ATOM 1 N GLY A 0 21.874 11.817 4.386 1.00 0.00 N ATOM 2 CA GLY A 0 22.384 10.523 3.943 1.00 0.00 C ATOM 3 C GLY A 0 22.049 10.306 2.500 1.00 0.00 C ATOM 4 O GLY A 0 22.586 11.003 1.651 1.00 0.00 O ATOM 5 H1 GLY A 0 22.131 12.563 3.712 1.00 0.00 H ATOM 6 H2 GLY A 0 20.830 11.700 4.367 1.00 0.00 H ATOM 7 H3 GLY A 0 22.133 12.047 5.361 1.00 0.00 H ATOM 8 HA2 GLY A 0 23.457 10.499 4.061 1.00 0.00 H ATOM 9 HA3 GLY A 0 21.937 9.741 4.539 1.00 0.00 H ATOM 10 N MET A 1 21.121 9.400 2.231 1.00 0.00 N ATOM 11 CA MET A 1 20.725 9.047 0.853 1.00 0.00 C ATOM 12 C MET A 1 19.565 8.051 0.842 1.00 0.00 C ATOM 13 O MET A 1 19.124 7.630 -0.212 1.00 0.00 O ATOM 14 CB MET A 1 21.907 8.449 0.049 1.00 0.00 C ATOM 15 CG MET A 1 22.460 7.140 0.611 1.00 0.00 C ATOM 16 SD MET A 1 23.809 6.454 -0.380 1.00 0.00 S ATOM 17 CE MET A 1 25.018 7.777 -0.310 1.00 0.00 C ATOM 18 H MET A 1 20.642 8.996 2.994 1.00 0.00 H ATOM 19 HA MET A 1 20.401 9.956 0.367 1.00 0.00 H ATOM 20 HB2 MET A 1 21.580 8.269 -0.965 1.00 0.00 H ATOM 21 HB3 MET A 1 22.704 9.177 0.033 1.00 0.00 H ATOM 22 HG2 MET A 1 22.826 7.320 1.611 1.00 0.00 H ATOM 23 HG3 MET A 1 21.657 6.419 0.652 1.00 0.00 H ATOM 24 HE1 MET A 1 25.281 7.971 0.718 1.00 0.00 H ATOM 25 HE2 MET A 1 25.901 7.482 -0.858 1.00 0.00 H ATOM 26 HE3 MET A 1 24.606 8.671 -0.755 1.00 0.00 H ATOM 27 N ALA A 2 19.063 7.695 2.006 1.00 0.00 N ATOM 28 CA ALA A 2 18.014 6.702 2.099 1.00 0.00 C ATOM 29 C ALA A 2 16.841 7.282 2.852 1.00 0.00 C ATOM 30 O ALA A 2 15.944 6.561 3.307 1.00 0.00 O ATOM 31 CB ALA A 2 18.538 5.455 2.800 1.00 0.00 C ATOM 32 H ALA A 2 19.342 8.113 2.855 1.00 0.00 H ATOM 33 HA ALA A 2 17.703 6.436 1.099 1.00 0.00 H ATOM 34 HB1 ALA A 2 18.857 5.711 3.799 1.00 0.00 H ATOM 35 HB2 ALA A 2 17.755 4.713 2.852 1.00 0.00 H ATOM 36 HB3 ALA A 2 19.376 5.056 2.246 1.00 0.00 H ATOM 37 N GLU A 3 16.847 8.581 2.983 1.00 0.00 N ATOM 38 CA GLU A 3 15.809 9.272 3.680 1.00 0.00 C ATOM 39 C GLU A 3 14.855 9.863 2.656 1.00 0.00 C ATOM 40 O GLU A 3 14.982 11.016 2.257 1.00 0.00 O ATOM 41 CB GLU A 3 16.357 10.383 4.606 1.00 0.00 C ATOM 42 CG GLU A 3 17.552 9.990 5.492 1.00 0.00 C ATOM 43 CD GLU A 3 18.885 10.056 4.758 1.00 0.00 C ATOM 44 OE1 GLU A 3 19.424 11.162 4.605 1.00 0.00 O ATOM 45 OE2 GLU A 3 19.432 9.005 4.324 1.00 0.00 O1- ATOM 46 H GLU A 3 17.580 9.095 2.586 1.00 0.00 H ATOM 47 HA GLU A 3 15.273 8.544 4.271 1.00 0.00 H ATOM 48 HB2 GLU A 3 16.669 11.214 3.990 1.00 0.00 H ATOM 49 HB3 GLU A 3 15.555 10.716 5.248 1.00 0.00 H ATOM 50 HG2 GLU A 3 17.596 10.659 6.338 1.00 0.00 H ATOM 51 HG3 GLU A 3 17.400 8.979 5.843 1.00 0.00 H ATOM 52 N VAL A 4 13.970 9.040 2.175 1.00 0.00 N ATOM 53 CA VAL A 4 13.018 9.429 1.172 1.00 0.00 C ATOM 54 C VAL A 4 11.823 8.497 1.301 1.00 0.00 C ATOM 55 O VAL A 4 11.936 7.451 1.931 1.00 0.00 O ATOM 56 CB VAL A 4 13.664 9.339 -0.261 1.00 0.00 C ATOM 57 CG1 VAL A 4 14.069 7.914 -0.619 1.00 0.00 C ATOM 58 CG2 VAL A 4 12.771 9.951 -1.342 1.00 0.00 C ATOM 59 H VAL A 4 13.927 8.112 2.489 1.00 0.00 H ATOM 60 HA VAL A 4 12.708 10.445 1.369 1.00 0.00 H ATOM 61 HB VAL A 4 14.580 9.911 -0.217 1.00 0.00 H ATOM 62 HG11 VAL A 4 13.196 7.279 -0.602 1.00 0.00 H ATOM 63 HG12 VAL A 4 14.508 7.899 -1.607 1.00 0.00 H ATOM 64 HG13 VAL A 4 14.791 7.555 0.101 1.00 0.00 H ATOM 65 HG21 VAL A 4 12.594 10.993 -1.116 1.00 0.00 H ATOM 66 HG22 VAL A 4 13.259 9.868 -2.302 1.00 0.00 H ATOM 67 HG23 VAL A 4 11.829 9.424 -1.369 1.00 0.00 H ATOM 68 N GLU A 5 10.693 8.880 0.774 1.00 0.00 N ATOM 69 CA GLU A 5 9.530 8.046 0.849 1.00 0.00 C ATOM 70 C GLU A 5 9.424 7.167 -0.381 1.00 0.00 C ATOM 71 O GLU A 5 9.646 7.615 -1.509 1.00 0.00 O ATOM 72 CB GLU A 5 8.241 8.868 0.984 1.00 0.00 C ATOM 73 CG GLU A 5 7.996 9.853 -0.151 1.00 0.00 C ATOM 74 CD GLU A 5 6.537 10.197 -0.302 1.00 0.00 C ATOM 75 OE1 GLU A 5 6.005 10.936 0.519 1.00 0.00 O1- ATOM 76 OE2 GLU A 5 5.892 9.685 -1.248 1.00 0.00 O ATOM 77 H GLU A 5 10.634 9.733 0.299 1.00 0.00 H ATOM 78 HA GLU A 5 9.628 7.416 1.719 1.00 0.00 H ATOM 79 HB2 GLU A 5 7.403 8.189 1.021 1.00 0.00 H ATOM 80 HB3 GLU A 5 8.279 9.421 1.911 1.00 0.00 H ATOM 81 HG2 GLU A 5 8.547 10.760 0.048 1.00 0.00 H ATOM 82 HG3 GLU A 5 8.352 9.410 -1.069 1.00 0.00 H ATOM 83 N TYR A 6 9.129 5.933 -0.170 1.00 0.00 N ATOM 84 CA TYR A 6 8.827 5.051 -1.229 1.00 0.00 C ATOM 85 C TYR A 6 7.448 4.530 -1.088 1.00 0.00 C ATOM 86 O TYR A 6 7.175 3.540 -0.417 1.00 0.00 O ATOM 87 CB TYR A 6 9.864 3.985 -1.449 1.00 0.00 C ATOM 88 CG TYR A 6 10.959 4.470 -2.347 1.00 0.00 C ATOM 89 CD1 TYR A 6 10.689 4.716 -3.689 1.00 0.00 C ATOM 90 CD2 TYR A 6 12.249 4.663 -1.889 1.00 0.00 C ATOM 91 CE1 TYR A 6 11.676 5.133 -4.548 1.00 0.00 C ATOM 92 CE2 TYR A 6 13.244 5.093 -2.746 1.00 0.00 C ATOM 93 CZ TYR A 6 12.950 5.322 -4.074 1.00 0.00 C ATOM 94 OH TYR A 6 13.940 5.706 -4.936 1.00 0.00 O ATOM 95 H TYR A 6 9.110 5.581 0.753 1.00 0.00 H ATOM 96 HA TYR A 6 8.802 5.689 -2.102 1.00 0.00 H ATOM 97 HB2 TYR A 6 10.296 3.702 -0.500 1.00 0.00 H ATOM 98 HB3 TYR A 6 9.408 3.122 -1.913 1.00 0.00 H ATOM 99 HD1 TYR A 6 9.677 4.576 -4.046 1.00 0.00 H ATOM 100 HD2 TYR A 6 12.478 4.484 -0.849 1.00 0.00 H ATOM 101 HE1 TYR A 6 11.450 5.320 -5.588 1.00 0.00 H ATOM 102 HE2 TYR A 6 14.250 5.242 -2.379 1.00 0.00 H ATOM 103 HH TYR A 6 14.660 5.049 -4.879 1.00 0.00 H ATOM 104 N ARG A 7 6.582 5.257 -1.682 1.00 0.00 N ATOM 105 CA ARG A 7 5.187 5.054 -1.604 1.00 0.00 C ATOM 106 C ARG A 7 4.754 4.039 -2.654 1.00 0.00 C ATOM 107 O ARG A 7 5.092 4.168 -3.826 1.00 0.00 O ATOM 108 CB ARG A 7 4.558 6.424 -1.832 1.00 0.00 C ATOM 109 CG ARG A 7 3.073 6.542 -1.546 1.00 0.00 C ATOM 110 CD ARG A 7 2.630 8.016 -1.559 1.00 0.00 C ATOM 111 NE ARG A 7 3.395 8.823 -0.584 1.00 0.00 N ATOM 112 CZ ARG A 7 3.088 8.970 0.719 1.00 0.00 C ATOM 113 NH1 ARG A 7 1.960 8.460 1.207 1.00 0.00 N1+ ATOM 114 NH2 ARG A 7 3.889 9.652 1.517 1.00 0.00 N ATOM 115 H ARG A 7 6.901 6.009 -2.224 1.00 0.00 H ATOM 116 HA ARG A 7 4.911 4.710 -0.622 1.00 0.00 H ATOM 117 HB2 ARG A 7 5.091 7.132 -1.215 1.00 0.00 H ATOM 118 HB3 ARG A 7 4.745 6.677 -2.865 1.00 0.00 H ATOM 119 HG2 ARG A 7 2.521 5.998 -2.297 1.00 0.00 H ATOM 120 HG3 ARG A 7 2.868 6.125 -0.571 1.00 0.00 H ATOM 121 HD2 ARG A 7 2.787 8.418 -2.549 1.00 0.00 H ATOM 122 HD3 ARG A 7 1.580 8.069 -1.312 1.00 0.00 H ATOM 123 HE ARG A 7 4.229 9.245 -0.924 1.00 0.00 H ATOM 124 HH11 ARG A 7 1.300 7.973 0.640 1.00 0.00 H ATOM 125 HH12 ARG A 7 1.743 8.477 2.198 1.00 0.00 H ATOM 126 HH21 ARG A 7 4.731 10.104 1.176 1.00 0.00 H ATOM 127 HH22 ARG A 7 3.719 9.683 2.508 1.00 0.00 H ATOM 128 N CYS A 8 4.081 3.009 -2.229 1.00 0.00 N ATOM 129 CA CYS A 8 3.552 2.029 -3.141 1.00 0.00 C ATOM 130 C CYS A 8 2.050 2.154 -3.167 1.00 0.00 C ATOM 131 O CYS A 8 1.440 2.449 -2.146 1.00 0.00 O ATOM 132 CB CYS A 8 3.998 0.604 -2.769 1.00 0.00 C ATOM 133 SG CYS A 8 3.523 0.041 -1.126 1.00 0.00 S ATOM 134 H CYS A 8 3.921 2.886 -1.266 1.00 0.00 H ATOM 135 HA CYS A 8 3.926 2.277 -4.124 1.00 0.00 H ATOM 136 HB2 CYS A 8 3.582 -0.099 -3.474 1.00 0.00 H ATOM 137 HB3 CYS A 8 5.074 0.575 -2.819 1.00 0.00 H ATOM 138 HG CYS A 8 3.890 0.983 -0.266 1.00 0.00 H ATOM 139 N PHE A 9 1.479 1.966 -4.311 1.00 0.00 N ATOM 140 CA PHE A 9 0.066 2.105 -4.517 1.00 0.00 C ATOM 141 C PHE A 9 -0.550 0.729 -4.409 1.00 0.00 C ATOM 142 O PHE A 9 -0.039 -0.227 -5.002 1.00 0.00 O ATOM 143 CB PHE A 9 -0.169 2.687 -5.925 1.00 0.00 C ATOM 144 CG PHE A 9 -1.602 2.951 -6.304 1.00 0.00 C ATOM 145 CD1 PHE A 9 -2.179 4.179 -6.050 1.00 0.00 C ATOM 146 CD2 PHE A 9 -2.359 1.980 -6.941 1.00 0.00 C ATOM 147 CE1 PHE A 9 -3.480 4.435 -6.420 1.00 0.00 C ATOM 148 CE2 PHE A 9 -3.662 2.226 -7.309 1.00 0.00 C ATOM 149 CZ PHE A 9 -4.225 3.456 -7.050 1.00 0.00 C ATOM 150 H PHE A 9 2.010 1.645 -5.074 1.00 0.00 H ATOM 151 HA PHE A 9 -0.348 2.777 -3.776 1.00 0.00 H ATOM 152 HB2 PHE A 9 0.352 3.627 -6.021 1.00 0.00 H ATOM 153 HB3 PHE A 9 0.239 1.996 -6.648 1.00 0.00 H ATOM 154 HD1 PHE A 9 -1.598 4.944 -5.554 1.00 0.00 H ATOM 155 HD2 PHE A 9 -1.907 1.018 -7.142 1.00 0.00 H ATOM 156 HE1 PHE A 9 -3.920 5.400 -6.216 1.00 0.00 H ATOM 157 HE2 PHE A 9 -4.240 1.457 -7.801 1.00 0.00 H ATOM 158 HZ PHE A 9 -5.246 3.658 -7.340 1.00 0.00 H ATOM 159 N VAL A 10 -1.590 0.605 -3.631 1.00 0.00 N ATOM 160 CA VAL A 10 -2.262 -0.654 -3.492 1.00 0.00 C ATOM 161 C VAL A 10 -3.725 -0.448 -3.831 1.00 0.00 C ATOM 162 O VAL A 10 -4.447 0.242 -3.112 1.00 0.00 O ATOM 163 CB VAL A 10 -2.147 -1.226 -2.046 1.00 0.00 C ATOM 164 CG1 VAL A 10 -2.762 -2.615 -1.965 1.00 0.00 C ATOM 165 CG2 VAL A 10 -0.699 -1.254 -1.567 1.00 0.00 C ATOM 166 H VAL A 10 -1.952 1.380 -3.146 1.00 0.00 H ATOM 167 HA VAL A 10 -1.825 -1.353 -4.190 1.00 0.00 H ATOM 168 HB VAL A 10 -2.713 -0.578 -1.392 1.00 0.00 H ATOM 169 HG11 VAL A 10 -2.286 -3.272 -2.678 1.00 0.00 H ATOM 170 HG12 VAL A 10 -2.640 -3.010 -0.968 1.00 0.00 H ATOM 171 HG13 VAL A 10 -3.816 -2.550 -2.196 1.00 0.00 H ATOM 172 HG21 VAL A 10 -0.292 -0.253 -1.587 1.00 0.00 H ATOM 173 HG22 VAL A 10 -0.659 -1.639 -0.559 1.00 0.00 H ATOM 174 HG23 VAL A 10 -0.119 -1.892 -2.216 1.00 0.00 H ATOM 175 N GLY A 11 -4.150 -1.042 -4.897 1.00 0.00 N ATOM 176 CA GLY A 11 -5.502 -0.918 -5.333 1.00 0.00 C ATOM 177 C GLY A 11 -6.195 -2.240 -5.348 1.00 0.00 C ATOM 178 O GLY A 11 -5.560 -3.274 -5.569 1.00 0.00 O ATOM 179 H GLY A 11 -3.522 -1.597 -5.406 1.00 0.00 H ATOM 180 HA2 GLY A 11 -6.028 -0.272 -4.648 1.00 0.00 H ATOM 181 HA3 GLY A 11 -5.525 -0.495 -6.326 1.00 0.00 H ATOM 182 N GLY A 12 -7.481 -2.222 -5.098 1.00 0.00 N ATOM 183 CA GLY A 12 -8.236 -3.439 -5.091 1.00 0.00 C ATOM 184 C GLY A 12 -8.171 -4.087 -3.744 1.00 0.00 C ATOM 185 O GLY A 12 -7.829 -5.246 -3.628 1.00 0.00 O ATOM 186 H GLY A 12 -7.921 -1.374 -4.879 1.00 0.00 H ATOM 187 HA2 GLY A 12 -9.265 -3.220 -5.336 1.00 0.00 H ATOM 188 HA3 GLY A 12 -7.829 -4.118 -5.826 1.00 0.00 H ATOM 189 N LEU A 13 -8.485 -3.318 -2.731 1.00 0.00 N ATOM 190 CA LEU A 13 -8.451 -3.791 -1.369 1.00 0.00 C ATOM 191 C LEU A 13 -9.693 -4.566 -1.008 1.00 0.00 C ATOM 192 O LEU A 13 -10.666 -4.610 -1.782 1.00 0.00 O ATOM 193 CB LEU A 13 -8.201 -2.645 -0.404 1.00 0.00 C ATOM 194 CG LEU A 13 -6.817 -2.018 -0.501 1.00 0.00 C ATOM 195 CD1 LEU A 13 -6.724 -0.815 0.396 1.00 0.00 C ATOM 196 CD2 LEU A 13 -5.755 -3.030 -0.113 1.00 0.00 C ATOM 197 H LEU A 13 -8.760 -2.390 -2.900 1.00 0.00 H ATOM 198 HA LEU A 13 -7.620 -4.477 -1.300 1.00 0.00 H ATOM 199 HB2 LEU A 13 -8.939 -1.880 -0.594 1.00 0.00 H ATOM 200 HB3 LEU A 13 -8.336 -3.011 0.603 1.00 0.00 H ATOM 201 HG LEU A 13 -6.634 -1.717 -1.522 1.00 0.00 H ATOM 202 HD11 LEU A 13 -6.910 -1.117 1.417 1.00 0.00 H ATOM 203 HD12 LEU A 13 -5.737 -0.385 0.324 1.00 0.00 H ATOM 204 HD13 LEU A 13 -7.461 -0.085 0.096 1.00 0.00 H ATOM 205 HD21 LEU A 13 -5.748 -3.853 -0.812 1.00 0.00 H ATOM 206 HD22 LEU A 13 -4.790 -2.547 -0.126 1.00 0.00 H ATOM 207 HD23 LEU A 13 -5.953 -3.397 0.882 1.00 0.00 H ATOM 208 N ALA A 14 -9.665 -5.161 0.157 1.00 0.00 N ATOM 209 CA ALA A 14 -10.689 -6.058 0.571 1.00 0.00 C ATOM 210 C ALA A 14 -11.778 -5.431 1.405 1.00 0.00 C ATOM 211 O ALA A 14 -11.883 -4.207 1.528 1.00 0.00 O ATOM 212 CB ALA A 14 -10.083 -7.238 1.251 1.00 0.00 C ATOM 213 H ALA A 14 -8.935 -4.993 0.789 1.00 0.00 H ATOM 214 HA ALA A 14 -11.190 -6.436 -0.303 1.00 0.00 H ATOM 215 HB1 ALA A 14 -9.219 -7.564 0.691 1.00 0.00 H ATOM 216 HB2 ALA A 14 -9.771 -6.954 2.244 1.00 0.00 H ATOM 217 HB3 ALA A 14 -10.800 -8.044 1.307 1.00 0.00 H ATOM 218 N TRP A 15 -12.554 -6.301 1.982 1.00 0.00 N ATOM 219 CA TRP A 15 -13.796 -5.994 2.631 1.00 0.00 C ATOM 220 C TRP A 15 -13.582 -5.399 4.016 1.00 0.00 C ATOM 221 O TRP A 15 -14.374 -4.570 4.469 1.00 0.00 O ATOM 222 CB TRP A 15 -14.614 -7.294 2.729 1.00 0.00 C ATOM 223 CG TRP A 15 -14.555 -8.121 1.459 1.00 0.00 C ATOM 224 CD1 TRP A 15 -13.712 -9.177 1.211 1.00 0.00 C ATOM 225 CD2 TRP A 15 -15.330 -7.948 0.264 1.00 0.00 C ATOM 226 NE1 TRP A 15 -13.915 -9.659 -0.060 1.00 0.00 N ATOM 227 CE2 TRP A 15 -14.905 -8.932 -0.658 1.00 0.00 C ATOM 228 CE3 TRP A 15 -16.343 -7.063 -0.117 1.00 0.00 C ATOM 229 CZ2 TRP A 15 -15.456 -9.048 -1.930 1.00 0.00 C ATOM 230 CZ3 TRP A 15 -16.890 -7.182 -1.381 1.00 0.00 C ATOM 231 CH2 TRP A 15 -16.445 -8.169 -2.273 1.00 0.00 C ATOM 232 H TRP A 15 -12.257 -7.236 2.001 1.00 0.00 H ATOM 233 HA TRP A 15 -14.352 -5.303 2.015 1.00 0.00 H ATOM 234 HB2 TRP A 15 -14.231 -7.896 3.540 1.00 0.00 H ATOM 235 HB3 TRP A 15 -15.650 -7.052 2.921 1.00 0.00 H ATOM 236 HD1 TRP A 15 -12.988 -9.558 1.919 1.00 0.00 H ATOM 237 HE1 TRP A 15 -13.419 -10.412 -0.460 1.00 0.00 H ATOM 238 HE3 TRP A 15 -16.694 -6.300 0.561 1.00 0.00 H ATOM 239 HZ2 TRP A 15 -15.127 -9.802 -2.629 1.00 0.00 H ATOM 240 HZ3 TRP A 15 -17.673 -6.507 -1.692 1.00 0.00 H ATOM 241 HH2 TRP A 15 -16.901 -8.224 -3.250 1.00 0.00 H ATOM 242 N ALA A 16 -12.532 -5.814 4.684 1.00 0.00 N ATOM 243 CA ALA A 16 -12.282 -5.363 6.047 1.00 0.00 C ATOM 244 C ALA A 16 -10.896 -4.754 6.195 1.00 0.00 C ATOM 245 O ALA A 16 -10.458 -4.420 7.310 1.00 0.00 O ATOM 246 CB ALA A 16 -12.467 -6.518 7.025 1.00 0.00 C ATOM 247 H ALA A 16 -11.886 -6.447 4.274 1.00 0.00 H ATOM 248 HA ALA A 16 -13.018 -4.607 6.281 1.00 0.00 H ATOM 249 HB1 ALA A 16 -11.726 -7.278 6.825 1.00 0.00 H ATOM 250 HB2 ALA A 16 -12.348 -6.159 8.037 1.00 0.00 H ATOM 251 HB3 ALA A 16 -13.455 -6.937 6.905 1.00 0.00 H ATOM 252 N THR A 17 -10.220 -4.574 5.090 1.00 0.00 N ATOM 253 CA THR A 17 -8.884 -4.059 5.115 1.00 0.00 C ATOM 254 C THR A 17 -8.876 -2.555 5.443 1.00 0.00 C ATOM 255 O THR A 17 -9.416 -1.736 4.697 1.00 0.00 O ATOM 256 CB THR A 17 -8.204 -4.289 3.752 1.00 0.00 C ATOM 257 OG1 THR A 17 -8.324 -5.665 3.379 1.00 0.00 O ATOM 258 CG2 THR A 17 -6.721 -3.923 3.813 1.00 0.00 C ATOM 259 H THR A 17 -10.644 -4.803 4.238 1.00 0.00 H ATOM 260 HA THR A 17 -8.325 -4.595 5.868 1.00 0.00 H ATOM 261 HB THR A 17 -8.688 -3.672 3.009 1.00 0.00 H ATOM 262 HG1 THR A 17 -9.017 -6.123 3.887 1.00 0.00 H ATOM 263 HG21 THR A 17 -6.234 -4.526 4.565 1.00 0.00 H ATOM 264 HG22 THR A 17 -6.262 -4.109 2.855 1.00 0.00 H ATOM 265 HG23 THR A 17 -6.619 -2.879 4.070 1.00 0.00 H ATOM 266 N THR A 18 -8.261 -2.205 6.550 1.00 0.00 N ATOM 267 CA THR A 18 -8.114 -0.821 6.916 1.00 0.00 C ATOM 268 C THR A 18 -6.680 -0.419 6.632 1.00 0.00 C ATOM 269 O THR A 18 -5.868 -1.271 6.254 1.00 0.00 O ATOM 270 CB THR A 18 -8.417 -0.589 8.420 1.00 0.00 C ATOM 271 OG1 THR A 18 -7.482 -1.314 9.232 1.00 0.00 O ATOM 272 CG2 THR A 18 -9.838 -1.017 8.770 1.00 0.00 C ATOM 273 H THR A 18 -7.902 -2.902 7.136 1.00 0.00 H ATOM 274 HA THR A 18 -8.785 -0.228 6.313 1.00 0.00 H ATOM 275 HB THR A 18 -8.302 0.464 8.633 1.00 0.00 H ATOM 276 HG1 THR A 18 -7.637 -2.268 9.202 1.00 0.00 H ATOM 277 HG21 THR A 18 -9.960 -2.068 8.552 1.00 0.00 H ATOM 278 HG22 THR A 18 -10.016 -0.846 9.821 1.00 0.00 H ATOM 279 HG23 THR A 18 -10.542 -0.444 8.185 1.00 0.00 H ATOM 280 N ASP A 19 -6.350 0.843 6.817 1.00 0.00 N ATOM 281 CA ASP A 19 -4.979 1.297 6.609 1.00 0.00 C ATOM 282 C ASP A 19 -4.042 0.815 7.661 1.00 0.00 C ATOM 283 O ASP A 19 -2.833 0.734 7.436 1.00 0.00 O ATOM 284 CB ASP A 19 -4.837 2.787 6.337 1.00 0.00 C ATOM 285 CG ASP A 19 -5.703 3.710 7.158 1.00 0.00 C ATOM 286 OD1 ASP A 19 -5.413 3.988 8.319 1.00 0.00 O ATOM 287 OD2 ASP A 19 -6.673 4.264 6.600 1.00 0.00 O1- ATOM 288 H ASP A 19 -7.027 1.500 7.084 1.00 0.00 H ATOM 289 HA ASP A 19 -4.676 0.767 5.716 1.00 0.00 H ATOM 290 HB2 ASP A 19 -3.810 3.077 6.491 1.00 0.00 H ATOM 291 HB3 ASP A 19 -5.083 2.924 5.298 1.00 0.00 H ATOM 292 N GLN A 20 -4.597 0.443 8.788 1.00 0.00 N ATOM 293 CA GLN A 20 -3.817 -0.168 9.832 1.00 0.00 C ATOM 294 C GLN A 20 -3.358 -1.508 9.300 1.00 0.00 C ATOM 295 O GLN A 20 -2.169 -1.780 9.205 1.00 0.00 O ATOM 296 CB GLN A 20 -4.654 -0.421 11.079 1.00 0.00 C ATOM 297 CG GLN A 20 -3.838 -0.987 12.231 1.00 0.00 C ATOM 298 CD GLN A 20 -4.687 -1.650 13.280 1.00 0.00 C ATOM 299 OE1 GLN A 20 -5.169 -1.011 14.211 1.00 0.00 O ATOM 300 NE2 GLN A 20 -4.827 -2.944 13.170 1.00 0.00 N ATOM 301 H GLN A 20 -5.560 0.582 8.885 1.00 0.00 H ATOM 302 HA GLN A 20 -2.973 0.463 10.064 1.00 0.00 H ATOM 303 HB2 GLN A 20 -5.101 0.510 11.396 1.00 0.00 H ATOM 304 HB3 GLN A 20 -5.436 -1.127 10.840 1.00 0.00 H ATOM 305 HG2 GLN A 20 -3.171 -1.734 11.825 1.00 0.00 H ATOM 306 HG3 GLN A 20 -3.263 -0.194 12.686 1.00 0.00 H ATOM 307 HE21 GLN A 20 -4.366 -3.404 12.418 1.00 0.00 H ATOM 308 HE22 GLN A 20 -5.361 -3.422 13.831 1.00 0.00 H ATOM 309 N THR A 21 -4.343 -2.296 8.877 1.00 0.00 N ATOM 310 CA THR A 21 -4.163 -3.603 8.360 1.00 0.00 C ATOM 311 C THR A 21 -3.269 -3.600 7.111 1.00 0.00 C ATOM 312 O THR A 21 -2.463 -4.505 6.899 1.00 0.00 O ATOM 313 CB THR A 21 -5.538 -4.145 8.025 1.00 0.00 C ATOM 314 OG1 THR A 21 -6.426 -3.767 9.093 1.00 0.00 O ATOM 315 CG2 THR A 21 -5.495 -5.625 7.970 1.00 0.00 C ATOM 316 H THR A 21 -5.282 -2.027 8.937 1.00 0.00 H ATOM 317 HA THR A 21 -3.746 -4.225 9.137 1.00 0.00 H ATOM 318 HB THR A 21 -5.879 -3.745 7.081 1.00 0.00 H ATOM 319 HG1 THR A 21 -5.968 -4.043 9.900 1.00 0.00 H ATOM 320 HG21 THR A 21 -5.185 -5.941 8.954 1.00 0.00 H ATOM 321 HG22 THR A 21 -6.481 -6.001 7.746 1.00 0.00 H ATOM 322 HG23 THR A 21 -4.772 -5.917 7.224 1.00 0.00 H ATOM 323 N LEU A 22 -3.414 -2.568 6.308 1.00 0.00 N ATOM 324 CA LEU A 22 -2.624 -2.404 5.119 1.00 0.00 C ATOM 325 C LEU A 22 -1.158 -2.194 5.516 1.00 0.00 C ATOM 326 O LEU A 22 -0.266 -2.900 5.043 1.00 0.00 O ATOM 327 CB LEU A 22 -3.160 -1.211 4.310 1.00 0.00 C ATOM 328 CG LEU A 22 -2.562 -0.987 2.922 1.00 0.00 C ATOM 329 CD1 LEU A 22 -2.830 -2.181 2.022 1.00 0.00 C ATOM 330 CD2 LEU A 22 -3.118 0.287 2.301 1.00 0.00 C ATOM 331 H LEU A 22 -4.096 -1.895 6.524 1.00 0.00 H ATOM 332 HA LEU A 22 -2.711 -3.305 4.530 1.00 0.00 H ATOM 333 HB2 LEU A 22 -4.227 -1.335 4.197 1.00 0.00 H ATOM 334 HB3 LEU A 22 -2.986 -0.320 4.895 1.00 0.00 H ATOM 335 HG LEU A 22 -1.492 -0.880 3.015 1.00 0.00 H ATOM 336 HD11 LEU A 22 -3.897 -2.332 1.934 1.00 0.00 H ATOM 337 HD12 LEU A 22 -2.412 -1.995 1.044 1.00 0.00 H ATOM 338 HD13 LEU A 22 -2.377 -3.064 2.445 1.00 0.00 H ATOM 339 HD21 LEU A 22 -2.872 1.131 2.928 1.00 0.00 H ATOM 340 HD22 LEU A 22 -2.685 0.430 1.321 1.00 0.00 H ATOM 341 HD23 LEU A 22 -4.191 0.205 2.211 1.00 0.00 H ATOM 342 N GLY A 23 -0.938 -1.271 6.437 1.00 0.00 N ATOM 343 CA GLY A 23 0.392 -0.977 6.904 1.00 0.00 C ATOM 344 C GLY A 23 1.041 -2.148 7.630 1.00 0.00 C ATOM 345 O GLY A 23 2.187 -2.499 7.332 1.00 0.00 O ATOM 346 H GLY A 23 -1.692 -0.762 6.810 1.00 0.00 H ATOM 347 HA2 GLY A 23 1.007 -0.711 6.057 1.00 0.00 H ATOM 348 HA3 GLY A 23 0.345 -0.134 7.578 1.00 0.00 H ATOM 349 N GLU A 24 0.301 -2.777 8.544 1.00 0.00 N ATOM 350 CA GLU A 24 0.826 -3.876 9.360 1.00 0.00 C ATOM 351 C GLU A 24 1.228 -5.079 8.490 1.00 0.00 C ATOM 352 O GLU A 24 2.257 -5.711 8.730 1.00 0.00 O ATOM 353 CB GLU A 24 -0.173 -4.274 10.480 1.00 0.00 C ATOM 354 CG GLU A 24 -1.480 -4.860 9.989 1.00 0.00 C ATOM 355 CD GLU A 24 -2.512 -5.070 11.094 1.00 0.00 C ATOM 356 OE1 GLU A 24 -2.408 -6.062 11.816 1.00 0.00 O1- ATOM 357 OE2 GLU A 24 -3.453 -4.228 11.222 1.00 0.00 O ATOM 358 H GLU A 24 -0.632 -2.495 8.694 1.00 0.00 H ATOM 359 HA GLU A 24 1.730 -3.501 9.819 1.00 0.00 H ATOM 360 HB2 GLU A 24 0.290 -5.001 11.128 1.00 0.00 H ATOM 361 HB3 GLU A 24 -0.408 -3.392 11.059 1.00 0.00 H ATOM 362 HG2 GLU A 24 -1.871 -4.177 9.250 1.00 0.00 H ATOM 363 HG3 GLU A 24 -1.272 -5.807 9.513 1.00 0.00 H ATOM 364 N ALA A 25 0.457 -5.338 7.437 1.00 0.00 N ATOM 365 CA ALA A 25 0.738 -6.441 6.526 1.00 0.00 C ATOM 366 C ALA A 25 2.045 -6.206 5.767 1.00 0.00 C ATOM 367 O ALA A 25 2.820 -7.131 5.527 1.00 0.00 O ATOM 368 CB ALA A 25 -0.414 -6.635 5.552 1.00 0.00 C ATOM 369 H ALA A 25 -0.338 -4.780 7.289 1.00 0.00 H ATOM 370 HA ALA A 25 0.840 -7.338 7.120 1.00 0.00 H ATOM 371 HB1 ALA A 25 -0.520 -5.748 4.945 1.00 0.00 H ATOM 372 HB2 ALA A 25 -0.214 -7.486 4.918 1.00 0.00 H ATOM 373 HB3 ALA A 25 -1.327 -6.801 6.104 1.00 0.00 H ATOM 374 N PHE A 26 2.298 -4.962 5.424 1.00 0.00 N ATOM 375 CA PHE A 26 3.506 -4.603 4.699 1.00 0.00 C ATOM 376 C PHE A 26 4.694 -4.396 5.636 1.00 0.00 C ATOM 377 O PHE A 26 5.837 -4.328 5.188 1.00 0.00 O ATOM 378 CB PHE A 26 3.290 -3.377 3.806 1.00 0.00 C ATOM 379 CG PHE A 26 2.478 -3.636 2.547 1.00 0.00 C ATOM 380 CD1 PHE A 26 1.105 -3.777 2.592 1.00 0.00 C ATOM 381 CD2 PHE A 26 3.107 -3.732 1.316 1.00 0.00 C ATOM 382 CE1 PHE A 26 0.376 -4.008 1.444 1.00 0.00 C ATOM 383 CE2 PHE A 26 2.384 -3.962 0.162 1.00 0.00 C ATOM 384 CZ PHE A 26 1.014 -4.099 0.228 1.00 0.00 C ATOM 385 H PHE A 26 1.653 -4.260 5.664 1.00 0.00 H ATOM 386 HA PHE A 26 3.740 -5.447 4.065 1.00 0.00 H ATOM 387 HB2 PHE A 26 2.784 -2.623 4.389 1.00 0.00 H ATOM 388 HB3 PHE A 26 4.253 -2.989 3.515 1.00 0.00 H ATOM 389 HD2 PHE A 26 4.179 -3.621 1.258 1.00 0.00 H ATOM 390 HD1 PHE A 26 0.596 -3.702 3.544 1.00 0.00 H ATOM 391 HE2 PHE A 26 2.889 -4.036 -0.791 1.00 0.00 H ATOM 392 HE1 PHE A 26 -0.698 -4.115 1.500 1.00 0.00 H ATOM 393 HZ PHE A 26 0.444 -4.278 -0.672 1.00 0.00 H ATOM 394 N SER A 27 4.431 -4.347 6.939 1.00 0.00 N ATOM 395 CA SER A 27 5.490 -4.161 7.937 1.00 0.00 C ATOM 396 C SER A 27 6.390 -5.404 8.025 1.00 0.00 C ATOM 397 O SER A 27 7.490 -5.352 8.557 1.00 0.00 O ATOM 398 CB SER A 27 4.887 -3.835 9.304 1.00 0.00 C ATOM 399 OG SER A 27 4.092 -2.654 9.247 1.00 0.00 O ATOM 400 H SER A 27 3.503 -4.439 7.248 1.00 0.00 H ATOM 401 HA SER A 27 6.093 -3.327 7.611 1.00 0.00 H ATOM 402 HB2 SER A 27 4.262 -4.656 9.623 1.00 0.00 H ATOM 403 HB3 SER A 27 5.682 -3.686 10.021 1.00 0.00 H ATOM 404 HG SER A 27 3.597 -2.621 8.419 1.00 0.00 H ATOM 405 N GLN A 28 5.909 -6.509 7.474 1.00 0.00 N ATOM 406 CA GLN A 28 6.669 -7.740 7.428 1.00 0.00 C ATOM 407 C GLN A 28 7.693 -7.669 6.276 1.00 0.00 C ATOM 408 O GLN A 28 8.632 -8.461 6.200 1.00 0.00 O ATOM 409 CB GLN A 28 5.703 -8.927 7.231 1.00 0.00 C ATOM 410 CG GLN A 28 6.373 -10.294 7.191 1.00 0.00 C ATOM 411 CD GLN A 28 7.098 -10.643 8.482 1.00 0.00 C ATOM 412 OE1 GLN A 28 6.704 -10.240 9.565 1.00 0.00 O ATOM 413 NE2 GLN A 28 8.179 -11.371 8.368 1.00 0.00 N ATOM 414 H GLN A 28 5.004 -6.500 7.100 1.00 0.00 H ATOM 415 HA GLN A 28 7.191 -7.856 8.366 1.00 0.00 H ATOM 416 HB2 GLN A 28 4.993 -8.928 8.046 1.00 0.00 H ATOM 417 HB3 GLN A 28 5.166 -8.783 6.305 1.00 0.00 H ATOM 418 HG2 GLN A 28 5.618 -11.043 7.004 1.00 0.00 H ATOM 419 HG3 GLN A 28 7.086 -10.290 6.380 1.00 0.00 H ATOM 420 HE21 GLN A 28 8.455 -11.641 7.468 1.00 0.00 H ATOM 421 HE22 GLN A 28 8.655 -11.595 9.193 1.00 0.00 H ATOM 422 N PHE A 29 7.499 -6.707 5.398 1.00 0.00 N ATOM 423 CA PHE A 29 8.364 -6.528 4.253 1.00 0.00 C ATOM 424 C PHE A 29 9.345 -5.396 4.487 1.00 0.00 C ATOM 425 O PHE A 29 10.506 -5.491 4.111 1.00 0.00 O ATOM 426 CB PHE A 29 7.550 -6.276 2.974 1.00 0.00 C ATOM 427 CG PHE A 29 6.774 -7.472 2.484 1.00 0.00 C ATOM 428 CD1 PHE A 29 5.577 -7.844 3.077 1.00 0.00 C ATOM 429 CD2 PHE A 29 7.247 -8.224 1.419 1.00 0.00 C ATOM 430 CE1 PHE A 29 4.873 -8.939 2.620 1.00 0.00 C ATOM 431 CE2 PHE A 29 6.546 -9.319 0.957 1.00 0.00 C ATOM 432 CZ PHE A 29 5.357 -9.678 1.558 1.00 0.00 C ATOM 433 H PHE A 29 6.764 -6.075 5.543 1.00 0.00 H ATOM 434 HA PHE A 29 8.925 -7.442 4.127 1.00 0.00 H ATOM 435 HB2 PHE A 29 6.843 -5.481 3.160 1.00 0.00 H ATOM 436 HB3 PHE A 29 8.224 -5.968 2.188 1.00 0.00 H ATOM 437 HD1 PHE A 29 5.195 -7.268 3.907 1.00 0.00 H ATOM 438 HD2 PHE A 29 8.179 -7.945 0.947 1.00 0.00 H ATOM 439 HE1 PHE A 29 3.947 -9.218 3.097 1.00 0.00 H ATOM 440 HE2 PHE A 29 6.933 -9.892 0.126 1.00 0.00 H ATOM 441 HZ PHE A 29 4.807 -10.536 1.197 1.00 0.00 H ATOM 442 N GLY A 30 8.886 -4.332 5.111 1.00 0.00 N ATOM 443 CA GLY A 30 9.764 -3.224 5.357 1.00 0.00 C ATOM 444 C GLY A 30 9.194 -2.259 6.344 1.00 0.00 C ATOM 445 O GLY A 30 8.168 -2.534 6.967 1.00 0.00 O ATOM 446 H GLY A 30 7.956 -4.279 5.422 1.00 0.00 H ATOM 447 HA2 GLY A 30 10.704 -3.596 5.736 1.00 0.00 H ATOM 448 HA3 GLY A 30 9.941 -2.702 4.430 1.00 0.00 H ATOM 449 N GLU A 31 9.832 -1.126 6.462 1.00 0.00 N ATOM 450 CA GLU A 31 9.440 -0.117 7.398 1.00 0.00 C ATOM 451 C GLU A 31 8.486 0.893 6.787 1.00 0.00 C ATOM 452 O GLU A 31 8.707 1.404 5.695 1.00 0.00 O ATOM 453 CB GLU A 31 10.665 0.480 8.124 1.00 0.00 C ATOM 454 CG GLU A 31 11.968 0.543 7.301 1.00 0.00 C ATOM 455 CD GLU A 31 12.066 1.686 6.321 1.00 0.00 C ATOM 456 OE1 GLU A 31 11.638 1.555 5.153 1.00 0.00 O1- ATOM 457 OE2 GLU A 31 12.652 2.717 6.702 1.00 0.00 O ATOM 458 H GLU A 31 10.585 -0.917 5.870 1.00 0.00 H ATOM 459 HA GLU A 31 8.850 -0.652 8.130 1.00 0.00 H ATOM 460 HB2 GLU A 31 10.421 1.490 8.418 1.00 0.00 H ATOM 461 HB3 GLU A 31 10.854 -0.102 9.013 1.00 0.00 H ATOM 462 HG2 GLU A 31 12.795 0.636 7.989 1.00 0.00 H ATOM 463 HG3 GLU A 31 12.074 -0.388 6.763 1.00 0.00 H ATOM 464 N ILE A 32 7.404 1.136 7.490 1.00 0.00 N ATOM 465 CA ILE A 32 6.319 1.938 6.979 1.00 0.00 C ATOM 466 C ILE A 32 6.370 3.342 7.562 1.00 0.00 C ATOM 467 O ILE A 32 6.449 3.512 8.776 1.00 0.00 O ATOM 468 CB ILE A 32 4.940 1.298 7.345 1.00 0.00 C ATOM 469 CG1 ILE A 32 4.923 -0.219 7.044 1.00 0.00 C ATOM 470 CG2 ILE A 32 3.791 2.000 6.620 1.00 0.00 C ATOM 471 CD1 ILE A 32 5.223 -0.589 5.607 1.00 0.00 C ATOM 472 H ILE A 32 7.334 0.779 8.397 1.00 0.00 H ATOM 473 HA ILE A 32 6.394 1.984 5.902 1.00 0.00 H ATOM 474 HB ILE A 32 4.786 1.444 8.403 1.00 0.00 H ATOM 475 HG12 ILE A 32 5.662 -0.706 7.661 1.00 0.00 H ATOM 476 HG13 ILE A 32 3.947 -0.611 7.293 1.00 0.00 H ATOM 477 HG21 ILE A 32 3.932 1.915 5.553 1.00 0.00 H ATOM 478 HG22 ILE A 32 2.855 1.538 6.897 1.00 0.00 H ATOM 479 HG23 ILE A 32 3.773 3.044 6.900 1.00 0.00 H ATOM 480 HD11 ILE A 32 6.210 -0.241 5.343 1.00 0.00 H ATOM 481 HD12 ILE A 32 5.176 -1.661 5.494 1.00 0.00 H ATOM 482 HD13 ILE A 32 4.493 -0.126 4.959 1.00 0.00 H ATOM 483 N LEU A 33 6.333 4.324 6.696 1.00 0.00 N ATOM 484 CA LEU A 33 6.288 5.710 7.102 1.00 0.00 C ATOM 485 C LEU A 33 4.835 6.139 7.274 1.00 0.00 C ATOM 486 O LEU A 33 4.481 6.790 8.251 1.00 0.00 O ATOM 487 CB LEU A 33 6.986 6.615 6.076 1.00 0.00 C ATOM 488 CG LEU A 33 8.475 6.341 5.797 1.00 0.00 C ATOM 489 CD1 LEU A 33 9.007 7.337 4.781 1.00 0.00 C ATOM 490 CD2 LEU A 33 9.301 6.399 7.084 1.00 0.00 C ATOM 491 H LEU A 33 6.336 4.081 5.743 1.00 0.00 H ATOM 492 HA LEU A 33 6.794 5.793 8.052 1.00 0.00 H ATOM 493 HB2 LEU A 33 6.450 6.528 5.142 1.00 0.00 H ATOM 494 HB3 LEU A 33 6.892 7.635 6.419 1.00 0.00 H ATOM 495 HG LEU A 33 8.570 5.353 5.369 1.00 0.00 H ATOM 496 HD11 LEU A 33 8.903 8.338 5.171 1.00 0.00 H ATOM 497 HD12 LEU A 33 10.051 7.134 4.590 1.00 0.00 H ATOM 498 HD13 LEU A 33 8.450 7.250 3.860 1.00 0.00 H ATOM 499 HD21 LEU A 33 8.975 5.623 7.759 1.00 0.00 H ATOM 500 HD22 LEU A 33 10.348 6.248 6.860 1.00 0.00 H ATOM 501 HD23 LEU A 33 9.172 7.363 7.553 1.00 0.00 H ATOM 502 N ASP A 34 3.992 5.738 6.325 1.00 0.00 N ATOM 503 CA ASP A 34 2.567 6.065 6.356 1.00 0.00 C ATOM 504 C ASP A 34 1.812 5.111 5.468 1.00 0.00 C ATOM 505 O ASP A 34 2.395 4.504 4.576 1.00 0.00 O ATOM 506 CB ASP A 34 2.264 7.526 5.914 1.00 0.00 C ATOM 507 CG ASP A 34 2.319 7.801 4.412 1.00 0.00 C ATOM 508 OD1 ASP A 34 3.383 8.156 3.892 1.00 0.00 O1- ATOM 509 OD2 ASP A 34 1.275 7.702 3.735 1.00 0.00 O ATOM 510 H ASP A 34 4.314 5.182 5.585 1.00 0.00 H ATOM 511 HA ASP A 34 2.228 5.925 7.372 1.00 0.00 H ATOM 512 HB2 ASP A 34 1.256 7.748 6.214 1.00 0.00 H ATOM 513 HB3 ASP A 34 2.958 8.186 6.413 1.00 0.00 H ATOM 514 N SER A 35 0.561 4.907 5.765 1.00 0.00 N ATOM 515 CA SER A 35 -0.302 4.098 4.957 1.00 0.00 C ATOM 516 C SER A 35 -1.717 4.564 5.218 1.00 0.00 C ATOM 517 O SER A 35 -2.104 4.701 6.377 1.00 0.00 O ATOM 518 CB SER A 35 -0.130 2.606 5.305 1.00 0.00 C ATOM 519 OG SER A 35 -0.810 1.772 4.383 1.00 0.00 O ATOM 520 H SER A 35 0.159 5.321 6.557 1.00 0.00 H ATOM 521 HA SER A 35 -0.075 4.268 3.915 1.00 0.00 H ATOM 522 HB2 SER A 35 0.920 2.354 5.289 1.00 0.00 H ATOM 523 HB3 SER A 35 -0.523 2.426 6.294 1.00 0.00 H ATOM 524 HG SER A 35 -0.781 2.190 3.513 1.00 0.00 H ATOM 525 N LYS A 36 -2.468 4.860 4.170 1.00 0.00 N ATOM 526 CA LYS A 36 -3.837 5.330 4.320 1.00 0.00 C ATOM 527 C LYS A 36 -4.756 4.773 3.265 1.00 0.00 C ATOM 528 O LYS A 36 -4.334 4.532 2.125 1.00 0.00 O ATOM 529 CB LYS A 36 -3.934 6.873 4.334 1.00 0.00 C ATOM 530 CG LYS A 36 -3.445 7.549 5.620 1.00 0.00 C ATOM 531 CD LYS A 36 -4.178 7.013 6.858 1.00 0.00 C ATOM 532 CE LYS A 36 -5.670 7.294 6.844 1.00 0.00 C ATOM 533 NZ LYS A 36 -6.351 6.588 7.965 1.00 0.00 N1+ ATOM 534 H LYS A 36 -2.108 4.743 3.265 1.00 0.00 H ATOM 535 HA LYS A 36 -4.194 4.965 5.270 1.00 0.00 H ATOM 536 HB2 LYS A 36 -3.299 7.221 3.532 1.00 0.00 H ATOM 537 HB3 LYS A 36 -4.952 7.173 4.138 1.00 0.00 H ATOM 538 HG2 LYS A 36 -2.388 7.356 5.733 1.00 0.00 H ATOM 539 HG3 LYS A 36 -3.610 8.614 5.544 1.00 0.00 H ATOM 540 HD2 LYS A 36 -4.069 5.940 6.891 1.00 0.00 H ATOM 541 HD3 LYS A 36 -3.746 7.449 7.747 1.00 0.00 H ATOM 542 HE2 LYS A 36 -5.830 8.358 6.935 1.00 0.00 H ATOM 543 HE3 LYS A 36 -6.083 6.950 5.905 1.00 0.00 H ATOM 544 HZ1 LYS A 36 -5.983 6.852 8.898 1.00 0.00 H ATOM 545 HZ2 LYS A 36 -7.381 6.696 7.930 1.00 0.00 H ATOM 546 HZ3 LYS A 36 -6.169 5.559 7.852 1.00 0.00 H ATOM 547 N ILE A 37 -5.998 4.531 3.666 1.00 0.00 N ATOM 548 CA ILE A 37 -7.045 4.116 2.744 1.00 0.00 C ATOM 549 C ILE A 37 -7.631 5.360 2.118 1.00 0.00 C ATOM 550 O ILE A 37 -7.907 6.348 2.819 1.00 0.00 O ATOM 551 CB ILE A 37 -8.204 3.330 3.452 1.00 0.00 C ATOM 552 CG1 ILE A 37 -7.688 2.078 4.156 1.00 0.00 C ATOM 553 CG2 ILE A 37 -9.322 2.959 2.468 1.00 0.00 C ATOM 554 CD1 ILE A 37 -6.946 1.110 3.263 1.00 0.00 C ATOM 555 H ILE A 37 -6.212 4.628 4.624 1.00 0.00 H ATOM 556 HA ILE A 37 -6.605 3.500 1.973 1.00 0.00 H ATOM 557 HB ILE A 37 -8.632 3.992 4.190 1.00 0.00 H ATOM 558 HG12 ILE A 37 -7.021 2.367 4.954 1.00 0.00 H ATOM 559 HG13 ILE A 37 -8.528 1.554 4.584 1.00 0.00 H ATOM 560 HG21 ILE A 37 -8.918 2.337 1.683 1.00 0.00 H ATOM 561 HG22 ILE A 37 -10.101 2.423 2.989 1.00 0.00 H ATOM 562 HG23 ILE A 37 -9.732 3.861 2.036 1.00 0.00 H ATOM 563 HD11 ILE A 37 -6.072 1.593 2.851 1.00 0.00 H ATOM 564 HD12 ILE A 37 -6.644 0.246 3.837 1.00 0.00 H ATOM 565 HD13 ILE A 37 -7.596 0.798 2.458 1.00 0.00 H ATOM 566 N ILE A 38 -7.813 5.334 0.836 1.00 0.00 N ATOM 567 CA ILE A 38 -8.355 6.460 0.155 1.00 0.00 C ATOM 568 C ILE A 38 -9.865 6.323 0.040 1.00 0.00 C ATOM 569 O ILE A 38 -10.400 5.391 -0.596 1.00 0.00 O ATOM 570 CB ILE A 38 -7.686 6.673 -1.226 1.00 0.00 C ATOM 571 CG1 ILE A 38 -6.156 6.845 -1.041 1.00 0.00 C ATOM 572 CG2 ILE A 38 -8.291 7.881 -1.952 1.00 0.00 C ATOM 573 CD1 ILE A 38 -5.750 8.010 -0.142 1.00 0.00 C ATOM 574 H ILE A 38 -7.590 4.525 0.321 1.00 0.00 H ATOM 575 HA ILE A 38 -8.155 7.323 0.772 1.00 0.00 H ATOM 576 HB ILE A 38 -7.861 5.794 -1.828 1.00 0.00 H ATOM 577 HG12 ILE A 38 -5.781 5.951 -0.567 1.00 0.00 H ATOM 578 HG13 ILE A 38 -5.665 6.959 -1.996 1.00 0.00 H ATOM 579 HG21 ILE A 38 -8.143 8.769 -1.356 1.00 0.00 H ATOM 580 HG22 ILE A 38 -7.807 8.005 -2.910 1.00 0.00 H ATOM 581 HG23 ILE A 38 -9.349 7.718 -2.100 1.00 0.00 H ATOM 582 HD11 ILE A 38 -6.127 7.849 0.858 1.00 0.00 H ATOM 583 HD12 ILE A 38 -4.672 8.078 -0.108 1.00 0.00 H ATOM 584 HD13 ILE A 38 -6.158 8.930 -0.533 1.00 0.00 H ATOM 585 N ASN A 39 -10.539 7.204 0.713 1.00 0.00 N ATOM 586 CA ASN A 39 -11.973 7.240 0.719 1.00 0.00 C ATOM 587 C ASN A 39 -12.535 8.280 -0.246 1.00 0.00 C ATOM 588 O ASN A 39 -11.812 9.146 -0.749 1.00 0.00 O ATOM 589 CB ASN A 39 -12.569 7.369 2.145 1.00 0.00 C ATOM 590 CG ASN A 39 -11.899 8.415 3.025 1.00 0.00 C ATOM 591 OD1 ASN A 39 -11.308 9.375 2.548 1.00 0.00 O ATOM 592 ND2 ASN A 39 -12.011 8.247 4.318 1.00 0.00 N ATOM 593 H ASN A 39 -10.045 7.872 1.232 1.00 0.00 H ATOM 594 HA ASN A 39 -12.269 6.281 0.321 1.00 0.00 H ATOM 595 HB2 ASN A 39 -13.611 7.634 2.050 1.00 0.00 H ATOM 596 HB3 ASN A 39 -12.503 6.409 2.635 1.00 0.00 H ATOM 597 HD21 ASN A 39 -12.512 7.468 4.639 1.00 0.00 H ATOM 598 HD22 ASN A 39 -11.597 8.906 4.912 1.00 0.00 H ATOM 599 N ASP A 40 -13.813 8.180 -0.473 1.00 0.00 N ATOM 600 CA ASP A 40 -14.554 8.945 -1.466 1.00 0.00 C ATOM 601 C ASP A 40 -15.171 10.175 -0.806 1.00 0.00 C ATOM 602 O ASP A 40 -15.848 10.048 0.207 1.00 0.00 O ATOM 603 CB ASP A 40 -15.665 8.024 -1.991 1.00 0.00 C ATOM 604 CG ASP A 40 -16.411 8.542 -3.177 1.00 0.00 C ATOM 605 OD1 ASP A 40 -17.258 9.413 -3.014 1.00 0.00 O ATOM 606 OD2 ASP A 40 -16.204 7.995 -4.293 1.00 0.00 O1- ATOM 607 H ASP A 40 -14.345 7.574 0.095 1.00 0.00 H ATOM 608 HA ASP A 40 -13.908 9.221 -2.286 1.00 0.00 H ATOM 609 HB2 ASP A 40 -15.236 7.073 -2.269 1.00 0.00 H ATOM 610 HB3 ASP A 40 -16.373 7.858 -1.192 1.00 0.00 H ATOM 611 N ARG A 41 -14.890 11.357 -1.335 1.00 0.00 N ATOM 612 CA ARG A 41 -15.423 12.604 -0.762 1.00 0.00 C ATOM 613 C ARG A 41 -16.898 12.752 -1.055 1.00 0.00 C ATOM 614 O ARG A 41 -17.703 12.991 -0.164 1.00 0.00 O ATOM 615 CB ARG A 41 -14.682 13.839 -1.318 1.00 0.00 C ATOM 616 CG ARG A 41 -13.207 13.885 -1.011 1.00 0.00 C ATOM 617 CD ARG A 41 -12.970 14.011 0.476 1.00 0.00 C ATOM 618 NE ARG A 41 -11.555 13.875 0.816 1.00 0.00 N ATOM 619 CZ ARG A 41 -11.026 12.750 1.299 1.00 0.00 C ATOM 620 NH1 ARG A 41 -11.770 11.658 1.354 1.00 0.00 N1+ ATOM 621 NH2 ARG A 41 -9.750 12.710 1.689 1.00 0.00 N ATOM 622 H ARG A 41 -14.380 11.410 -2.172 1.00 0.00 H ATOM 623 HA ARG A 41 -15.286 12.571 0.309 1.00 0.00 H ATOM 624 HB2 ARG A 41 -14.799 13.852 -2.392 1.00 0.00 H ATOM 625 HB3 ARG A 41 -15.144 14.726 -0.911 1.00 0.00 H ATOM 626 HG2 ARG A 41 -12.746 12.973 -1.362 1.00 0.00 H ATOM 627 HG3 ARG A 41 -12.764 14.733 -1.512 1.00 0.00 H ATOM 628 HD2 ARG A 41 -13.314 14.982 0.802 1.00 0.00 H ATOM 629 HD3 ARG A 41 -13.527 13.246 0.995 1.00 0.00 H ATOM 630 HE ARG A 41 -11.025 14.694 0.696 1.00 0.00 H ATOM 631 HH11 ARG A 41 -12.722 11.631 1.041 1.00 0.00 H ATOM 632 HH12 ARG A 41 -11.439 10.777 1.720 1.00 0.00 H ATOM 633 HH21 ARG A 41 -9.141 13.503 1.641 1.00 0.00 H ATOM 634 HH22 ARG A 41 -9.350 11.865 2.051 1.00 0.00 H ATOM 635 N GLU A 42 -17.204 12.591 -2.311 1.00 0.00 N ATOM 636 CA GLU A 42 -18.503 12.821 -2.886 1.00 0.00 C ATOM 637 C GLU A 42 -19.615 11.965 -2.260 1.00 0.00 C ATOM 638 O GLU A 42 -20.727 12.445 -2.050 1.00 0.00 O ATOM 639 CB GLU A 42 -18.457 12.628 -4.427 1.00 0.00 C ATOM 640 CG GLU A 42 -17.379 13.465 -5.172 1.00 0.00 C ATOM 641 CD GLU A 42 -15.974 12.833 -5.190 1.00 0.00 C ATOM 642 OE1 GLU A 42 -15.326 12.709 -4.127 1.00 0.00 O ATOM 643 OE2 GLU A 42 -15.503 12.440 -6.273 1.00 0.00 O1- ATOM 644 H GLU A 42 -16.481 12.333 -2.934 1.00 0.00 H ATOM 645 HA GLU A 42 -18.745 13.856 -2.702 1.00 0.00 H ATOM 646 HB2 GLU A 42 -18.267 11.586 -4.635 1.00 0.00 H ATOM 647 HB3 GLU A 42 -19.425 12.889 -4.832 1.00 0.00 H ATOM 648 HG2 GLU A 42 -17.694 13.598 -6.196 1.00 0.00 H ATOM 649 HG3 GLU A 42 -17.314 14.433 -4.698 1.00 0.00 H ATOM 650 N THR A 43 -19.331 10.717 -1.978 1.00 0.00 N ATOM 651 CA THR A 43 -20.349 9.848 -1.414 1.00 0.00 C ATOM 652 C THR A 43 -20.056 9.408 0.024 1.00 0.00 C ATOM 653 O THR A 43 -20.893 8.765 0.657 1.00 0.00 O ATOM 654 CB THR A 43 -20.594 8.612 -2.308 1.00 0.00 C ATOM 655 OG1 THR A 43 -19.354 7.944 -2.584 1.00 0.00 O ATOM 656 CG2 THR A 43 -21.233 9.008 -3.616 1.00 0.00 C ATOM 657 H THR A 43 -18.428 10.382 -2.197 1.00 0.00 H ATOM 658 HA THR A 43 -21.264 10.420 -1.398 1.00 0.00 H ATOM 659 HB THR A 43 -21.252 7.933 -1.785 1.00 0.00 H ATOM 660 HG1 THR A 43 -18.703 8.635 -2.816 1.00 0.00 H ATOM 661 HG21 THR A 43 -20.559 9.679 -4.127 1.00 0.00 H ATOM 662 HG22 THR A 43 -21.390 8.122 -4.212 1.00 0.00 H ATOM 663 HG23 THR A 43 -22.175 9.501 -3.424 1.00 0.00 H ATOM 664 N GLY A 44 -18.871 9.733 0.528 1.00 0.00 N ATOM 665 CA GLY A 44 -18.508 9.340 1.892 1.00 0.00 C ATOM 666 C GLY A 44 -18.152 7.860 1.993 1.00 0.00 C ATOM 667 O GLY A 44 -18.066 7.295 3.080 1.00 0.00 O ATOM 668 H GLY A 44 -18.242 10.264 -0.005 1.00 0.00 H ATOM 669 HA2 GLY A 44 -17.658 9.926 2.210 1.00 0.00 H ATOM 670 HA3 GLY A 44 -19.341 9.544 2.548 1.00 0.00 H ATOM 671 N ARG A 45 -17.947 7.249 0.854 1.00 0.00 N ATOM 672 CA ARG A 45 -17.609 5.839 0.759 1.00 0.00 C ATOM 673 C ARG A 45 -16.101 5.639 0.794 1.00 0.00 C ATOM 674 O ARG A 45 -15.346 6.570 1.012 1.00 0.00 O ATOM 675 CB ARG A 45 -18.126 5.298 -0.558 1.00 0.00 C ATOM 676 CG ARG A 45 -19.619 5.052 -0.648 1.00 0.00 C ATOM 677 CD ARG A 45 -20.044 4.929 -2.114 1.00 0.00 C ATOM 678 NE ARG A 45 -19.114 4.098 -2.919 1.00 0.00 N ATOM 679 CZ ARG A 45 -18.226 4.605 -3.821 1.00 0.00 C ATOM 680 NH1 ARG A 45 -18.129 5.933 -3.993 1.00 0.00 N1+ ATOM 681 NH2 ARG A 45 -17.426 3.787 -4.513 1.00 0.00 N ATOM 682 H ARG A 45 -18.019 7.798 0.046 1.00 0.00 H ATOM 683 HA ARG A 45 -18.083 5.298 1.564 1.00 0.00 H ATOM 684 HB2 ARG A 45 -17.869 6.001 -1.337 1.00 0.00 H ATOM 685 HB3 ARG A 45 -17.618 4.368 -0.767 1.00 0.00 H ATOM 686 HG2 ARG A 45 -19.859 4.137 -0.127 1.00 0.00 H ATOM 687 HG3 ARG A 45 -20.143 5.881 -0.196 1.00 0.00 H ATOM 688 HD2 ARG A 45 -21.026 4.478 -2.147 1.00 0.00 H ATOM 689 HD3 ARG A 45 -20.096 5.919 -2.544 1.00 0.00 H ATOM 690 HE ARG A 45 -19.184 3.133 -2.753 1.00 0.00 H ATOM 691 HH11 ARG A 45 -18.706 6.583 -3.477 1.00 0.00 H ATOM 692 HH12 ARG A 45 -17.472 6.410 -4.589 1.00 0.00 H ATOM 693 HH21 ARG A 45 -17.446 2.792 -4.396 1.00 0.00 H ATOM 694 HH22 ARG A 45 -16.768 4.141 -5.178 1.00 0.00 H ATOM 695 N SER A 46 -15.680 4.429 0.579 1.00 0.00 N ATOM 696 CA SER A 46 -14.302 4.101 0.438 1.00 0.00 C ATOM 697 C SER A 46 -14.044 3.819 -1.049 1.00 0.00 C ATOM 698 O SER A 46 -14.971 3.423 -1.768 1.00 0.00 O ATOM 699 CB SER A 46 -14.012 2.877 1.307 1.00 0.00 C ATOM 700 OG SER A 46 -15.007 1.884 1.098 1.00 0.00 O ATOM 701 H SER A 46 -16.301 3.676 0.506 1.00 0.00 H ATOM 702 HA SER A 46 -13.709 4.938 0.773 1.00 0.00 H ATOM 703 HB2 SER A 46 -13.045 2.470 1.047 1.00 0.00 H ATOM 704 HB3 SER A 46 -14.019 3.163 2.349 1.00 0.00 H ATOM 705 HG SER A 46 -14.751 1.074 1.551 1.00 0.00 H ATOM 706 N ARG A 47 -12.836 4.060 -1.537 1.00 0.00 N ATOM 707 CA ARG A 47 -12.567 3.804 -2.947 1.00 0.00 C ATOM 708 C ARG A 47 -11.810 2.508 -3.186 1.00 0.00 C ATOM 709 O ARG A 47 -11.421 2.201 -4.304 1.00 0.00 O ATOM 710 CB ARG A 47 -11.948 5.015 -3.652 1.00 0.00 C ATOM 711 CG ARG A 47 -12.949 6.144 -3.782 1.00 0.00 C ATOM 712 CD ARG A 47 -12.451 7.326 -4.593 1.00 0.00 C ATOM 713 NE ARG A 47 -13.574 8.228 -4.856 1.00 0.00 N ATOM 714 CZ ARG A 47 -13.552 9.466 -5.347 1.00 0.00 C ATOM 715 NH1 ARG A 47 -12.411 10.086 -5.641 1.00 0.00 N1+ ATOM 716 NH2 ARG A 47 -14.694 10.074 -5.520 1.00 0.00 N ATOM 717 H ARG A 47 -12.114 4.437 -0.983 1.00 0.00 H ATOM 718 HA ARG A 47 -13.546 3.637 -3.373 1.00 0.00 H ATOM 719 HB2 ARG A 47 -11.096 5.361 -3.085 1.00 0.00 H ATOM 720 HB3 ARG A 47 -11.631 4.725 -4.642 1.00 0.00 H ATOM 721 HG2 ARG A 47 -13.846 5.768 -4.249 1.00 0.00 H ATOM 722 HG3 ARG A 47 -13.188 6.484 -2.783 1.00 0.00 H ATOM 723 HD2 ARG A 47 -11.688 7.848 -4.033 1.00 0.00 H ATOM 724 HD3 ARG A 47 -12.051 6.977 -5.534 1.00 0.00 H ATOM 725 HE ARG A 47 -14.477 7.871 -4.650 1.00 0.00 H ATOM 726 HH11 ARG A 47 -11.516 9.663 -5.514 1.00 0.00 H ATOM 727 HH12 ARG A 47 -12.452 11.021 -6.002 1.00 0.00 H ATOM 728 HH21 ARG A 47 -15.561 9.614 -5.290 1.00 0.00 H ATOM 729 HH22 ARG A 47 -14.829 11.027 -5.854 1.00 0.00 H ATOM 730 N GLY A 48 -11.633 1.748 -2.119 1.00 0.00 N ATOM 731 CA GLY A 48 -11.062 0.416 -2.211 1.00 0.00 C ATOM 732 C GLY A 48 -9.598 0.376 -2.589 1.00 0.00 C ATOM 733 O GLY A 48 -9.132 -0.616 -3.168 1.00 0.00 O ATOM 734 H GLY A 48 -11.913 2.101 -1.251 1.00 0.00 H ATOM 735 HA2 GLY A 48 -11.173 -0.069 -1.253 1.00 0.00 H ATOM 736 HA3 GLY A 48 -11.625 -0.143 -2.943 1.00 0.00 H ATOM 737 N PHE A 49 -8.868 1.419 -2.281 1.00 0.00 N ATOM 738 CA PHE A 49 -7.455 1.430 -2.543 1.00 0.00 C ATOM 739 C PHE A 49 -6.766 2.336 -1.548 1.00 0.00 C ATOM 740 O PHE A 49 -7.438 3.061 -0.790 1.00 0.00 O ATOM 741 CB PHE A 49 -7.127 1.841 -4.006 1.00 0.00 C ATOM 742 CG PHE A 49 -7.320 3.284 -4.357 1.00 0.00 C ATOM 743 CD1 PHE A 49 -8.550 3.772 -4.745 1.00 0.00 C ATOM 744 CD2 PHE A 49 -6.243 4.142 -4.318 1.00 0.00 C ATOM 745 CE1 PHE A 49 -8.701 5.103 -5.084 1.00 0.00 C ATOM 746 CE2 PHE A 49 -6.384 5.473 -4.651 1.00 0.00 C ATOM 747 CZ PHE A 49 -7.617 5.956 -5.034 1.00 0.00 C ATOM 748 H PHE A 49 -9.259 2.210 -1.857 1.00 0.00 H ATOM 749 HA PHE A 49 -7.101 0.424 -2.373 1.00 0.00 H ATOM 750 HB2 PHE A 49 -6.083 1.633 -4.188 1.00 0.00 H ATOM 751 HB3 PHE A 49 -7.727 1.244 -4.678 1.00 0.00 H ATOM 752 HD1 PHE A 49 -9.396 3.100 -4.778 1.00 0.00 H ATOM 753 HD2 PHE A 49 -5.286 3.731 -4.023 1.00 0.00 H ATOM 754 HE1 PHE A 49 -9.668 5.474 -5.388 1.00 0.00 H ATOM 755 HE2 PHE A 49 -5.531 6.133 -4.608 1.00 0.00 H ATOM 756 HZ PHE A 49 -7.729 6.997 -5.298 1.00 0.00 H ATOM 757 N GLY A 50 -5.466 2.285 -1.533 1.00 0.00 N ATOM 758 CA GLY A 50 -4.686 3.091 -0.658 1.00 0.00 C ATOM 759 C GLY A 50 -3.238 3.016 -1.038 1.00 0.00 C ATOM 760 O GLY A 50 -2.908 2.580 -2.141 1.00 0.00 O ATOM 761 H GLY A 50 -4.986 1.679 -2.146 1.00 0.00 H ATOM 762 HA2 GLY A 50 -5.023 4.114 -0.726 1.00 0.00 H ATOM 763 HA3 GLY A 50 -4.800 2.740 0.357 1.00 0.00 H ATOM 764 N PHE A 51 -2.382 3.432 -0.165 1.00 0.00 N ATOM 765 CA PHE A 51 -0.957 3.366 -0.414 1.00 0.00 C ATOM 766 C PHE A 51 -0.188 3.006 0.835 1.00 0.00 C ATOM 767 O PHE A 51 -0.679 3.211 1.958 1.00 0.00 O ATOM 768 CB PHE A 51 -0.418 4.669 -1.052 1.00 0.00 C ATOM 769 CG PHE A 51 -0.888 5.948 -0.415 1.00 0.00 C ATOM 770 CD1 PHE A 51 -0.571 6.268 0.897 1.00 0.00 C ATOM 771 CD2 PHE A 51 -1.660 6.826 -1.143 1.00 0.00 C ATOM 772 CE1 PHE A 51 -1.016 7.440 1.465 1.00 0.00 C ATOM 773 CE2 PHE A 51 -2.109 8.004 -0.582 1.00 0.00 C ATOM 774 CZ PHE A 51 -1.786 8.311 0.725 1.00 0.00 C ATOM 775 H PHE A 51 -2.710 3.806 0.682 1.00 0.00 H ATOM 776 HA PHE A 51 -0.811 2.561 -1.121 1.00 0.00 H ATOM 777 HB2 PHE A 51 0.660 4.661 -0.991 1.00 0.00 H ATOM 778 HB3 PHE A 51 -0.703 4.687 -2.094 1.00 0.00 H ATOM 779 HD2 PHE A 51 -1.900 6.566 -2.165 1.00 0.00 H ATOM 780 HD1 PHE A 51 0.035 5.587 1.480 1.00 0.00 H ATOM 781 HE2 PHE A 51 -2.714 8.684 -1.165 1.00 0.00 H ATOM 782 HE1 PHE A 51 -0.752 7.671 2.488 1.00 0.00 H ATOM 783 HZ PHE A 51 -2.134 9.233 1.171 1.00 0.00 H ATOM 784 N VAL A 52 0.989 2.446 0.650 1.00 0.00 N ATOM 785 CA VAL A 52 1.860 2.099 1.749 1.00 0.00 C ATOM 786 C VAL A 52 3.208 2.743 1.501 1.00 0.00 C ATOM 787 O VAL A 52 3.837 2.500 0.467 1.00 0.00 O ATOM 788 CB VAL A 52 2.051 0.566 1.884 1.00 0.00 C ATOM 789 CG1 VAL A 52 2.914 0.239 3.080 1.00 0.00 C ATOM 790 CG2 VAL A 52 0.723 -0.146 1.992 1.00 0.00 C ATOM 791 H VAL A 52 1.306 2.256 -0.266 1.00 0.00 H ATOM 792 HA VAL A 52 1.435 2.493 2.661 1.00 0.00 H ATOM 793 HB VAL A 52 2.559 0.212 0.999 1.00 0.00 H ATOM 794 HG11 VAL A 52 2.435 0.599 3.979 1.00 0.00 H ATOM 795 HG12 VAL A 52 3.047 -0.831 3.144 1.00 0.00 H ATOM 796 HG13 VAL A 52 3.877 0.716 2.967 1.00 0.00 H ATOM 797 HG21 VAL A 52 0.129 0.055 1.112 1.00 0.00 H ATOM 798 HG22 VAL A 52 0.887 -1.210 2.085 1.00 0.00 H ATOM 799 HG23 VAL A 52 0.206 0.219 2.867 1.00 0.00 H ATOM 800 N THR A 53 3.624 3.573 2.385 1.00 0.00 N ATOM 801 CA THR A 53 4.857 4.258 2.242 1.00 0.00 C ATOM 802 C THR A 53 5.967 3.599 3.030 1.00 0.00 C ATOM 803 O THR A 53 5.857 3.414 4.228 1.00 0.00 O ATOM 804 CB THR A 53 4.675 5.700 2.681 1.00 0.00 C ATOM 805 OG1 THR A 53 3.601 6.236 1.940 1.00 0.00 O ATOM 806 CG2 THR A 53 5.926 6.518 2.428 1.00 0.00 C ATOM 807 H THR A 53 3.087 3.803 3.180 1.00 0.00 H ATOM 808 HA THR A 53 5.137 4.264 1.202 1.00 0.00 H ATOM 809 HB THR A 53 4.407 5.758 3.729 1.00 0.00 H ATOM 810 HG1 THR A 53 3.329 7.021 2.445 1.00 0.00 H ATOM 811 HG21 THR A 53 6.164 6.497 1.376 1.00 0.00 H ATOM 812 HG22 THR A 53 5.760 7.537 2.746 1.00 0.00 H ATOM 813 HG23 THR A 53 6.741 6.095 2.998 1.00 0.00 H ATOM 814 N PHE A 54 6.996 3.231 2.329 1.00 0.00 N ATOM 815 CA PHE A 54 8.207 2.697 2.904 1.00 0.00 C ATOM 816 C PHE A 54 9.240 3.791 2.856 1.00 0.00 C ATOM 817 O PHE A 54 8.981 4.852 2.282 1.00 0.00 O ATOM 818 CB PHE A 54 8.716 1.527 2.069 1.00 0.00 C ATOM 819 CG PHE A 54 7.884 0.280 2.121 1.00 0.00 C ATOM 820 CD1 PHE A 54 6.753 0.139 1.331 1.00 0.00 C ATOM 821 CD2 PHE A 54 8.246 -0.760 2.947 1.00 0.00 C ATOM 822 CE1 PHE A 54 6.006 -1.016 1.374 1.00 0.00 C ATOM 823 CE2 PHE A 54 7.505 -1.917 2.990 1.00 0.00 C ATOM 824 CZ PHE A 54 6.387 -2.045 2.207 1.00 0.00 C ATOM 825 H PHE A 54 6.975 3.335 1.351 1.00 0.00 H ATOM 826 HA PHE A 54 8.027 2.377 3.919 1.00 0.00 H ATOM 827 HB2 PHE A 54 8.742 1.852 1.039 1.00 0.00 H ATOM 828 HB3 PHE A 54 9.724 1.296 2.379 1.00 0.00 H ATOM 829 HD2 PHE A 54 9.124 -0.657 3.567 1.00 0.00 H ATOM 830 HD1 PHE A 54 6.454 0.946 0.678 1.00 0.00 H ATOM 831 HE2 PHE A 54 7.799 -2.728 3.642 1.00 0.00 H ATOM 832 HE1 PHE A 54 5.125 -1.114 0.755 1.00 0.00 H ATOM 833 HZ PHE A 54 5.816 -2.960 2.247 1.00 0.00 H ATOM 834 N LYS A 55 10.379 3.579 3.433 1.00 0.00 N ATOM 835 CA LYS A 55 11.430 4.558 3.321 1.00 0.00 C ATOM 836 C LYS A 55 12.554 3.979 2.461 1.00 0.00 C ATOM 837 O LYS A 55 13.380 4.702 1.913 1.00 0.00 O ATOM 838 CB LYS A 55 11.951 4.917 4.691 1.00 0.00 C ATOM 839 CG LYS A 55 12.895 6.113 4.740 1.00 0.00 C ATOM 840 CD LYS A 55 13.642 6.165 6.065 1.00 0.00 C ATOM 841 CE LYS A 55 14.893 5.265 6.068 1.00 0.00 C ATOM 842 NZ LYS A 55 14.647 3.880 5.582 1.00 0.00 N1+ ATOM 843 H LYS A 55 10.532 2.769 3.978 1.00 0.00 H ATOM 844 HA LYS A 55 11.028 5.437 2.839 1.00 0.00 H ATOM 845 HB2 LYS A 55 11.104 5.128 5.326 1.00 0.00 H ATOM 846 HB3 LYS A 55 12.469 4.058 5.091 1.00 0.00 H ATOM 847 HG2 LYS A 55 13.610 6.027 3.936 1.00 0.00 H ATOM 848 HG3 LYS A 55 12.322 7.020 4.621 1.00 0.00 H ATOM 849 HD2 LYS A 55 13.947 7.183 6.253 1.00 0.00 H ATOM 850 HD3 LYS A 55 12.975 5.841 6.850 1.00 0.00 H ATOM 851 HE2 LYS A 55 15.646 5.721 5.444 1.00 0.00 H ATOM 852 HE3 LYS A 55 15.250 5.224 7.088 1.00 0.00 H ATOM 853 HZ1 LYS A 55 13.864 3.441 6.127 1.00 0.00 H ATOM 854 HZ2 LYS A 55 14.346 3.889 4.587 1.00 0.00 H ATOM 855 HZ3 LYS A 55 15.473 3.261 5.678 1.00 0.00 H ATOM 856 N ASP A 56 12.596 2.671 2.380 1.00 0.00 N ATOM 857 CA ASP A 56 13.568 1.980 1.554 1.00 0.00 C ATOM 858 C ASP A 56 12.906 1.454 0.298 1.00 0.00 C ATOM 859 O ASP A 56 11.754 1.003 0.340 1.00 0.00 O ATOM 860 CB ASP A 56 14.222 0.832 2.325 1.00 0.00 C ATOM 861 CG ASP A 56 14.995 -0.087 1.416 1.00 0.00 C ATOM 862 OD1 ASP A 56 15.936 0.372 0.759 1.00 0.00 O ATOM 863 OD2 ASP A 56 14.625 -1.257 1.320 1.00 0.00 O1- ATOM 864 H ASP A 56 11.957 2.122 2.888 1.00 0.00 H ATOM 865 HA ASP A 56 14.329 2.694 1.273 1.00 0.00 H ATOM 866 HB2 ASP A 56 14.904 1.229 3.062 1.00 0.00 H ATOM 867 HB3 ASP A 56 13.454 0.254 2.816 1.00 0.00 H ATOM 868 N GLU A 57 13.607 1.521 -0.822 1.00 0.00 N ATOM 869 CA GLU A 57 13.040 1.064 -2.060 1.00 0.00 C ATOM 870 C GLU A 57 13.132 -0.418 -2.215 1.00 0.00 C ATOM 871 O GLU A 57 12.247 -1.015 -2.797 1.00 0.00 O ATOM 872 CB GLU A 57 13.593 1.768 -3.281 1.00 0.00 C ATOM 873 CG GLU A 57 15.090 1.706 -3.495 1.00 0.00 C ATOM 874 CD GLU A 57 15.462 2.363 -4.805 1.00 0.00 C ATOM 875 OE1 GLU A 57 15.578 3.594 -4.845 1.00 0.00 O ATOM 876 OE2 GLU A 57 15.576 1.641 -5.823 1.00 0.00 O1- ATOM 877 H GLU A 57 14.530 1.853 -0.791 1.00 0.00 H ATOM 878 HA GLU A 57 11.988 1.298 -1.992 1.00 0.00 H ATOM 879 HB2 GLU A 57 13.132 1.322 -4.148 1.00 0.00 H ATOM 880 HB3 GLU A 57 13.302 2.803 -3.212 1.00 0.00 H ATOM 881 HG2 GLU A 57 15.587 2.221 -2.685 1.00 0.00 H ATOM 882 HG3 GLU A 57 15.404 0.673 -3.522 1.00 0.00 H ATOM 883 N LYS A 58 14.174 -1.010 -1.677 1.00 0.00 N ATOM 884 CA LYS A 58 14.366 -2.452 -1.772 1.00 0.00 C ATOM 885 C LYS A 58 13.189 -3.187 -1.132 1.00 0.00 C ATOM 886 O LYS A 58 12.541 -4.013 -1.781 1.00 0.00 O ATOM 887 CB LYS A 58 15.733 -2.881 -1.166 1.00 0.00 C ATOM 888 CG LYS A 58 15.921 -4.392 -0.975 1.00 0.00 C ATOM 889 CD LYS A 58 15.705 -5.176 -2.263 1.00 0.00 C ATOM 890 CE LYS A 58 15.736 -6.671 -1.996 1.00 0.00 C ATOM 891 NZ LYS A 58 15.258 -7.444 -3.163 1.00 0.00 N1+ ATOM 892 H LYS A 58 14.807 -0.459 -1.163 1.00 0.00 H ATOM 893 HA LYS A 58 14.358 -2.690 -2.826 1.00 0.00 H ATOM 894 HB2 LYS A 58 16.522 -2.528 -1.813 1.00 0.00 H ATOM 895 HB3 LYS A 58 15.839 -2.403 -0.203 1.00 0.00 H ATOM 896 HG2 LYS A 58 16.924 -4.579 -0.622 1.00 0.00 H ATOM 897 HG3 LYS A 58 15.214 -4.733 -0.233 1.00 0.00 H ATOM 898 HD2 LYS A 58 14.744 -4.914 -2.678 1.00 0.00 H ATOM 899 HD3 LYS A 58 16.486 -4.925 -2.966 1.00 0.00 H ATOM 900 HE2 LYS A 58 16.750 -6.967 -1.771 1.00 0.00 H ATOM 901 HE3 LYS A 58 15.103 -6.886 -1.149 1.00 0.00 H ATOM 902 HZ1 LYS A 58 14.330 -7.032 -3.430 1.00 0.00 H ATOM 903 HZ2 LYS A 58 15.866 -7.465 -4.000 1.00 0.00 H ATOM 904 HZ3 LYS A 58 14.926 -8.387 -2.866 1.00 0.00 H ATOM 905 N ALA A 59 12.886 -2.830 0.091 1.00 0.00 N ATOM 906 CA ALA A 59 11.776 -3.415 0.819 1.00 0.00 C ATOM 907 C ALA A 59 10.449 -3.110 0.132 1.00 0.00 C ATOM 908 O ALA A 59 9.539 -3.919 0.145 1.00 0.00 O ATOM 909 CB ALA A 59 11.762 -2.896 2.246 1.00 0.00 C ATOM 910 H ALA A 59 13.462 -2.157 0.538 1.00 0.00 H ATOM 911 HA ALA A 59 11.911 -4.486 0.845 1.00 0.00 H ATOM 912 HB1 ALA A 59 11.593 -1.829 2.240 1.00 0.00 H ATOM 913 HB2 ALA A 59 10.970 -3.387 2.791 1.00 0.00 H ATOM 914 HB3 ALA A 59 12.710 -3.107 2.718 1.00 0.00 H ATOM 915 N MET A 60 10.370 -1.953 -0.499 1.00 0.00 N ATOM 916 CA MET A 60 9.155 -1.522 -1.172 1.00 0.00 C ATOM 917 C MET A 60 8.928 -2.310 -2.472 1.00 0.00 C ATOM 918 O MET A 60 7.833 -2.797 -2.717 1.00 0.00 O ATOM 919 CB MET A 60 9.196 0.007 -1.395 1.00 0.00 C ATOM 920 CG MET A 60 7.949 0.638 -2.032 1.00 0.00 C ATOM 921 SD MET A 60 7.873 0.484 -3.824 1.00 0.00 S ATOM 922 CE MET A 60 9.347 1.370 -4.319 1.00 0.00 C ATOM 923 H MET A 60 11.165 -1.379 -0.498 1.00 0.00 H ATOM 924 HA MET A 60 8.337 -1.751 -0.505 1.00 0.00 H ATOM 925 HB2 MET A 60 9.350 0.481 -0.437 1.00 0.00 H ATOM 926 HB3 MET A 60 10.048 0.228 -2.019 1.00 0.00 H ATOM 927 HG2 MET A 60 7.080 0.146 -1.624 1.00 0.00 H ATOM 928 HG3 MET A 60 7.906 1.684 -1.774 1.00 0.00 H ATOM 929 HE1 MET A 60 10.226 0.881 -3.928 1.00 0.00 H ATOM 930 HE2 MET A 60 9.403 1.388 -5.398 1.00 0.00 H ATOM 931 HE3 MET A 60 9.300 2.384 -3.951 1.00 0.00 H ATOM 932 N ARG A 61 9.983 -2.478 -3.265 1.00 0.00 N ATOM 933 CA ARG A 61 9.908 -3.205 -4.549 1.00 0.00 C ATOM 934 C ARG A 61 9.508 -4.650 -4.316 1.00 0.00 C ATOM 935 O ARG A 61 8.613 -5.178 -4.982 1.00 0.00 O ATOM 936 CB ARG A 61 11.261 -3.154 -5.273 1.00 0.00 C ATOM 937 CG ARG A 61 11.713 -1.755 -5.654 1.00 0.00 C ATOM 938 CD ARG A 61 10.981 -1.198 -6.875 1.00 0.00 C ATOM 939 NE ARG A 61 11.182 0.267 -7.061 1.00 0.00 N ATOM 940 CZ ARG A 61 12.331 0.989 -6.957 1.00 0.00 C ATOM 941 NH1 ARG A 61 13.522 0.408 -6.803 1.00 0.00 N1+ ATOM 942 NH2 ARG A 61 12.257 2.304 -7.064 1.00 0.00 N ATOM 943 H ARG A 61 10.847 -2.109 -2.967 1.00 0.00 H ATOM 944 HA ARG A 61 9.157 -2.736 -5.167 1.00 0.00 H ATOM 945 HB2 ARG A 61 12.012 -3.587 -4.628 1.00 0.00 H ATOM 946 HB3 ARG A 61 11.195 -3.747 -6.174 1.00 0.00 H ATOM 947 HG2 ARG A 61 11.535 -1.095 -4.817 1.00 0.00 H ATOM 948 HG3 ARG A 61 12.772 -1.787 -5.861 1.00 0.00 H ATOM 949 HD2 ARG A 61 11.339 -1.709 -7.755 1.00 0.00 H ATOM 950 HD3 ARG A 61 9.924 -1.390 -6.760 1.00 0.00 H ATOM 951 HE ARG A 61 10.364 0.799 -7.256 1.00 0.00 H ATOM 952 HH11 ARG A 61 13.650 -0.580 -6.773 1.00 0.00 H ATOM 953 HH12 ARG A 61 14.366 0.958 -6.646 1.00 0.00 H ATOM 954 HH21 ARG A 61 11.353 2.725 -7.228 1.00 0.00 H ATOM 955 HH22 ARG A 61 13.055 2.908 -6.976 1.00 0.00 H ATOM 956 N ASP A 62 10.147 -5.262 -3.346 1.00 0.00 N ATOM 957 CA ASP A 62 9.881 -6.650 -2.973 1.00 0.00 C ATOM 958 C ASP A 62 8.501 -6.794 -2.360 1.00 0.00 C ATOM 959 O ASP A 62 7.873 -7.848 -2.450 1.00 0.00 O ATOM 960 CB ASP A 62 10.961 -7.176 -2.011 1.00 0.00 C ATOM 961 CG ASP A 62 12.303 -7.430 -2.687 1.00 0.00 C ATOM 962 OD1 ASP A 62 12.822 -6.537 -3.412 1.00 0.00 O1- ATOM 963 OD2 ASP A 62 12.899 -8.520 -2.504 1.00 0.00 O ATOM 964 H ASP A 62 10.857 -4.790 -2.855 1.00 0.00 H ATOM 965 HA ASP A 62 9.911 -7.237 -3.879 1.00 0.00 H ATOM 966 HB2 ASP A 62 11.118 -6.432 -1.243 1.00 0.00 H ATOM 967 HB3 ASP A 62 10.625 -8.088 -1.543 1.00 0.00 H ATOM 968 N ALA A 63 8.002 -5.717 -1.779 1.00 0.00 N ATOM 969 CA ALA A 63 6.691 -5.733 -1.170 1.00 0.00 C ATOM 970 C ALA A 63 5.625 -5.650 -2.228 1.00 0.00 C ATOM 971 O ALA A 63 4.526 -6.170 -2.051 1.00 0.00 O ATOM 972 CB ALA A 63 6.527 -4.598 -0.186 1.00 0.00 C ATOM 973 H ALA A 63 8.528 -4.887 -1.771 1.00 0.00 H ATOM 974 HA ALA A 63 6.583 -6.667 -0.639 1.00 0.00 H ATOM 975 HB1 ALA A 63 6.572 -3.652 -0.706 1.00 0.00 H ATOM 976 HB2 ALA A 63 5.571 -4.696 0.304 1.00 0.00 H ATOM 977 HB3 ALA A 63 7.313 -4.642 0.554 1.00 0.00 H ATOM 978 N ILE A 64 5.961 -5.008 -3.342 1.00 0.00 N ATOM 979 CA ILE A 64 5.034 -4.857 -4.439 1.00 0.00 C ATOM 980 C ILE A 64 4.688 -6.207 -5.015 1.00 0.00 C ATOM 981 O ILE A 64 3.566 -6.637 -4.902 1.00 0.00 O ATOM 982 CB ILE A 64 5.617 -3.939 -5.551 1.00 0.00 C ATOM 983 CG1 ILE A 64 5.768 -2.511 -5.029 1.00 0.00 C ATOM 984 CG2 ILE A 64 4.757 -3.967 -6.817 1.00 0.00 C ATOM 985 CD1 ILE A 64 6.439 -1.571 -5.996 1.00 0.00 C ATOM 986 H ILE A 64 6.862 -4.623 -3.408 1.00 0.00 H ATOM 987 HA ILE A 64 4.135 -4.402 -4.054 1.00 0.00 H ATOM 988 HB ILE A 64 6.597 -4.315 -5.809 1.00 0.00 H ATOM 989 HG12 ILE A 64 4.792 -2.106 -4.808 1.00 0.00 H ATOM 990 HG13 ILE A 64 6.355 -2.530 -4.122 1.00 0.00 H ATOM 991 HG21 ILE A 64 3.760 -3.625 -6.583 1.00 0.00 H ATOM 992 HG22 ILE A 64 5.193 -3.319 -7.564 1.00 0.00 H ATOM 993 HG23 ILE A 64 4.710 -4.976 -7.198 1.00 0.00 H ATOM 994 HD11 ILE A 64 5.872 -1.517 -6.914 1.00 0.00 H ATOM 995 HD12 ILE A 64 6.498 -0.592 -5.542 1.00 0.00 H ATOM 996 HD13 ILE A 64 7.438 -1.935 -6.188 1.00 0.00 H ATOM 997 N GLU A 65 5.684 -6.930 -5.469 1.00 0.00 N ATOM 998 CA GLU A 65 5.455 -8.210 -6.097 1.00 0.00 C ATOM 999 C GLU A 65 5.181 -9.300 -5.071 1.00 0.00 C ATOM 1000 O GLU A 65 4.683 -10.367 -5.393 1.00 0.00 O ATOM 1001 CB GLU A 65 6.609 -8.549 -7.018 1.00 0.00 C ATOM 1002 CG GLU A 65 6.714 -7.606 -8.215 1.00 0.00 C ATOM 1003 CD GLU A 65 5.465 -7.633 -9.101 1.00 0.00 C ATOM 1004 OE1 GLU A 65 4.482 -6.916 -8.788 1.00 0.00 O1- ATOM 1005 OE2 GLU A 65 5.467 -8.365 -10.102 1.00 0.00 O ATOM 1006 H GLU A 65 6.610 -6.612 -5.431 1.00 0.00 H ATOM 1007 HA GLU A 65 4.564 -8.098 -6.695 1.00 0.00 H ATOM 1008 HB2 GLU A 65 7.528 -8.498 -6.453 1.00 0.00 H ATOM 1009 HB3 GLU A 65 6.471 -9.553 -7.379 1.00 0.00 H ATOM 1010 HG2 GLU A 65 6.852 -6.598 -7.850 1.00 0.00 H ATOM 1011 HG3 GLU A 65 7.567 -7.891 -8.812 1.00 0.00 H ATOM 1012 N GLY A 66 5.517 -9.015 -3.827 1.00 0.00 N ATOM 1013 CA GLY A 66 5.226 -9.934 -2.759 1.00 0.00 C ATOM 1014 C GLY A 66 3.763 -9.879 -2.348 1.00 0.00 C ATOM 1015 O GLY A 66 3.291 -10.742 -1.631 1.00 0.00 O ATOM 1016 H GLY A 66 5.991 -8.179 -3.637 1.00 0.00 H ATOM 1017 HA2 GLY A 66 5.465 -10.936 -3.084 1.00 0.00 H ATOM 1018 HA3 GLY A 66 5.837 -9.683 -1.904 1.00 0.00 H ATOM 1019 N MET A 67 3.061 -8.839 -2.780 1.00 0.00 N ATOM 1020 CA MET A 67 1.639 -8.684 -2.474 1.00 0.00 C ATOM 1021 C MET A 67 0.780 -8.620 -3.735 1.00 0.00 C ATOM 1022 O MET A 67 -0.390 -8.984 -3.714 1.00 0.00 O ATOM 1023 CB MET A 67 1.412 -7.416 -1.651 1.00 0.00 C ATOM 1024 CG MET A 67 1.748 -7.522 -0.176 1.00 0.00 C ATOM 1025 SD MET A 67 0.568 -8.546 0.721 1.00 0.00 S ATOM 1026 CE MET A 67 1.147 -8.336 2.397 1.00 0.00 C ATOM 1027 H MET A 67 3.523 -8.159 -3.315 1.00 0.00 H ATOM 1028 HA MET A 67 1.329 -9.532 -1.882 1.00 0.00 H ATOM 1029 HB2 MET A 67 2.026 -6.631 -2.068 1.00 0.00 H ATOM 1030 HB3 MET A 67 0.375 -7.129 -1.744 1.00 0.00 H ATOM 1031 HG2 MET A 67 2.732 -7.957 -0.073 1.00 0.00 H ATOM 1032 HG3 MET A 67 1.747 -6.532 0.256 1.00 0.00 H ATOM 1033 HE1 MET A 67 1.098 -7.290 2.666 1.00 0.00 H ATOM 1034 HE2 MET A 67 0.529 -8.911 3.069 1.00 0.00 H ATOM 1035 HE3 MET A 67 2.168 -8.678 2.463 1.00 0.00 H ATOM 1036 N ASN A 68 1.367 -8.182 -4.814 1.00 0.00 N ATOM 1037 CA ASN A 68 0.669 -7.988 -6.082 1.00 0.00 C ATOM 1038 C ASN A 68 0.160 -9.304 -6.642 1.00 0.00 C ATOM 1039 O ASN A 68 0.928 -10.216 -6.916 1.00 0.00 O ATOM 1040 CB ASN A 68 1.612 -7.306 -7.087 1.00 0.00 C ATOM 1041 CG ASN A 68 0.983 -6.986 -8.424 1.00 0.00 C ATOM 1042 OD1 ASN A 68 -0.231 -6.739 -8.522 1.00 0.00 O ATOM 1043 ND2 ASN A 68 1.802 -6.926 -9.443 1.00 0.00 N ATOM 1044 H ASN A 68 2.322 -7.951 -4.796 1.00 0.00 H ATOM 1045 HA ASN A 68 -0.171 -7.333 -5.906 1.00 0.00 H ATOM 1046 HB2 ASN A 68 1.970 -6.381 -6.662 1.00 0.00 H ATOM 1047 HB3 ASN A 68 2.457 -7.957 -7.256 1.00 0.00 H ATOM 1048 HD21 ASN A 68 2.769 -7.083 -9.263 1.00 0.00 H ATOM 1049 HD22 ASN A 68 1.464 -6.736 -10.338 1.00 0.00 H ATOM 1050 N GLY A 69 -1.144 -9.413 -6.749 1.00 0.00 N ATOM 1051 CA GLY A 69 -1.733 -10.577 -7.335 1.00 0.00 C ATOM 1052 C GLY A 69 -2.310 -11.536 -6.321 1.00 0.00 C ATOM 1053 O GLY A 69 -3.191 -12.332 -6.659 1.00 0.00 O ATOM 1054 H GLY A 69 -1.726 -8.692 -6.417 1.00 0.00 H ATOM 1055 HA2 GLY A 69 -2.523 -10.267 -8.003 1.00 0.00 H ATOM 1056 HA3 GLY A 69 -0.978 -11.093 -7.909 1.00 0.00 H ATOM 1057 N GLN A 70 -1.858 -11.465 -5.078 1.00 0.00 N ATOM 1058 CA GLN A 70 -2.333 -12.417 -4.090 1.00 0.00 C ATOM 1059 C GLN A 70 -3.588 -11.919 -3.395 1.00 0.00 C ATOM 1060 O GLN A 70 -4.040 -10.784 -3.629 1.00 0.00 O ATOM 1061 CB GLN A 70 -1.267 -12.797 -3.049 1.00 0.00 C ATOM 1062 CG GLN A 70 -0.923 -11.735 -2.021 1.00 0.00 C ATOM 1063 CD GLN A 70 -0.031 -12.300 -0.933 1.00 0.00 C ATOM 1064 OE1 GLN A 70 -0.079 -13.487 -0.629 1.00 0.00 O ATOM 1065 NE2 GLN A 70 0.737 -11.470 -0.308 1.00 0.00 N ATOM 1066 H GLN A 70 -1.223 -10.758 -4.830 1.00 0.00 H ATOM 1067 HA GLN A 70 -2.606 -13.305 -4.640 1.00 0.00 H ATOM 1068 HB2 GLN A 70 -1.637 -13.637 -2.485 1.00 0.00 H ATOM 1069 HB3 GLN A 70 -0.359 -13.084 -3.559 1.00 0.00 H ATOM 1070 HG2 GLN A 70 -0.411 -10.920 -2.512 1.00 0.00 H ATOM 1071 HG3 GLN A 70 -1.835 -11.373 -1.569 1.00 0.00 H ATOM 1072 HE21 GLN A 70 0.712 -10.520 -0.547 1.00 0.00 H ATOM 1073 HE22 GLN A 70 1.331 -11.834 0.377 1.00 0.00 H ATOM 1074 N ASP A 71 -4.136 -12.761 -2.547 1.00 0.00 N ATOM 1075 CA ASP A 71 -5.331 -12.440 -1.806 1.00 0.00 C ATOM 1076 C ASP A 71 -4.953 -11.843 -0.483 1.00 0.00 C ATOM 1077 O ASP A 71 -4.026 -12.314 0.186 1.00 0.00 O ATOM 1078 CB ASP A 71 -6.192 -13.688 -1.552 1.00 0.00 C ATOM 1079 CG ASP A 71 -7.505 -13.362 -0.831 1.00 0.00 C ATOM 1080 OD1 ASP A 71 -7.503 -13.159 0.418 1.00 0.00 O1- ATOM 1081 OD2 ASP A 71 -8.535 -13.281 -1.506 1.00 0.00 O ATOM 1082 H ASP A 71 -3.708 -13.621 -2.371 1.00 0.00 H ATOM 1083 HA ASP A 71 -5.911 -11.726 -2.371 1.00 0.00 H ATOM 1084 HB2 ASP A 71 -6.429 -14.154 -2.497 1.00 0.00 H ATOM 1085 HB3 ASP A 71 -5.633 -14.384 -0.944 1.00 0.00 H ATOM 1086 N LEU A 72 -5.616 -10.805 -0.140 1.00 0.00 N ATOM 1087 CA LEU A 72 -5.474 -10.197 1.121 1.00 0.00 C ATOM 1088 C LEU A 72 -6.851 -9.871 1.622 1.00 0.00 C ATOM 1089 O LEU A 72 -7.533 -9.037 1.034 1.00 0.00 O ATOM 1090 CB LEU A 72 -4.609 -8.928 1.042 1.00 0.00 C ATOM 1091 CG LEU A 72 -4.404 -8.164 2.363 1.00 0.00 C ATOM 1092 CD1 LEU A 72 -3.720 -9.042 3.404 1.00 0.00 C ATOM 1093 CD2 LEU A 72 -3.604 -6.890 2.131 1.00 0.00 C ATOM 1094 H LEU A 72 -6.267 -10.424 -0.774 1.00 0.00 H ATOM 1095 HA LEU A 72 -5.009 -10.909 1.786 1.00 0.00 H ATOM 1096 HB2 LEU A 72 -3.637 -9.210 0.665 1.00 0.00 H ATOM 1097 HB3 LEU A 72 -5.065 -8.254 0.332 1.00 0.00 H ATOM 1098 HG LEU A 72 -5.372 -7.890 2.757 1.00 0.00 H ATOM 1099 HD11 LEU A 72 -2.768 -9.380 3.023 1.00 0.00 H ATOM 1100 HD12 LEU A 72 -3.565 -8.472 4.307 1.00 0.00 H ATOM 1101 HD13 LEU A 72 -4.349 -9.893 3.623 1.00 0.00 H ATOM 1102 HD21 LEU A 72 -4.134 -6.253 1.438 1.00 0.00 H ATOM 1103 HD22 LEU A 72 -3.476 -6.371 3.070 1.00 0.00 H ATOM 1104 HD23 LEU A 72 -2.637 -7.140 1.723 1.00 0.00 H ATOM 1105 N ASP A 73 -7.280 -10.607 2.645 1.00 0.00 N ATOM 1106 CA ASP A 73 -8.559 -10.364 3.346 1.00 0.00 C ATOM 1107 C ASP A 73 -9.789 -10.672 2.430 1.00 0.00 C ATOM 1108 O ASP A 73 -10.889 -10.145 2.602 1.00 0.00 O ATOM 1109 CB ASP A 73 -8.541 -8.909 3.932 1.00 0.00 C ATOM 1110 CG ASP A 73 -9.793 -8.456 4.681 1.00 0.00 C ATOM 1111 OD1 ASP A 73 -10.156 -9.085 5.681 1.00 0.00 O1- ATOM 1112 OD2 ASP A 73 -10.395 -7.411 4.268 1.00 0.00 O ATOM 1113 H ASP A 73 -6.732 -11.373 2.909 1.00 0.00 H ATOM 1114 HA ASP A 73 -8.579 -11.068 4.165 1.00 0.00 H ATOM 1115 HB2 ASP A 73 -7.716 -8.833 4.625 1.00 0.00 H ATOM 1116 HB3 ASP A 73 -8.357 -8.223 3.119 1.00 0.00 H ATOM 1117 N GLY A 74 -9.598 -11.589 1.480 1.00 0.00 N ATOM 1118 CA GLY A 74 -10.701 -12.022 0.640 1.00 0.00 C ATOM 1119 C GLY A 74 -10.784 -11.268 -0.664 1.00 0.00 C ATOM 1120 O GLY A 74 -11.825 -11.295 -1.353 1.00 0.00 O ATOM 1121 H GLY A 74 -8.716 -12.002 1.314 1.00 0.00 H ATOM 1122 HA2 GLY A 74 -10.580 -13.072 0.424 1.00 0.00 H ATOM 1123 HA3 GLY A 74 -11.624 -11.883 1.183 1.00 0.00 H ATOM 1124 N ARG A 75 -9.749 -10.540 -0.972 1.00 0.00 N ATOM 1125 CA ARG A 75 -9.663 -9.814 -2.204 1.00 0.00 C ATOM 1126 C ARG A 75 -8.261 -9.907 -2.760 1.00 0.00 C ATOM 1127 O ARG A 75 -7.293 -9.844 -2.020 1.00 0.00 O ATOM 1128 CB ARG A 75 -10.028 -8.369 -1.966 1.00 0.00 C ATOM 1129 CG ARG A 75 -9.967 -7.451 -3.169 1.00 0.00 C ATOM 1130 CD ARG A 75 -10.987 -7.781 -4.226 1.00 0.00 C ATOM 1131 NE ARG A 75 -11.172 -6.632 -5.143 1.00 0.00 N ATOM 1132 CZ ARG A 75 -10.653 -6.500 -6.383 1.00 0.00 C ATOM 1133 NH1 ARG A 75 -9.830 -7.417 -6.880 1.00 0.00 N1+ ATOM 1134 NH2 ARG A 75 -10.943 -5.411 -7.112 1.00 0.00 N ATOM 1135 H ARG A 75 -8.994 -10.520 -0.345 1.00 0.00 H ATOM 1136 HA ARG A 75 -10.362 -10.240 -2.907 1.00 0.00 H ATOM 1137 HB2 ARG A 75 -11.030 -8.324 -1.568 1.00 0.00 H ATOM 1138 HB3 ARG A 75 -9.346 -7.983 -1.225 1.00 0.00 H ATOM 1139 HG2 ARG A 75 -10.118 -6.434 -2.853 1.00 0.00 H ATOM 1140 HG3 ARG A 75 -8.981 -7.533 -3.602 1.00 0.00 H ATOM 1141 HD2 ARG A 75 -10.652 -8.646 -4.779 1.00 0.00 H ATOM 1142 HD3 ARG A 75 -11.924 -7.995 -3.733 1.00 0.00 H ATOM 1143 HE ARG A 75 -11.742 -5.937 -4.745 1.00 0.00 H ATOM 1144 HH11 ARG A 75 -9.551 -8.243 -6.376 1.00 0.00 H ATOM 1145 HH12 ARG A 75 -9.401 -7.352 -7.780 1.00 0.00 H ATOM 1146 HH21 ARG A 75 -11.539 -4.685 -6.763 1.00 0.00 H ATOM 1147 HH22 ARG A 75 -10.571 -5.278 -8.033 1.00 0.00 H ATOM 1148 N ASN A 76 -8.156 -10.023 -4.049 1.00 0.00 N ATOM 1149 CA ASN A 76 -6.868 -10.035 -4.696 1.00 0.00 C ATOM 1150 C ASN A 76 -6.445 -8.616 -4.989 1.00 0.00 C ATOM 1151 O ASN A 76 -7.130 -7.871 -5.703 1.00 0.00 O ATOM 1152 CB ASN A 76 -6.835 -10.919 -5.951 1.00 0.00 C ATOM 1153 CG ASN A 76 -7.793 -10.518 -7.050 1.00 0.00 C ATOM 1154 OD1 ASN A 76 -8.907 -10.020 -6.812 1.00 0.00 O ATOM 1155 ND2 ASN A 76 -7.357 -10.705 -8.256 1.00 0.00 N ATOM 1156 H ASN A 76 -8.970 -10.074 -4.587 1.00 0.00 H ATOM 1157 HA ASN A 76 -6.136 -10.398 -3.992 1.00 0.00 H ATOM 1158 HB2 ASN A 76 -5.838 -10.890 -6.363 1.00 0.00 H ATOM 1159 HB3 ASN A 76 -7.054 -11.936 -5.659 1.00 0.00 H ATOM 1160 HD21 ASN A 76 -6.454 -11.081 -8.315 1.00 0.00 H ATOM 1161 HD22 ASN A 76 -7.925 -10.480 -9.019 1.00 0.00 H ATOM 1162 N ILE A 77 -5.348 -8.250 -4.412 1.00 0.00 N ATOM 1163 CA ILE A 77 -4.844 -6.895 -4.445 1.00 0.00 C ATOM 1164 C ILE A 77 -3.842 -6.666 -5.577 1.00 0.00 C ATOM 1165 O ILE A 77 -3.143 -7.587 -6.014 1.00 0.00 O ATOM 1166 CB ILE A 77 -4.172 -6.546 -3.093 1.00 0.00 C ATOM 1167 CG1 ILE A 77 -3.169 -7.647 -2.710 1.00 0.00 C ATOM 1168 CG2 ILE A 77 -5.227 -6.374 -2.005 1.00 0.00 C ATOM 1169 CD1 ILE A 77 -2.327 -7.341 -1.500 1.00 0.00 C ATOM 1170 H ILE A 77 -4.829 -8.941 -3.943 1.00 0.00 H ATOM 1171 HA ILE A 77 -5.680 -6.222 -4.571 1.00 0.00 H ATOM 1172 HB ILE A 77 -3.640 -5.613 -3.206 1.00 0.00 H ATOM 1173 HG12 ILE A 77 -3.726 -8.543 -2.477 1.00 0.00 H ATOM 1174 HG13 ILE A 77 -2.523 -7.859 -3.547 1.00 0.00 H ATOM 1175 HG21 ILE A 77 -5.779 -7.295 -1.893 1.00 0.00 H ATOM 1176 HG22 ILE A 77 -4.746 -6.127 -1.070 1.00 0.00 H ATOM 1177 HG23 ILE A 77 -5.905 -5.581 -2.284 1.00 0.00 H ATOM 1178 HD11 ILE A 77 -2.973 -7.183 -0.649 1.00 0.00 H ATOM 1179 HD12 ILE A 77 -1.673 -8.181 -1.314 1.00 0.00 H ATOM 1180 HD13 ILE A 77 -1.741 -6.455 -1.688 1.00 0.00 H ATOM 1181 N THR A 78 -3.798 -5.449 -6.052 1.00 0.00 N ATOM 1182 CA THR A 78 -2.859 -5.024 -7.059 1.00 0.00 C ATOM 1183 C THR A 78 -1.928 -4.000 -6.424 1.00 0.00 C ATOM 1184 O THR A 78 -2.393 -3.021 -5.832 1.00 0.00 O ATOM 1185 CB THR A 78 -3.609 -4.377 -8.245 1.00 0.00 C ATOM 1186 OG1 THR A 78 -4.580 -5.314 -8.744 1.00 0.00 O ATOM 1187 CG2 THR A 78 -2.643 -3.978 -9.373 1.00 0.00 C ATOM 1188 H THR A 78 -4.422 -4.767 -5.710 1.00 0.00 H ATOM 1189 HA THR A 78 -2.296 -5.879 -7.405 1.00 0.00 H ATOM 1190 HB THR A 78 -4.125 -3.500 -7.883 1.00 0.00 H ATOM 1191 HG1 THR A 78 -4.544 -6.071 -8.151 1.00 0.00 H ATOM 1192 HG21 THR A 78 -2.116 -4.850 -9.730 1.00 0.00 H ATOM 1193 HG22 THR A 78 -3.199 -3.537 -10.189 1.00 0.00 H ATOM 1194 HG23 THR A 78 -1.928 -3.251 -9.012 1.00 0.00 H ATOM 1195 N VAL A 79 -0.646 -4.231 -6.501 1.00 0.00 N ATOM 1196 CA VAL A 79 0.312 -3.332 -5.893 1.00 0.00 C ATOM 1197 C VAL A 79 1.288 -2.877 -6.957 1.00 0.00 C ATOM 1198 O VAL A 79 1.651 -3.651 -7.827 1.00 0.00 O ATOM 1199 CB VAL A 79 1.089 -4.013 -4.716 1.00 0.00 C ATOM 1200 CG1 VAL A 79 1.982 -3.014 -3.990 1.00 0.00 C ATOM 1201 CG2 VAL A 79 0.135 -4.672 -3.733 1.00 0.00 C ATOM 1202 H VAL A 79 -0.307 -4.995 -7.019 1.00 0.00 H ATOM 1203 HA VAL A 79 -0.225 -2.475 -5.517 1.00 0.00 H ATOM 1204 HB VAL A 79 1.726 -4.777 -5.137 1.00 0.00 H ATOM 1205 HG11 VAL A 79 1.380 -2.190 -3.637 1.00 0.00 H ATOM 1206 HG12 VAL A 79 2.459 -3.491 -3.147 1.00 0.00 H ATOM 1207 HG13 VAL A 79 2.727 -2.639 -4.675 1.00 0.00 H ATOM 1208 HG21 VAL A 79 -0.461 -5.414 -4.245 1.00 0.00 H ATOM 1209 HG22 VAL A 79 0.700 -5.142 -2.942 1.00 0.00 H ATOM 1210 HG23 VAL A 79 -0.511 -3.918 -3.310 1.00 0.00 H ATOM 1211 N ASN A 80 1.653 -1.627 -6.919 1.00 0.00 N ATOM 1212 CA ASN A 80 2.603 -1.053 -7.855 1.00 0.00 C ATOM 1213 C ASN A 80 3.267 0.158 -7.213 1.00 0.00 C ATOM 1214 O ASN A 80 2.880 0.560 -6.123 1.00 0.00 O ATOM 1215 CB ASN A 80 1.929 -0.704 -9.216 1.00 0.00 C ATOM 1216 CG ASN A 80 0.789 0.311 -9.130 1.00 0.00 C ATOM 1217 OD1 ASN A 80 0.129 0.445 -8.129 1.00 0.00 O ATOM 1218 ND2 ASN A 80 0.517 0.976 -10.218 1.00 0.00 N ATOM 1219 H ASN A 80 1.263 -1.032 -6.237 1.00 0.00 H ATOM 1220 HA ASN A 80 3.370 -1.799 -8.016 1.00 0.00 H ATOM 1221 HB2 ASN A 80 2.677 -0.298 -9.880 1.00 0.00 H ATOM 1222 HB3 ASN A 80 1.542 -1.616 -9.648 1.00 0.00 H ATOM 1223 HD21 ASN A 80 1.043 0.787 -11.019 1.00 0.00 H ATOM 1224 HD22 ASN A 80 -0.208 1.634 -10.167 1.00 0.00 H ATOM 1225 N GLU A 81 4.272 0.722 -7.847 1.00 0.00 N ATOM 1226 CA GLU A 81 4.983 1.838 -7.266 1.00 0.00 C ATOM 1227 C GLU A 81 4.213 3.132 -7.490 1.00 0.00 C ATOM 1228 O GLU A 81 3.837 3.456 -8.617 1.00 0.00 O ATOM 1229 CB GLU A 81 6.409 1.950 -7.846 1.00 0.00 C ATOM 1230 CG GLU A 81 7.266 3.025 -7.178 1.00 0.00 C ATOM 1231 CD GLU A 81 8.659 3.140 -7.763 1.00 0.00 C ATOM 1232 OE1 GLU A 81 9.495 2.259 -7.485 1.00 0.00 O ATOM 1233 OE2 GLU A 81 8.942 4.129 -8.466 1.00 0.00 O1- ATOM 1234 H GLU A 81 4.550 0.413 -8.731 1.00 0.00 H ATOM 1235 HA GLU A 81 5.054 1.660 -6.203 1.00 0.00 H ATOM 1236 HB2 GLU A 81 6.907 1.000 -7.731 1.00 0.00 H ATOM 1237 HB3 GLU A 81 6.336 2.182 -8.899 1.00 0.00 H ATOM 1238 HG2 GLU A 81 6.771 3.978 -7.287 1.00 0.00 H ATOM 1239 HG3 GLU A 81 7.350 2.791 -6.126 1.00 0.00 H ATOM 1240 N ALA A 82 3.951 3.839 -6.410 1.00 0.00 N ATOM 1241 CA ALA A 82 3.305 5.135 -6.478 1.00 0.00 C ATOM 1242 C ALA A 82 4.390 6.178 -6.610 1.00 0.00 C ATOM 1243 O ALA A 82 4.165 7.270 -7.145 1.00 0.00 O ATOM 1244 CB ALA A 82 2.477 5.387 -5.225 1.00 0.00 C ATOM 1245 H ALA A 82 4.220 3.495 -5.532 1.00 0.00 H ATOM 1246 HA ALA A 82 2.667 5.159 -7.350 1.00 0.00 H ATOM 1247 HB1 ALA A 82 3.136 5.370 -4.369 1.00 0.00 H ATOM 1248 HB2 ALA A 82 1.985 6.346 -5.287 1.00 0.00 H ATOM 1249 HB3 ALA A 82 1.738 4.609 -5.110 1.00 0.00 H ATOM 1250 N GLN A 83 5.573 5.787 -6.106 1.00 0.00 N ATOM 1251 CA GLN A 83 6.824 6.539 -6.147 1.00 0.00 C ATOM 1252 C GLN A 83 6.806 7.722 -5.153 1.00 0.00 C ATOM 1253 O GLN A 83 5.773 8.011 -4.549 1.00 0.00 O ATOM 1254 CB GLN A 83 7.148 6.935 -7.596 1.00 0.00 C ATOM 1255 CG GLN A 83 8.557 7.412 -7.864 1.00 0.00 C ATOM 1256 CD GLN A 83 8.817 7.517 -9.345 1.00 0.00 C ATOM 1257 OE1 GLN A 83 8.607 8.572 -9.967 1.00 0.00 O ATOM 1258 NE2 GLN A 83 9.195 6.418 -9.938 1.00 0.00 N ATOM 1259 H GLN A 83 5.583 4.912 -5.664 1.00 0.00 H ATOM 1260 HA GLN A 83 7.584 5.855 -5.795 1.00 0.00 H ATOM 1261 HB2 GLN A 83 6.972 6.081 -8.232 1.00 0.00 H ATOM 1262 HB3 GLN A 83 6.465 7.718 -7.889 1.00 0.00 H ATOM 1263 HG2 GLN A 83 8.692 8.385 -7.414 1.00 0.00 H ATOM 1264 HG3 GLN A 83 9.258 6.711 -7.436 1.00 0.00 H ATOM 1265 HE21 GLN A 83 9.267 5.597 -9.379 1.00 0.00 H ATOM 1266 HE22 GLN A 83 9.400 6.421 -10.893 1.00 0.00 H ATOM 1267 N SER A 84 7.958 8.337 -4.944 1.00 0.00 N ATOM 1268 CA SER A 84 8.136 9.430 -4.005 1.00 0.00 C ATOM 1269 C SER A 84 7.296 10.660 -4.383 1.00 0.00 C ATOM 1270 O SER A 84 7.648 11.400 -5.322 1.00 0.00 O ATOM 1271 CB SER A 84 9.608 9.790 -3.984 1.00 0.00 C ATOM 1272 OG SER A 84 10.389 8.607 -3.885 1.00 0.00 O ATOM 1273 H SER A 84 8.769 8.058 -5.420 1.00 0.00 H ATOM 1274 HA SER A 84 7.857 9.084 -3.022 1.00 0.00 H ATOM 1275 HB2 SER A 84 9.866 10.308 -4.895 1.00 0.00 H ATOM 1276 HB3 SER A 84 9.820 10.419 -3.132 1.00 0.00 H ATOM 1277 HG SER A 84 10.197 8.181 -3.036 1.00 0.00 H ATOM 1278 N ARG A 85 6.173 10.827 -3.672 1.00 0.00 N ATOM 1279 CA ARG A 85 5.201 11.912 -3.828 1.00 0.00 C ATOM 1280 C ARG A 85 3.965 11.675 -2.944 1.00 0.00 C ATOM 1281 O ARG A 85 2.929 11.160 -3.399 1.00 0.00 O ATOM 1282 CB ARG A 85 4.805 12.131 -5.303 1.00 0.00 C ATOM 1283 CG ARG A 85 4.453 10.866 -6.073 1.00 0.00 C ATOM 1284 CD ARG A 85 4.396 11.143 -7.556 1.00 0.00 C ATOM 1285 NE ARG A 85 4.373 9.903 -8.330 1.00 0.00 N ATOM 1286 CZ ARG A 85 5.341 9.504 -9.176 1.00 0.00 C ATOM 1287 NH1 ARG A 85 6.457 10.229 -9.318 1.00 0.00 N1+ ATOM 1288 NH2 ARG A 85 5.218 8.350 -9.829 1.00 0.00 N ATOM 1289 H ARG A 85 5.967 10.181 -2.955 1.00 0.00 H ATOM 1290 HA ARG A 85 5.687 12.804 -3.457 1.00 0.00 H ATOM 1291 HB2 ARG A 85 3.944 12.779 -5.313 1.00 0.00 H ATOM 1292 HB3 ARG A 85 5.633 12.618 -5.795 1.00 0.00 H ATOM 1293 HG2 ARG A 85 5.209 10.118 -5.883 1.00 0.00 H ATOM 1294 HG3 ARG A 85 3.491 10.503 -5.741 1.00 0.00 H ATOM 1295 HD2 ARG A 85 3.501 11.708 -7.770 1.00 0.00 H ATOM 1296 HD3 ARG A 85 5.262 11.722 -7.841 1.00 0.00 H ATOM 1297 HE ARG A 85 3.585 9.336 -8.166 1.00 0.00 H ATOM 1298 HH11 ARG A 85 6.605 11.083 -8.817 1.00 0.00 H ATOM 1299 HH12 ARG A 85 7.220 9.916 -9.897 1.00 0.00 H ATOM 1300 HH21 ARG A 85 4.415 7.764 -9.703 1.00 0.00 H ATOM 1301 HH22 ARG A 85 5.930 8.009 -10.448 1.00 0.00 H TER 1302 ARG A 85