -3.404 12.707 1.00 0.00 C ATOM 1066 O ILE A 146 5.203 -3.447 12.355 1.00 0.00 O ATOM 1067 CB ILE A 146 8.220 -4.665 11.434 1.00 0.00 C ATOM 1068 CG1 ILE A 146 7.556 -4.849 10.053 1.00 0.00 C ATOM 1069 CG2 ILE A 146 9.292 -5.757 11.622 1.00 0.00 C ATOM 1070 CD1 ILE A 146 6.958 -3.576 9.440 1.00 0.00 C ATOM 0 H ILE A 146 5.739 -5.884 12.007 1.00 0.00 H new ATOM 0 HA ILE A 146 7.916 -4.617 13.538 1.00 0.00 H new ATOM 0 HB ILE A 146 8.643 -3.661 11.411 1.00 0.00 H new ATOM 0 HG12 ILE A 146 8.297 -5.252 9.362 1.00 0.00 H new ATOM 0 HG13 ILE A 146 6.766 -5.595 10.144 1.00 0.00 H new ATOM 0 HG21 ILE A 146 9.958 -5.765 10.759 1.00 0.00 H new ATOM 0 HG22 ILE A 146 9.868 -5.550 12.524 1.00 0.00 H new ATOM 0 HG23 ILE A 146 8.808 -6.729 11.716 1.00 0.00 H new ATOM 0 HD11 ILE A 146 6.516 -3.811 8.472 1.00 0.00 H new ATOM 0 HD12 ILE A 146 6.189 -3.179 10.103 1.00 0.00 H new ATOM 0 HD13 ILE A 146 7.743 -2.832 9.309 1.00 0.00 H new ATOM 1082 N ALA A 147 6.951 -2.285 13.171 1.00 0.00 N ATOM 1083 CA ALA A 147 6.275 -0.995 13.389 1.00 0.00 C ATOM 1084 C ALA A 147 4.964 -1.047 14.223 1.00 0.00 C ATOM 1085 O ALA A 147 4.128 -0.143 14.134 1.00 0.00 O ATOM 1086 CB ALA A 147 6.119 -0.293 12.029 1.00 0.00 C ATOM 0 H ALA A 147 7.940 -2.250 13.417 1.00 0.00 H new ATOM 0 HA ALA A 147 6.914 -0.399 14.041 1.00 0.00 H new ATOM 0 HB1 ALA A 147 5.620 0.666 12.170 1.00 0.00 H new ATOM 0 HB2 ALA A 147 7.103 -0.129 11.589 1.00 0.00 H new ATOM 0 HB3 ALA A 147 5.524 -0.918 11.363 1.00 0.00 H new ATOM 1092 N LEU A 148 4.777 -2.079 15.061 1.00 0.00 N ATOM 1093 CA LEU A 148 3.592 -2.294 15.916 1.00 0.00 C ATOM 1094 C LEU A 148 3.605 -1.449 17.216 1.00 0.00 C ATOM 1095 O LEU A 148 3.111 -1.884 18.262 1.00 0.00 O ATOM 1096 CB LEU A 148 3.434 -3.806 16.202 1.00 0.00 C ATOM 1097 CG LEU A 148 3.217 -4.716 14.977 1.00 0.00 C ATOM 1098 CD1 LEU A 148 2.934 -6.138 15.461 1.00 0.00 C ATOM 1099 CD2 LEU A 148 2.047 -4.277 14.094 1.00 0.00 C ATOM 0 H LEU A 148 5.473 -2.817 15.168 1.00 0.00 H new ATOM 0 HA LEU A 148 2.719 -1.940 15.368 1.00 0.00 H new ATOM 0 HB2 LEU A 148 4.324 -4.149 16.729 1.00 0.00 H new ATOM 0 HB3 LEU A 148 2.591 -3.939 16.880 1.00 0.00 H new ATOM 0 HG LEU A 148 4.125 -4.656 14.377 1.00 0.00 H new ATOM 0 HD11 LEU A 148 2.779 -6.791 14.602 1.00 0.00 H new ATOM 0 HD12 LEU A 148 3.782 -6.500 16.043 1.00 0.00 H new ATOM 0 HD13 LEU A 148 2.039 -6.139 16.084 1.00 0.00 H new ATOM 0 HD21 LEU A 148 1.951 -4.961 13.251 1.00 0.00 H new ATOM 0 HD22 LEU A 148 1.126 -4.289 14.677 1.00 0.00 H new ATOM 0 HD23 LEU A 148 2.229 -3.268 13.724 1.00 0.00 H new ATOM 1111 N VAL A 149 4.186 -0.244 17.172 1.00 0.00 N ATOM 1112 CA VAL A 149 4.354 0.680 18.312 1.00 0.00 C ATOM 1113 C VAL A 149 4.021 2.111 17.869 1.00 0.00 C ATOM 1114 O VAL A 149 4.422 2.542 16.783 1.00 0.00 O ATOM 1115 CB VAL A 149 5.794 0.611 18.875 1.00 0.00 C ATOM 1116 CG1 VAL A 149 5.957 1.485 20.127 1.00 0.00 C ATOM 1117 CG2 VAL A 149 6.203 -0.816 19.269 1.00 0.00 C ATOM 0 H VAL A 149 4.570 0.135 16.306 1.00 0.00 H new ATOM 0 HA VAL A 149 3.670 0.381 19.106 1.00 0.00 H new ATOM 0 HB VAL A 149 6.431 0.971 18.067 1.00 0.00 H new ATOM 0 HG11 VAL A 149 6.981 1.410 20.492 1.00 0.00 H new ATOM 0 HG12 VAL A 149 5.736 2.523 19.878 1.00 0.00 H new ATOM 0 HG13 VAL A 149 5.270 1.144 20.901 1.00 0.00 H new ATOM 0 HG21 VAL A 149 7.221 -0.808 19.658 1.00 0.00 H new ATOM 0 HG22 VAL A 149 5.525 -1.190 20.036 1.00 0.00 H new ATOM 0 HG23 VAL A 149 6.154 -1.463 18.394 1.00 0.00 H new ATOM 1127 N LYS A 150 3.277 2.849 18.705 1.00 0.00 N ATOM 1128 CA LYS A 150 2.844 4.239 18.460 1.00 0.00 C ATOM 1129 C LYS A 150 4.041 5.184 18.223 1.00 0.00 C ATOM 1130 O LYS A 150 5.041 5.114 18.943 1.00 0.00 O ATOM 1131 CB LYS A 150 1.934 4.672 19.629 1.00 0.00 C ATOM 1132 CG LYS A 150 1.223 6.020 19.423 1.00 0.00 C ATOM 1133 CD LYS A 150 2.014 7.205 19.994 1.00 0.00 C ATOM 1134 CE LYS A 150 1.406 8.532 19.528 1.00 0.00 C ATOM 1135 NZ LYS A 150 2.342 9.655 19.773 1.00 0.00 N ATOM 0 H LYS A 150 2.948 2.487 19.600 1.00 0.00 H new ATOM 0 HA LYS A 150 2.269 4.297 17.536 1.00 0.00 H new ATOM 0 HB2 LYS A 150 1.181 3.900 19.791 1.00 0.00 H new ATOM 0 HB3 LYS A 150 2.534 4.728 20.537 1.00 0.00 H new ATOM 0 HG2 LYS A 150 1.058 6.179 18.357 1.00 0.00 H new ATOM 0 HG3 LYS A 150 0.241 5.983 19.895 1.00 0.00 H new ATOM 0 HD2 LYS A 150 2.012 7.160 21.083 1.00 0.00 H new ATOM 0 HD3 LYS A 150 3.054 7.143 19.674 1.00 0.00 H new ATOM 0 HE2 LYS A 150 1.169 8.475 18.466 1.00 0.00 H new ATOM 0 HE3 LYS A 150 0.469 8.712 20.054 1.00 0.00 H new ATOM 0 HZ1 LYS A 150 1.971 10.519 19.330 1.00 0.00 H new ATOM 0 HZ2 LYS A 150 2.442 9.806 20.797 1.00 0.00 H new ATOM 0 HZ3 LYS A 150 3.271 9.428 19.364 1.00 0.00 H new ATOM 1149 N ALA A 151 3.922 6.060 17.218 1.00 0.00 N ATOM 1150 CA ALA A 151 4.955 7.005 16.758 1.00 0.00 C ATOM 1151 C ALA A 151 5.424 8.013 17.833 1.00 0.00 C ATOM 1152 O ALA A 151 6.638 8.035 18.140 1.00 0.00 O ATOM 1153 CB ALA A 151 4.434 7.709 15.495 1.00 0.00 C ATOM 1154 OXT ALA A 151 4.589 8.804 18.335 1.00 0.00 O ATOM 0 H ALA A 151 3.062 6.135 16.675 1.00 0.00 H new ATOM 0 HA ALA A 151 5.855 6.433 16.531 1.00 0.00 H new ATOM 0 HB1 ALA A 151 5.184 8.414 15.136 1.00 0.00 H new ATOM 0 HB2 ALA A 151 4.234 6.968 14.721 1.00 0.00 H new ATOM 0 HB3 ALA A 151 3.515 8.245 15.730 1.00 0.00 H new TER 1160 ALA A 151