EXPDTA keasar-server_TS3-scwrl MODEL 1 REMARK 44 REMARK 44 model 1 is called keasar-server_TS3-scwrl ATOM 1 N SER A 1 -4.441 -10.146 -18.765 1.00 0.00 ATOM 2 CA SER A 1 -5.771 -9.718 -18.346 1.00 0.00 ATOM 3 CB SER A 1 -6.035 -10.132 -16.897 1.00 0.00 ATOM 4 OG SER A 1 -5.214 -9.403 -16.001 1.00 0.00 ATOM 5 O SER A 1 -4.924 -7.478 -18.506 1.00 0.00 ATOM 6 C SER A 1 -5.919 -8.203 -18.439 1.00 0.00 ATOM 7 N MET A 2 -7.154 -7.713 -18.397 1.00 0.00 ATOM 8 CA MET A 2 -7.414 -6.283 -18.535 1.00 0.00 ATOM 9 CB MET A 2 -8.502 -6.035 -19.582 1.00 0.00 ATOM 10 CG MET A 2 -8.098 -6.412 -20.998 1.00 0.00 ATOM 11 SD MET A 2 -9.397 -6.080 -22.203 1.00 0.00 ATOM 12 CE MET A 2 -10.513 -7.444 -21.883 1.00 0.00 ATOM 13 O MET A 2 -9.085 -5.569 -16.968 1.00 0.00 ATOM 14 C MET A 2 -7.882 -5.663 -17.222 1.00 0.00 ATOM 15 N SER A 3 -6.937 -5.210 -16.403 1.00 0.00 ATOM 16 CA SER A 3 -7.284 -4.545 -15.150 1.00 0.00 ATOM 17 CB SER A 3 -7.274 -5.545 -13.992 1.00 0.00 ATOM 18 OG SER A 3 -7.576 -4.906 -12.764 1.00 0.00 ATOM 19 O SER A 3 -5.080 -3.635 -14.852 1.00 0.00 ATOM 20 C SER A 3 -6.296 -3.429 -14.814 1.00 0.00 ATOM 21 N GLU A 4 -6.820 -2.253 -14.484 1.00 0.00 ATOM 22 CA GLU A 4 -5.987 -1.089 -14.192 1.00 0.00 ATOM 23 CB GLU A 4 -6.853 0.091 -13.745 1.00 0.00 ATOM 24 CG GLU A 4 -7.654 0.733 -14.866 1.00 0.00 ATOM 25 CD GLU A 4 -8.496 1.898 -14.386 1.00 0.00 ATOM 26 OE1 GLU A 4 -8.478 2.183 -13.170 1.00 0.00 ATOM 27 OE2 GLU A 4 -9.174 2.526 -15.226 1.00 0.00 ATOM 28 O GLU A 4 -5.310 -1.781 -11.982 1.00 0.00 ATOM 29 C GLU A 4 -4.959 -1.323 -13.082 1.00 0.00 ATOM 30 N THR A 5 -3.735 -0.898 -13.391 1.00 0.00 ATOM 31 CA THR A 5 -2.549 -1.088 -12.585 1.00 0.00 ATOM 32 CB THR A 5 -1.497 -1.938 -13.321 1.00 0.00 ATOM 33 CG2 THR A 5 -2.018 -3.348 -13.553 1.00 0.00 ATOM 34 OG1 THR A 5 -1.197 -1.340 -14.588 1.00 0.00 ATOM 35 O THR A 5 -1.043 0.748 -12.968 1.00 0.00 ATOM 36 C THR A 5 -1.926 0.276 -12.256 1.00 0.00 ATOM 37 N PHE A 6 -2.303 0.884 -11.141 1.00 0.00 ATOM 38 CA PHE A 6 -1.840 2.232 -10.822 1.00 0.00 ATOM 39 CB PHE A 6 -2.770 2.891 -9.802 1.00 0.00 ATOM 40 CG PHE A 6 -4.104 3.288 -10.366 1.00 0.00 ATOM 41 CD1 PHE A 6 -5.218 2.489 -10.177 1.00 0.00 ATOM 42 CD2 PHE A 6 -4.246 4.462 -11.086 1.00 0.00 ATOM 43 CE1 PHE A 6 -6.446 2.855 -10.696 1.00 0.00 ATOM 44 CE2 PHE A 6 -5.473 4.828 -11.605 1.00 0.00 ATOM 45 CZ PHE A 6 -6.570 4.030 -11.413 1.00 0.00 ATOM 46 O PHE A 6 -0.143 1.359 -9.390 1.00 0.00 ATOM 47 C PHE A 6 -0.433 2.252 -10.228 1.00 0.00 ATOM 48 N ASP A 7 0.304 3.231 -10.782 1.00 0.00 ATOM 49 CA ASP A 7 1.636 3.656 -10.408 1.00 0.00 ATOM 50 CB ASP A 7 2.407 4.145 -11.636 1.00 0.00 ATOM 51 CG ASP A 7 3.827 4.561 -11.305 1.00 0.00 ATOM 52 OD1 ASP A 7 4.175 4.581 -10.105 1.00 0.00 ATOM 53 OD2 ASP A 7 4.590 4.869 -12.244 1.00 0.00 ATOM 54 O ASP A 7 0.946 5.866 -9.717 1.00 0.00 ATOM 55 C ASP A 7 1.447 4.784 -9.406 1.00 0.00 ATOM 56 N VAL A 8 1.836 4.467 -8.195 1.00 0.00 ATOM 57 CA VAL A 8 1.651 5.339 -7.037 1.00 0.00 ATOM 58 CB VAL A 8 0.804 4.657 -5.946 1.00 0.00 ATOM 59 CG1 VAL A 8 0.657 5.569 -4.738 1.00 0.00 ATOM 60 CG2 VAL A 8 -0.584 4.332 -6.476 1.00 0.00 ATOM 61 O VAL A 8 3.742 4.841 -5.960 1.00 0.00 ATOM 62 C VAL A 8 2.977 5.731 -6.391 1.00 0.00 ATOM 63 N GLU A 9 3.139 7.054 -6.325 1.00 0.00 ATOM 64 CA GLU A 9 4.334 7.709 -5.828 1.00 0.00 ATOM 65 CB GLU A 9 4.556 9.039 -6.551 1.00 0.00 ATOM 66 CG GLU A 9 4.886 8.896 -8.028 1.00 0.00 ATOM 67 CD GLU A 9 5.090 10.233 -8.712 1.00 0.00 ATOM 68 OE1 GLU A 9 4.970 11.273 -8.031 1.00 0.00 ATOM 69 OE2 GLU A 9 5.368 10.241 -9.929 1.00 0.00 ATOM 70 O GLU A 9 3.285 8.626 -3.868 1.00 0.00 ATOM 71 C GLU A 9 4.240 8.001 -4.338 1.00 0.00 ATOM 72 N LEU A 10 5.255 7.558 -3.609 1.00 0.00 ATOM 73 CA LEU A 10 5.292 7.766 -2.156 1.00 0.00 ATOM 74 CB LEU A 10 5.029 6.451 -1.420 1.00 0.00 ATOM 75 CG LEU A 10 3.653 5.817 -1.633 1.00 0.00 ATOM 76 CD1 LEU A 10 3.591 4.438 -0.995 1.00 0.00 ATOM 77 CD2 LEU A 10 2.563 6.678 -1.013 1.00 0.00 ATOM 78 O LEU A 10 7.674 7.708 -2.038 1.00 0.00 ATOM 79 C LEU A 10 6.644 8.294 -1.699 1.00 0.00 ATOM 80 N THR A 11 6.625 9.341 -0.885 1.00 0.00 ATOM 81 CA THR A 11 7.852 9.990 -0.455 1.00 0.00 ATOM 82 CB THR A 11 7.743 11.523 -0.552 1.00 0.00 ATOM 83 CG2 THR A 11 9.033 12.179 -0.083 1.00 0.00 ATOM 84 OG1 THR A 11 7.498 11.903 -1.912 1.00 0.00 ATOM 85 O THR A 11 7.447 9.996 1.908 1.00 0.00 ATOM 86 C THR A 11 8.205 9.660 0.992 1.00 0.00 ATOM 87 N LYS A 12 9.313 8.948 1.199 1.00 0.00 ATOM 88 CA LYS A 12 9.800 8.679 2.553 1.00 0.00 ATOM 89 CB LYS A 12 11.142 7.946 2.504 1.00 0.00 ATOM 90 CG LYS A 12 11.690 7.563 3.869 1.00 0.00 ATOM 91 CD LYS A 12 12.965 6.744 3.742 1.00 0.00 ATOM 92 CE LYS A 12 13.533 6.393 5.107 1.00 0.00 ATOM 93 NZ LYS A 12 14.774 5.576 4.999 1.00 0.00 ATOM 94 O LYS A 12 11.092 10.543 3.362 1.00 0.00 ATOM 95 C LYS A 12 9.994 9.982 3.329 1.00 0.00 ATOM 96 N ASN A 13 8.937 10.422 4.001 1.00 0.00 ATOM 97 CA ASN A 13 8.941 11.696 4.712 1.00 0.00 ATOM 98 CB ASN A 13 7.597 12.408 4.544 1.00 0.00 ATOM 99 CG ASN A 13 6.459 11.672 5.223 1.00 0.00 ATOM 100 ND2 ASN A 13 5.233 12.115 4.968 1.00 0.00 ATOM 101 OD1 ASN A 13 6.681 10.718 5.968 1.00 0.00 ATOM 102 O ASN A 13 9.266 10.368 6.677 1.00 0.00 ATOM 103 C ASN A 13 9.185 11.501 6.203 1.00 0.00 ATOM 104 N VAL A 14 9.240 12.606 6.941 1.00 0.00 ATOM 105 CA VAL A 14 9.531 12.575 8.372 1.00 0.00 ATOM 106 CB VAL A 14 9.306 13.952 9.024 1.00 0.00 ATOM 107 CG1 VAL A 14 10.236 14.989 8.413 1.00 0.00 ATOM 108 CG2 VAL A 14 7.871 14.412 8.816 1.00 0.00 ATOM 109 O VAL A 14 8.834 11.327 10.294 1.00 0.00 ATOM 110 C VAL A 14 8.637 11.572 9.100 1.00 0.00 ATOM 111 N GLN A 15 7.646 11.023 8.401 1.00 0.00 ATOM 112 CA GLN A 15 6.718 10.067 8.999 1.00 0.00 ATOM 113 CB GLN A 15 5.275 10.547 8.835 1.00 0.00 ATOM 114 CG GLN A 15 4.981 11.875 9.513 1.00 0.00 ATOM 115 CD GLN A 15 3.534 12.301 9.358 1.00 0.00 ATOM 116 OE1 GLN A 15 2.743 11.621 8.704 1.00 0.00 ATOM 117 NE2 GLN A 15 3.184 13.432 9.960 1.00 0.00 ATOM 118 O GLN A 15 5.956 7.836 8.575 1.00 0.00 ATOM 119 C GLN A 15 6.823 8.685 8.353 1.00 0.00 ATOM 120 N GLY A 16 7.871 8.435 7.572 1.00 0.00 ATOM 121 CA GLY A 16 7.988 7.165 6.868 1.00 0.00 ATOM 122 O GLY A 16 7.222 8.161 4.835 1.00 0.00 ATOM 123 C GLY A 16 7.246 7.149 5.543 1.00 0.00 ATOM 124 N LEU A 17 6.687 5.998 5.183 1.00 0.00 ATOM 125 CA LEU A 17 5.898 5.879 3.961 1.00 0.00 ATOM 126 CB LEU A 17 5.535 4.416 3.698 1.00 0.00 ATOM 127 CG LEU A 17 4.906 4.108 2.338 1.00 0.00 ATOM 128 CD1 LEU A 17 5.847 4.499 1.209 1.00 0.00 ATOM 129 CD2 LEU A 17 4.602 2.623 2.210 1.00 0.00 ATOM 130 O LEU A 17 3.982 7.058 3.099 1.00 0.00 ATOM 131 C LEU A 17 4.608 6.691 4.098 1.00 0.00 ATOM 132 N GLY A 18 4.212 7.009 5.328 1.00 0.00 ATOM 133 CA GLY A 18 3.017 7.810 5.536 1.00 0.00 ATOM 134 O GLY A 18 0.822 7.577 4.625 1.00 0.00 ATOM 135 C GLY A 18 1.746 7.041 5.237 1.00 0.00 ATOM 136 N ILE A 19 1.671 5.795 5.695 1.00 0.00 ATOM 137 CA ILE A 19 0.520 4.954 5.395 1.00 0.00 ATOM 138 CB ILE A 19 0.514 4.510 3.920 1.00 0.00 ATOM 139 CG1 ILE A 19 -0.843 3.910 3.549 1.00 0.00 ATOM 140 CG2 ILE A 19 1.588 3.461 3.676 1.00 0.00 ATOM 141 CD1 ILE A 19 -1.060 3.765 2.059 1.00 0.00 ATOM 142 O ILE A 19 1.484 3.454 7.011 1.00 0.00 ATOM 143 C ILE A 19 0.536 3.700 6.263 1.00 0.00 ATOM 144 N THR A 20 -0.549 2.936 6.215 1.00 0.00 ATOM 145 CA THR A 20 -0.605 1.656 6.912 1.00 0.00 ATOM 146 CB THR A 20 -1.422 1.757 8.214 1.00 0.00 ATOM 147 CG2 THR A 20 -1.426 0.424 8.945 1.00 0.00 ATOM 148 OG1 THR A 20 -0.844 2.753 9.067 1.00 0.00 ATOM 149 O THR A 20 -2.444 0.732 5.678 1.00 0.00 ATOM 150 C THR A 20 -1.259 0.616 6.013 1.00 0.00 ATOM 151 N ILE A 21 -0.491 -0.408 5.650 1.00 0.00 ATOM 152 CA ILE A 21 -0.962 -1.415 4.707 1.00 0.00 ATOM 153 CB ILE A 21 0.170 -1.892 3.778 1.00 0.00 ATOM 154 CG1 ILE A 21 1.292 -2.538 4.594 1.00 0.00 ATOM 155 CG2 ILE A 21 0.752 -0.720 3.002 1.00 0.00 ATOM 156 CD1 ILE A 21 2.337 -3.234 3.749 1.00 0.00 ATOM 157 O ILE A 21 -1.096 -2.919 6.574 1.00 0.00 ATOM 158 C ILE A 21 -1.502 -2.631 5.446 1.00 0.00 ATOM 159 N ALA A 22 -2.389 -3.367 4.785 1.00 0.00 ATOM 160 CA ALA A 22 -2.962 -4.574 5.364 1.00 0.00 ATOM 161 CB ALA A 22 -4.481 -4.518 5.311 1.00 0.00 ATOM 162 O ALA A 22 -2.770 -5.963 3.411 1.00 0.00 ATOM 163 C ALA A 22 -2.510 -5.822 4.611 1.00 0.00 ATOM 164 N GLY A 23 -1.798 -6.700 5.313 1.00 0.00 ATOM 165 CA GLY A 23 -1.394 -7.976 4.746 1.00 0.00 ATOM 166 O GLY A 23 -3.279 -8.906 5.871 1.00 0.00 ATOM 167 C GLY A 23 -2.488 -9.011 4.927 1.00 0.00 ATOM 168 N TYR A 24 -2.583 -9.980 4.019 1.00 0.00 ATOM 169 CA TYR A 24 -3.658 -10.967 4.091 1.00 0.00 ATOM 170 CB TYR A 24 -4.545 -10.885 2.847 1.00 0.00 ATOM 171 CG TYR A 24 -5.227 -9.547 2.668 1.00 0.00 ATOM 172 CD1 TYR A 24 -4.761 -8.631 1.734 1.00 0.00 ATOM 173 CD2 TYR A 24 -6.333 -9.204 3.435 1.00 0.00 ATOM 174 CE1 TYR A 24 -5.378 -7.406 1.564 1.00 0.00 ATOM 175 CE2 TYR A 24 -6.962 -7.984 3.278 1.00 0.00 ATOM 176 CZ TYR A 24 -6.474 -7.083 2.333 1.00 0.00 ATOM 177 OH TYR A 24 -7.090 -5.863 2.165 1.00 0.00 ATOM 178 O TYR A 24 -3.792 -13.334 3.680 1.00 0.00 ATOM 179 C TYR A 24 -3.151 -12.407 4.183 1.00 0.00 ATOM 180 N ILE A 25 -1.995 -12.585 4.818 1.00 0.00 ATOM 181 CA ILE A 25 -1.427 -13.902 5.079 1.00 0.00 ATOM 182 CB ILE A 25 -0.121 -14.119 4.292 1.00 0.00 ATOM 183 CG1 ILE A 25 -0.380 -14.014 2.788 1.00 0.00 ATOM 184 CG2 ILE A 25 0.455 -15.496 4.587 1.00 0.00 ATOM 185 CD1 ILE A 25 0.878 -14.039 1.948 1.00 0.00 ATOM 186 O ILE A 25 -0.367 -13.186 7.106 1.00 0.00 ATOM 187 C ILE A 25 -1.142 -13.985 6.578 1.00 0.00 ATOM 188 N GLY A 26 -1.785 -14.918 7.275 1.00 0.00 ATOM 189 CA GLY A 26 -1.634 -15.000 8.720 1.00 0.00 ATOM 190 O GLY A 26 -3.573 -14.666 10.084 1.00 0.00 ATOM 191 C GLY A 26 -2.655 -14.142 9.448 1.00 0.00 ATOM 192 N ASP A 27 -2.477 -12.824 9.395 1.00 0.00 ATOM 193 CA ASP A 27 -3.440 -11.883 9.961 1.00 0.00 ATOM 194 CB ASP A 27 -2.735 -10.602 10.413 1.00 0.00 ATOM 195 CG ASP A 27 -3.628 -9.713 11.256 1.00 0.00 ATOM 196 OD1 ASP A 27 -4.721 -10.171 11.651 1.00 0.00 ATOM 197 OD2 ASP A 27 -3.235 -8.558 11.522 1.00 0.00 ATOM 198 O ASP A 27 -4.695 -10.386 8.554 1.00 0.00 ATOM 199 C ASP A 27 -4.466 -11.553 8.878 1.00 0.00 ATOM 200 N LYS A 28 -5.097 -12.596 8.346 1.00 0.00 ATOM 201 CA LYS A 28 -6.028 -12.488 7.223 1.00 0.00 ATOM 202 CB LYS A 28 -6.465 -13.877 6.754 1.00 0.00 ATOM 203 CG LYS A 28 -5.349 -14.702 6.133 1.00 0.00 ATOM 204 CD LYS A 28 -5.848 -16.074 5.709 1.00 0.00 ATOM 205 CE LYS A 28 -4.750 -16.872 5.024 1.00 0.00 ATOM 206 NZ LYS A 28 -5.222 -18.223 4.611 1.00 0.00 ATOM 207 O LYS A 28 -7.714 -11.610 8.702 1.00 0.00 ATOM 208 C LYS A 28 -7.306 -11.716 7.544 1.00 0.00 ATOM 209 N LYS A 29 -7.963 -11.216 6.499 1.00 0.00 ATOM 210 CA LYS A 29 -9.192 -10.442 6.654 1.00 0.00 ATOM 211 CB LYS A 29 -9.203 -9.255 5.688 1.00 0.00 ATOM 212 CG LYS A 29 -10.412 -8.345 5.837 1.00 0.00 ATOM 213 CD LYS A 29 -10.336 -7.167 4.881 1.00 0.00 ATOM 214 CE LYS A 29 -11.539 -6.250 5.038 1.00 0.00 ATOM 215 NZ LYS A 29 -11.472 -5.083 4.116 1.00 0.00 ATOM 216 O LYS A 29 -11.002 -11.870 7.296 1.00 0.00 ATOM 217 C LYS A 29 -10.444 -11.271 6.373 1.00 0.00 ATOM 218 N LEU A 30 -10.876 -11.358 5.113 1.00 0.00 ATOM 219 CA LEU A 30 -12.127 -12.051 4.814 1.00 0.00 ATOM 220 CB LEU A 30 -13.282 -11.053 4.714 1.00 0.00 ATOM 221 CG LEU A 30 -13.692 -10.358 6.014 1.00 0.00 ATOM 222 CD1 LEU A 30 -14.687 -9.241 5.737 1.00 0.00 ATOM 223 CD2 LEU A 30 -14.343 -11.347 6.970 1.00 0.00 ATOM 224 O LEU A 30 -13.217 -13.021 2.924 1.00 0.00 ATOM 225 C LEU A 30 -12.144 -12.841 3.503 1.00 0.00 ATOM 226 N GLU A 31 -11.003 -13.339 3.030 1.00 0.00 ATOM 227 CA GLU A 31 -11.019 -14.188 1.840 1.00 0.00 ATOM 228 CB GLU A 31 -12.335 -14.018 1.078 1.00 0.00 ATOM 229 CG GLU A 31 -13.548 -14.582 1.800 1.00 0.00 ATOM 230 CD GLU A 31 -14.841 -14.334 1.048 1.00 0.00 ATOM 231 OE1 GLU A 31 -14.795 -13.673 -0.011 1.00 0.00 ATOM 232 OE2 GLU A 31 -15.900 -14.799 1.519 1.00 0.00 ATOM 233 O GLU A 31 -9.623 -14.789 0.005 1.00 0.00 ATOM 234 C GLU A 31 -9.912 -13.915 0.825 1.00 0.00 ATOM 235 N PRO A 32 -9.320 -12.714 0.796 1.00 0.00 ATOM 236 CA PRO A 32 -8.254 -12.412 -0.163 1.00 0.00 ATOM 237 CB PRO A 32 -8.306 -10.890 -0.307 1.00 0.00 ATOM 238 CG PRO A 32 -8.756 -10.403 1.030 1.00 0.00 ATOM 239 CD PRO A 32 -9.754 -11.412 1.526 1.00 0.00 ATOM 240 O PRO A 32 -6.701 -13.365 1.401 1.00 0.00 ATOM 241 C PRO A 32 -6.862 -12.850 0.292 1.00 0.00 ATOM 242 N SER A 33 -5.858 -12.696 -0.573 1.00 0.00 ATOM 243 CA SER A 33 -4.482 -13.047 -0.223 1.00 0.00 ATOM 244 CB SER A 33 -4.183 -14.496 -0.613 1.00 0.00 ATOM 245 OG SER A 33 -2.924 -14.910 -0.110 1.00 0.00 ATOM 246 O SER A 33 -2.600 -12.687 -1.653 1.00 0.00 ATOM 247 C SER A 33 -3.446 -12.171 -0.922 1.00 0.00 ATOM 248 N GLY A 34 -3.493 -10.866 -0.678 1.00 0.00 ATOM 249 CA GLY A 34 -2.500 -9.944 -1.210 1.00 0.00 ATOM 250 O GLY A 34 -2.485 -8.989 0.978 1.00 0.00 ATOM 251 C GLY A 34 -2.224 -8.830 -0.216 1.00 0.00 ATOM 252 N ILE A 35 -1.758 -7.672 -0.666 1.00 0.00 ATOM 253 CA ILE A 35 -1.554 -6.571 0.272 1.00 0.00 ATOM 254 CB ILE A 35 -0.091 -6.090 0.268 1.00 0.00 ATOM 255 CG1 ILE A 35 0.851 -7.244 0.619 1.00 0.00 ATOM 256 CG2 ILE A 35 0.107 -4.980 1.289 1.00 0.00 ATOM 257 CD1 ILE A 35 0.627 -7.817 2.001 1.00 0.00 ATOM 258 O ILE A 35 -2.285 -4.792 -1.173 1.00 0.00 ATOM 259 C ILE A 35 -2.441 -5.386 -0.101 1.00 0.00 ATOM 260 N PHE A 36 -3.347 -5.018 0.802 1.00 0.00 ATOM 261 CA PHE A 36 -4.218 -3.869 0.568 1.00 0.00 ATOM 262 CB PHE A 36 -5.685 -4.262 0.753 1.00 0.00 ATOM 263 CG PHE A 36 -6.168 -5.283 -0.237 1.00 0.00 ATOM 264 CD1 PHE A 36 -5.570 -5.401 -1.480 1.00 0.00 ATOM 265 CD2 PHE A 36 -7.221 -6.126 0.073 1.00 0.00 ATOM 266 CE1 PHE A 36 -6.015 -6.340 -2.391 1.00 0.00 ATOM 267 CE2 PHE A 36 -7.666 -7.065 -0.838 1.00 0.00 ATOM 268 CZ PHE A 36 -7.067 -7.174 -2.066 1.00 0.00 ATOM 269 O PHE A 36 -3.023 -2.930 2.422 1.00 0.00 ATOM 270 C PHE A 36 -3.879 -2.757 1.554 1.00 0.00 ATOM 271 N VAL A 37 -4.586 -1.640 1.449 1.00 0.00 ATOM 272 CA VAL A 37 -4.385 -0.513 2.353 1.00 0.00 ATOM 273 CB VAL A 37 -4.568 0.833 1.627 1.00 0.00 ATOM 274 CG1 VAL A 37 -4.429 1.989 2.605 1.00 0.00 ATOM 275 CG2 VAL A 37 -3.521 0.997 0.537 1.00 0.00 ATOM 276 O VAL A 37 -6.541 -1.008 3.281 1.00 0.00 ATOM 277 C VAL A 37 -5.399 -0.593 3.491 1.00 0.00 ATOM 278 N LYS A 38 -4.975 -0.244 4.702 1.00 0.00 ATOM 279 CA LYS A 38 -5.873 -0.263 5.852 1.00 0.00 ATOM 280 CB LYS A 38 -5.369 -1.248 6.909 1.00 0.00 ATOM 281 CG LYS A 38 -4.001 -0.904 7.475 1.00 0.00 ATOM 282 CD LYS A 38 -3.528 -1.962 8.459 1.00 0.00 ATOM 283 CE LYS A 38 -4.424 -2.014 9.686 1.00 0.00 ATOM 284 NZ LYS A 38 -3.964 -3.036 10.666 1.00 0.00 ATOM 285 O LYS A 38 -6.936 1.384 7.229 1.00 0.00 ATOM 286 C LYS A 38 -5.977 1.111 6.504 1.00 0.00 ATOM 287 N SER A 39 -4.983 1.968 6.292 1.00 0.00 ATOM 288 CA SER A 39 -5.044 3.320 6.839 1.00 0.00 ATOM 289 CB SER A 39 -4.613 3.324 8.307 1.00 0.00 ATOM 290 OG SER A 39 -4.621 4.638 8.838 1.00 0.00 ATOM 291 O SER A 39 -3.023 3.936 5.701 1.00 0.00 ATOM 292 C SER A 39 -4.136 4.293 6.096 1.00 0.00 ATOM 293 N ILE A 40 -4.615 5.525 5.943 1.00 0.00 ATOM 294 CA ILE A 40 -3.843 6.589 5.311 1.00 0.00 ATOM 295 CB ILE A 40 -4.501 7.062 4.002 1.00 0.00 ATOM 296 CG1 ILE A 40 -5.904 7.608 4.277 1.00 0.00 ATOM 297 CG2 ILE A 40 -4.617 5.909 3.016 1.00 0.00 ATOM 298 CD1 ILE A 40 -6.543 8.280 3.081 1.00 0.00 ATOM 299 O ILE A 40 -4.589 7.907 7.170 1.00 0.00 ATOM 300 C ILE A 40 -3.754 7.774 6.273 1.00 0.00 ATOM 301 N THR A 41 -2.755 8.637 6.094 1.00 0.00 ATOM 302 CA THR A 41 -2.547 9.751 7.017 1.00 0.00 ATOM 303 CB THR A 41 -1.090 9.808 7.513 1.00 0.00 ATOM 304 CG2 THR A 41 -0.898 10.977 8.467 1.00 0.00 ATOM 305 OG1 THR A 41 -0.768 8.592 8.199 1.00 0.00 ATOM 306 O THR A 41 -2.470 11.363 5.231 1.00 0.00 ATOM 307 C THR A 41 -2.850 11.106 6.378 1.00 0.00 ATOM 308 N LYS A 42 -3.483 11.988 7.148 1.00 0.00 ATOM 309 CA LYS A 42 -3.841 13.325 6.680 1.00 0.00 ATOM 310 CB LYS A 42 -4.071 14.264 7.866 1.00 0.00 ATOM 311 CG LYS A 42 -4.539 15.656 7.474 1.00 0.00 ATOM 312 CD LYS A 42 -4.850 16.499 8.699 1.00 0.00 ATOM 313 CE LYS A 42 -5.315 17.893 8.307 1.00 0.00 ATOM 314 NZ LYS A 42 -5.678 18.712 9.496 1.00 0.00 ATOM 315 O LYS A 42 -1.751 14.447 6.321 1.00 0.00 ATOM 316 C LYS A 42 -2.752 13.942 5.810 1.00 0.00 ATOM 317 N SER A 43 -2.961 13.948 4.497 1.00 0.00 ATOM 318 CA SER A 43 -1.999 14.544 3.577 1.00 0.00 ATOM 319 CB SER A 43 -2.369 15.999 3.284 1.00 0.00 ATOM 320 OG SER A 43 -2.444 16.757 4.479 1.00 0.00 ATOM 321 O SER A 43 0.038 15.578 4.303 1.00 0.00 ATOM 322 C SER A 43 -0.588 14.526 4.155 1.00 0.00 ATOM 323 N SER A 44 -0.073 13.338 4.458 1.00 0.00 ATOM 324 CA SER A 44 1.295 13.213 4.952 1.00 0.00 ATOM 325 CB SER A 44 1.365 12.183 6.082 1.00 0.00 ATOM 326 OG SER A 44 1.018 10.891 5.616 1.00 0.00 ATOM 327 O SER A 44 3.401 13.176 3.800 1.00 0.00 ATOM 328 C SER A 44 2.239 12.764 3.840 1.00 0.00 ATOM 329 N ALA A 45 1.734 11.936 2.928 1.00 0.00 ATOM 330 CA ALA A 45 2.546 11.401 1.836 1.00 0.00 ATOM 331 CB ALA A 45 3.532 10.370 2.364 1.00 0.00 ATOM 332 O ALA A 45 1.456 11.299 -0.301 1.00 0.00 ATOM 333 C ALA A 45 1.694 10.719 0.762 1.00 0.00 ATOM 334 N VAL A 46 1.200 9.512 1.044 1.00 0.00 ATOM 335 CA VAL A 46 0.469 8.723 0.051 1.00 0.00 ATOM 336 CB VAL A 46 0.208 7.289 0.550 1.00 0.00 ATOM 337 CG1 VAL A 46 -0.836 7.292 1.655 1.00 0.00 ATOM 338 CG2 VAL A 46 -0.297 6.414 -0.587 1.00 0.00 ATOM 339 O VAL A 46 -1.424 9.077 -1.376 1.00 0.00 ATOM 340 C VAL A 46 -0.890 9.324 -0.290 1.00 0.00 ATOM 341 N GLU A 47 -1.488 10.057 0.638 1.00 0.00 ATOM 342 CA GLU A 47 -2.804 10.627 0.387 1.00 0.00 ATOM 343 CB GLU A 47 -3.513 10.939 1.706 1.00 0.00 ATOM 344 CG GLU A 47 -4.975 11.323 1.549 1.00 0.00 ATOM 345 CD GLU A 47 -5.674 11.514 2.881 1.00 0.00 ATOM 346 OE1 GLU A 47 -5.735 10.544 3.665 1.00 0.00 ATOM 347 OE2 GLU A 47 -6.161 12.635 3.141 1.00 0.00 ATOM 348 O GLU A 47 -3.685 12.381 -0.990 1.00 0.00 ATOM 349 C GLU A 47 -2.697 11.921 -0.412 1.00 0.00 ATOM 350 N HIS A 48 -1.503 12.508 -0.456 1.00 0.00 ATOM 351 CA HIS A 48 -1.306 13.789 -1.130 1.00 0.00 ATOM 352 CB HIS A 48 -0.481 14.734 -0.254 1.00 0.00 ATOM 353 CG HIS A 48 -0.280 16.092 -0.852 1.00 0.00 ATOM 354 CD2 HIS A 48 0.851 16.830 -1.395 1.00 0.00 ATOM 355 ND1 HIS A 48 -1.308 16.997 -1.005 1.00 0.00 ATOM 356 CE1 HIS A 48 -0.823 18.119 -1.567 1.00 0.00 ATOM 357 NE2 HIS A 48 0.471 18.025 -1.804 1.00 0.00 ATOM 358 O HIS A 48 -0.893 14.321 -3.428 1.00 0.00 ATOM 359 C HIS A 48 -0.571 13.632 -2.458 1.00 0.00 ATOM 360 N ASP A 49 0.422 12.747 -2.507 1.00 0.00 ATOM 361 CA ASP A 49 1.237 12.580 -3.710 1.00 0.00 ATOM 362 CB ASP A 49 2.668 12.187 -3.337 1.00 0.00 ATOM 363 CG ASP A 49 3.402 13.291 -2.601 1.00 0.00 ATOM 364 OD1 ASP A 49 3.342 14.452 -3.058 1.00 0.00 ATOM 365 OD2 ASP A 49 4.036 12.995 -1.567 1.00 0.00 ATOM 366 O ASP A 49 0.450 11.752 -5.818 1.00 0.00 ATOM 367 C ASP A 49 0.692 11.496 -4.636 1.00 0.00 ATOM 368 N GLY A 50 0.557 10.275 -4.129 1.00 0.00 ATOM 369 CA GLY A 50 0.000 9.191 -4.923 1.00 0.00 ATOM 370 O GLY A 50 -2.097 9.088 -6.074 1.00 0.00 ATOM 371 C GLY A 50 -1.518 9.217 -4.990 1.00 0.00 ATOM 372 N ARG A 51 -2.162 9.376 -3.836 1.00 0.00 ATOM 373 CA ARG A 51 -3.618 9.462 -3.771 1.00 0.00 ATOM 374 CB ARG A 51 -4.175 10.088 -5.051 1.00 0.00 ATOM 375 CG ARG A 51 -3.814 11.553 -5.234 1.00 0.00 ATOM 376 CD ARG A 51 -4.397 12.108 -6.524 1.00 0.00 ATOM 377 NE ARG A 51 -4.037 13.509 -6.728 1.00 0.00 ATOM 378 CZ ARG A 51 -4.369 14.216 -7.803 1.00 0.00 ATOM 379 NH1 ARG A 51 -3.998 15.485 -7.902 1.00 0.00 ATOM 380 NH2 ARG A 51 -5.071 13.653 -8.777 1.00 0.00 ATOM 381 O ARG A 51 -5.139 7.711 -4.386 1.00 0.00 ATOM 382 C ARG A 51 -4.257 8.084 -3.607 1.00 0.00 ATOM 383 N ILE A 52 -3.836 7.348 -2.577 1.00 0.00 ATOM 384 CA ILE A 52 -4.385 6.018 -2.308 1.00 0.00 ATOM 385 CB ILE A 52 -3.283 5.027 -1.889 1.00 0.00 ATOM 386 CG1 ILE A 52 -2.272 4.843 -3.021 1.00 0.00 ATOM 387 CG2 ILE A 52 -3.886 3.671 -1.555 1.00 0.00 ATOM 388 CD1 ILE A 52 -1.028 4.085 -2.612 1.00 0.00 ATOM 389 O ILE A 52 -5.281 6.902 -0.261 1.00 0.00 ATOM 390 C ILE A 52 -5.411 6.090 -1.181 1.00 0.00 ATOM 391 N GLN A 53 -6.438 5.251 -1.261 1.00 0.00 ATOM 392 CA GLN A 53 -7.445 5.173 -0.209 1.00 0.00 ATOM 393 CB GLN A 53 -8.751 5.825 -0.668 1.00 0.00 ATOM 394 CG GLN A 53 -8.631 7.309 -0.971 1.00 0.00 ATOM 395 CD GLN A 53 -9.953 7.930 -1.375 1.00 0.00 ATOM 396 OE1 GLN A 53 -10.949 7.230 -1.555 1.00 0.00 ATOM 397 NE2 GLN A 53 -9.966 9.250 -1.520 1.00 0.00 ATOM 398 O GLN A 53 -7.590 2.823 -0.683 1.00 0.00 ATOM 399 C GLN A 53 -7.735 3.720 0.152 1.00 0.00 ATOM 400 N ILE A 54 -8.174 3.495 1.386 1.00 0.00 ATOM 401 CA ILE A 54 -8.416 2.140 1.876 1.00 0.00 ATOM 402 CB ILE A 54 -9.145 2.152 3.233 1.00 0.00 ATOM 403 CG1 ILE A 54 -8.243 2.746 4.317 1.00 0.00 ATOM 404 CG2 ILE A 54 -9.527 0.739 3.645 1.00 0.00 ATOM 405 CD1 ILE A 54 -8.932 2.930 5.651 1.00 0.00 ATOM 406 O ILE A 54 -10.224 1.907 0.308 1.00 0.00 ATOM 407 C ILE A 54 -9.280 1.361 0.884 1.00 0.00 ATOM 408 N GLY A 55 -8.961 0.081 0.689 1.00 0.00 ATOM 409 CA GLY A 55 -9.664 -0.734 -0.291 1.00 0.00 ATOM 410 O GLY A 55 -9.319 -1.623 -2.487 1.00 0.00 ATOM 411 C GLY A 55 -8.882 -0.905 -1.585 1.00 0.00 ATOM 412 N ASP A 56 -7.755 -0.205 -1.706 1.00 0.00 ATOM 413 CA ASP A 56 -6.868 -0.360 -2.857 1.00 0.00 ATOM 414 CB ASP A 56 -6.060 0.919 -3.087 1.00 0.00 ATOM 415 CG ASP A 56 -6.903 2.049 -3.644 1.00 0.00 ATOM 416 OD1 ASP A 56 -8.020 1.773 -4.129 1.00 0.00 ATOM 417 OD2 ASP A 56 -6.446 3.210 -3.596 1.00 0.00 ATOM 418 O ASP A 56 -5.278 -1.584 -1.549 1.00 0.00 ATOM 419 C ASP A 56 -5.903 -1.516 -2.609 1.00 0.00 ATOM 420 N GLN A 57 -5.737 -2.411 -3.581 1.00 0.00 ATOM 421 CA GLN A 57 -4.900 -3.590 -3.413 1.00 0.00 ATOM 422 CB GLN A 57 -5.663 -4.852 -3.821 1.00 0.00 ATOM 423 CG GLN A 57 -4.886 -6.141 -3.615 1.00 0.00 ATOM 424 CD GLN A 57 -5.700 -7.373 -3.957 1.00 0.00 ATOM 425 OE1 GLN A 57 -6.842 -7.270 -4.406 1.00 0.00 ATOM 426 NE2 GLN A 57 -5.115 -8.546 -3.744 1.00 0.00 ATOM 427 O GLN A 57 -3.744 -3.416 -5.518 1.00 0.00 ATOM 428 C GLN A 57 -3.657 -3.463 -4.283 1.00 0.00 ATOM 429 N ILE A 58 -2.497 -3.451 -3.640 1.00 0.00 ATOM 430 CA ILE A 58 -1.245 -3.299 -4.365 1.00 0.00 ATOM 431 CB ILE A 58 -0.058 -3.097 -3.405 1.00 0.00 ATOM 432 CG1 ILE A 58 0.100 -4.312 -2.489 1.00 0.00 ATOM 433 CG2 ILE A 58 -0.277 -1.866 -2.539 1.00 0.00 ATOM 434 CD1 ILE A 58 1.381 -4.306 -1.683 1.00 0.00 ATOM 435 O ILE A 58 -1.815 -5.518 -5.008 1.00 0.00 ATOM 436 C ILE A 58 -1.039 -4.577 -5.177 1.00 0.00 ATOM 437 N ILE A 59 -0.102 -4.604 -6.122 1.00 0.00 ATOM 438 CA ILE A 59 0.234 -5.832 -6.828 1.00 0.00 ATOM 439 CB ILE A 59 -0.364 -5.849 -8.247 1.00 0.00 ATOM 440 CG1 ILE A 59 -0.229 -7.241 -8.866 1.00 0.00 ATOM 441 CG2 ILE A 59 0.359 -4.852 -9.141 1.00 0.00 ATOM 442 CD1 ILE A 59 -1.100 -8.289 -8.209 1.00 0.00 ATOM 443 O ILE A 59 2.341 -6.977 -7.015 1.00 0.00 ATOM 444 C ILE A 59 1.753 -5.898 -6.909 1.00 0.00 ATOM 445 N ALA A 60 2.376 -4.725 -6.870 1.00 0.00 ATOM 446 CA ALA A 60 3.829 -4.619 -6.879 1.00 0.00 ATOM 447 CB ALA A 60 4.356 -4.673 -8.305 1.00 0.00 ATOM 448 O ALA A 60 3.492 -2.354 -6.148 1.00 0.00 ATOM 449 C ALA A 60 4.280 -3.303 -6.250 1.00 0.00 ATOM 450 N VAL A 61 5.536 -3.264 -5.808 1.00 0.00 ATOM 451 CA VAL A 61 6.119 -2.050 -5.240 1.00 0.00 ATOM 452 CB VAL A 61 6.348 -2.190 -3.724 1.00 0.00 ATOM 453 CG1 VAL A 61 6.980 -0.926 -3.161 1.00 0.00 ATOM 454 CG2 VAL A 61 5.029 -2.429 -3.005 1.00 0.00 ATOM 455 O VAL A 61 8.376 -2.599 -5.833 1.00 0.00 ATOM 456 C VAL A 61 7.463 -1.773 -5.910 1.00 0.00 ATOM 457 N ASP A 62 7.605 -0.597 -6.522 1.00 0.00 ATOM 458 CA ASP A 62 8.812 -0.248 -7.274 1.00 0.00 ATOM 459 CB ASP A 62 9.999 -0.063 -6.326 1.00 0.00 ATOM 460 CG ASP A 62 11.229 0.475 -7.031 1.00 0.00 ATOM 461 OD1 ASP A 62 11.162 0.694 -8.259 1.00 0.00 ATOM 462 OD2 ASP A 62 12.259 0.678 -6.355 1.00 0.00 ATOM 463 O ASP A 62 8.696 -1.339 -9.413 1.00 0.00 ATOM 464 C ASP A 62 9.163 -1.346 -8.272 1.00 0.00 ATOM 465 N GLY A 63 9.983 -2.290 -7.830 1.00 0.00 ATOM 466 CA GLY A 63 10.353 -3.436 -8.641 1.00 0.00 ATOM 467 O GLY A 63 11.205 -5.619 -8.121 1.00 0.00 ATOM 468 C GLY A 63 10.493 -4.672 -7.775 1.00 0.00 ATOM 469 N THR A 64 9.792 -4.655 -6.646 1.00 0.00 ATOM 470 CA THR A 64 9.880 -5.724 -5.663 1.00 0.00 ATOM 471 CB THR A 64 10.318 -5.190 -4.286 1.00 0.00 ATOM 472 CG2 THR A 64 11.658 -4.479 -4.392 1.00 0.00 ATOM 473 OG1 THR A 64 9.339 -4.265 -3.796 1.00 0.00 ATOM 474 O THR A 64 7.481 -5.804 -5.744 1.00 0.00 ATOM 475 C THR A 64 8.524 -6.413 -5.487 1.00 0.00 ATOM 476 N ASN A 65 8.529 -7.661 -5.015 1.00 0.00 ATOM 477 CA ASN A 65 7.293 -8.443 -4.889 1.00 0.00 ATOM 478 CB ASN A 65 7.497 -9.859 -5.431 1.00 0.00 ATOM 479 CG ASN A 65 6.226 -10.684 -5.399 1.00 0.00 ATOM 480 ND2 ASN A 65 6.183 -11.734 -6.211 1.00 0.00 ATOM 481 OD1 ASN A 65 5.295 -10.380 -4.653 1.00 0.00 ATOM 482 O ASN A 65 7.363 -9.359 -2.667 1.00 0.00 ATOM 483 C ASN A 65 6.780 -8.604 -3.454 1.00 0.00 ATOM 484 N LEU A 66 5.654 -7.959 -3.135 1.00 0.00 ATOM 485 CA LEU A 66 5.016 -8.103 -1.823 1.00 0.00 ATOM 486 CB LEU A 66 5.019 -6.768 -1.076 1.00 0.00 ATOM 487 CG LEU A 66 6.392 -6.186 -0.733 1.00 0.00 ATOM 488 CD1 LEU A 66 6.254 -4.784 -0.159 1.00 0.00 ATOM 489 CD2 LEU A 66 7.102 -7.053 0.294 1.00 0.00 ATOM 490 O LEU A 66 2.698 -8.153 -1.185 1.00 0.00 ATOM 491 C LEU A 66 3.566 -8.565 -1.960 1.00 0.00 ATOM 492 N GLN A 67 3.303 -9.397 -2.964 1.00 0.00 ATOM 493 CA GLN A 67 1.956 -9.893 -3.237 1.00 0.00 ATOM 494 CB GLN A 67 1.581 -9.647 -4.700 1.00 0.00 ATOM 495 CG GLN A 67 2.467 -10.372 -5.699 1.00 0.00 ATOM 496 CD GLN A 67 2.069 -10.101 -7.136 1.00 0.00 ATOM 497 OE1 GLN A 67 0.996 -9.559 -7.401 1.00 0.00 ATOM 498 NE2 GLN A 67 2.934 -10.477 -8.070 1.00 0.00 ATOM 499 O GLN A 67 1.306 -12.155 -3.728 1.00 0.00 ATOM 500 C GLN A 67 1.893 -11.392 -2.958 1.00 0.00 ATOM 501 N GLY A 68 2.501 -11.806 -1.851 1.00 0.00 ATOM 502 CA GLY A 68 2.575 -13.214 -1.493 1.00 0.00 ATOM 503 O GLY A 68 4.172 -14.382 -0.150 1.00 0.00 ATOM 504 C GLY A 68 3.383 -13.438 -0.231 1.00 0.00 ATOM 505 N PHE A 69 3.164 -12.587 0.766 1.00 0.00 ATOM 506 CA PHE A 69 3.931 -12.647 2.004 1.00 0.00 ATOM 507 CB PHE A 69 5.207 -11.811 1.885 1.00 0.00 ATOM 508 CG PHE A 69 4.954 -10.345 1.679 1.00 0.00 ATOM 509 CD1 PHE A 69 4.900 -9.479 2.758 1.00 0.00 ATOM 510 CD2 PHE A 69 4.770 -9.831 0.407 1.00 0.00 ATOM 511 CE1 PHE A 69 4.667 -8.130 2.568 1.00 0.00 ATOM 512 CE2 PHE A 69 4.537 -8.482 0.218 1.00 0.00 ATOM 513 CZ PHE A 69 4.486 -7.633 1.292 1.00 0.00 ATOM 514 O PHE A 69 2.053 -11.530 2.991 1.00 0.00 ATOM 515 C PHE A 69 3.124 -12.111 3.180 1.00 0.00 ATOM 516 N THR A 70 3.615 -12.335 4.395 1.00 0.00 ATOM 517 CA THR A 70 2.935 -11.850 5.594 1.00 0.00 ATOM 518 CB THR A 70 3.534 -12.468 6.871 1.00 0.00 ATOM 519 CG2 THR A 70 3.458 -13.986 6.815 1.00 0.00 ATOM 520 OG1 THR A 70 4.906 -12.076 6.997 1.00 0.00 ATOM 521 O THR A 70 3.862 -9.718 4.998 1.00 0.00 ATOM 522 C THR A 70 3.058 -10.324 5.710 1.00 0.00 ATOM 523 N ASN A 71 2.250 -9.695 6.567 1.00 0.00 ATOM 524 CA ASN A 71 2.219 -8.231 6.687 1.00 0.00 ATOM 525 CB ASN A 71 1.333 -7.808 7.861 1.00 0.00 ATOM 526 CG ASN A 71 1.146 -6.306 7.938 1.00 0.00 ATOM 527 ND2 ASN A 71 1.619 -5.707 9.025 1.00 0.00 ATOM 528 OD1 ASN A 71 0.583 -5.693 7.030 1.00 0.00 ATOM 529 O ASN A 71 3.945 -6.595 6.333 1.00 0.00 ATOM 530 C ASN A 71 3.602 -7.624 6.924 1.00 0.00 ATOM 531 N GLN A 72 4.406 -8.271 7.763 1.00 0.00 ATOM 532 CA GLN A 72 5.720 -7.744 8.126 1.00 0.00 ATOM 533 CB GLN A 72 6.434 -8.699 9.085 1.00 0.00 ATOM 534 CG GLN A 72 5.827 -8.747 10.478 1.00 0.00 ATOM 535 CD GLN A 72 6.488 -9.784 11.365 1.00 0.00 ATOM 536 OE1 GLN A 72 7.349 -10.541 10.917 1.00 0.00 ATOM 537 NE2 GLN A 72 6.085 -9.821 12.630 1.00 0.00 ATOM 538 O GLN A 72 7.312 -6.545 6.775 1.00 0.00 ATOM 539 C GLN A 72 6.618 -7.558 6.899 1.00 0.00 ATOM 540 N GLN A 73 6.586 -8.520 5.982 1.00 0.00 ATOM 541 CA GLN A 73 7.424 -8.460 4.787 1.00 0.00 ATOM 542 CB GLN A 73 7.189 -9.688 3.906 1.00 0.00 ATOM 543 CG GLN A 73 8.075 -9.745 2.672 1.00 0.00 ATOM 544 CD GLN A 73 9.544 -9.894 3.015 1.00 0.00 ATOM 545 OE1 GLN A 73 9.915 -10.712 3.857 1.00 0.00 ATOM 546 NE2 GLN A 73 10.386 -9.102 2.362 1.00 0.00 ATOM 547 O GLN A 73 8.008 -6.478 3.570 1.00 0.00 ATOM 548 C GLN A 73 7.103 -7.213 3.970 1.00 0.00 ATOM 549 N ALA A 74 5.817 -6.945 3.760 1.00 0.00 ATOM 550 CA ALA A 74 5.402 -5.789 2.972 1.00 0.00 ATOM 551 CB ALA A 74 3.885 -5.688 2.937 1.00 0.00 ATOM 552 O ALA A 74 6.606 -3.712 2.879 1.00 0.00 ATOM 553 C ALA A 74 5.956 -4.503 3.572 1.00 0.00 ATOM 554 N VAL A 75 5.740 -4.312 4.871 1.00 0.00 ATOM 555 CA VAL A 75 6.275 -3.138 5.553 1.00 0.00 ATOM 556 CB VAL A 75 5.948 -3.161 7.058 1.00 0.00 ATOM 557 CG1 VAL A 75 6.680 -2.040 7.779 1.00 0.00 ATOM 558 CG2 VAL A 75 4.454 -2.982 7.281 1.00 0.00 ATOM 559 O VAL A 75 8.367 -2.118 4.971 1.00 0.00 ATOM 560 C VAL A 75 7.788 -3.131 5.371 1.00 0.00 ATOM 561 N GLU A 76 8.424 -4.276 5.600 1.00 0.00 ATOM 562 CA GLU A 76 9.860 -4.392 5.376 1.00 0.00 ATOM 563 CB GLU A 76 10.312 -5.845 5.539 1.00 0.00 ATOM 564 CG GLU A 76 10.314 -6.336 6.978 1.00 0.00 ATOM 565 CD GLU A 76 10.697 -7.798 7.093 1.00 0.00 ATOM 566 OE1 GLU A 76 10.878 -8.450 6.043 1.00 0.00 ATOM 567 OE2 GLU A 76 10.817 -8.293 8.234 1.00 0.00 ATOM 568 O GLU A 76 11.042 -3.054 3.779 1.00 0.00 ATOM 569 C GLU A 76 10.192 -3.925 3.963 1.00 0.00 ATOM 570 N VAL A 77 9.475 -4.460 2.980 1.00 0.00 ATOM 571 CA VAL A 77 9.673 -4.076 1.587 1.00 0.00 ATOM 572 CB VAL A 77 8.728 -4.849 0.649 1.00 0.00 ATOM 573 CG1 VAL A 77 8.810 -4.294 -0.765 1.00 0.00 ATOM 574 CG2 VAL A 77 9.104 -6.322 0.609 1.00 0.00 ATOM 575 O VAL A 77 10.186 -1.883 0.755 1.00 0.00 ATOM 576 C VAL A 77 9.404 -2.586 1.401 1.00 0.00 ATOM 577 N LEU A 78 8.283 -2.109 1.934 1.00 0.00 ATOM 578 CA LEU A 78 7.953 -0.691 1.857 1.00 0.00 ATOM 579 CB LEU A 78 6.639 -0.406 2.587 1.00 0.00 ATOM 580 CG LEU A 78 5.367 -0.944 1.928 1.00 0.00 ATOM 581 CD1 LEU A 78 4.168 -0.760 2.846 1.00 0.00 ATOM 582 CD2 LEU A 78 5.086 -0.211 0.626 1.00 0.00 ATOM 583 O LEU A 78 9.528 1.115 1.893 1.00 0.00 ATOM 584 C LEU A 78 9.050 0.151 2.497 1.00 0.00 ATOM 585 N ARG A 79 9.483 -0.230 3.695 1.00 0.00 ATOM 586 CA ARG A 79 10.584 0.465 4.354 1.00 0.00 ATOM 587 CB ARG A 79 10.817 -0.106 5.754 1.00 0.00 ATOM 588 CG ARG A 79 9.724 0.237 6.754 1.00 0.00 ATOM 589 CD ARG A 79 9.974 -0.431 8.096 1.00 0.00 ATOM 590 NE ARG A 79 8.920 -0.131 9.062 1.00 0.00 ATOM 591 CZ ARG A 79 8.838 -0.674 10.272 1.00 0.00 ATOM 592 NH1 ARG A 79 7.843 -0.341 11.083 1.00 0.00 ATOM 593 NH2 ARG A 79 9.751 -1.550 10.668 1.00 0.00 ATOM 594 O ARG A 79 12.715 1.199 3.516 1.00 0.00 ATOM 595 C ARG A 79 11.866 0.304 3.543 1.00 0.00 ATOM 596 N HIS A 80 11.990 -0.833 2.865 1.00 0.00 ATOM 597 CA HIS A 80 13.187 -1.143 2.092 1.00 0.00 ATOM 598 CB HIS A 80 13.119 -2.572 1.549 1.00 0.00 ATOM 599 CG HIS A 80 13.286 -3.626 2.598 1.00 0.00 ATOM 600 CD2 HIS A 80 13.524 -3.633 4.035 1.00 0.00 ATOM 601 ND1 HIS A 80 13.229 -4.973 2.316 1.00 0.00 ATOM 602 CE1 HIS A 80 13.413 -5.667 3.453 1.00 0.00 ATOM 603 NE2 HIS A 80 13.590 -4.869 4.488 1.00 0.00 ATOM 604 O HIS A 80 14.424 -0.130 0.308 1.00 0.00 ATOM 605 C HIS A 80 13.349 -0.200 0.907 1.00 0.00 ATOM 606 N THR A 81 12.289 0.522 0.566 1.00 0.00 ATOM 607 CA THR A 81 12.337 1.425 -0.578 1.00 0.00 ATOM 608 CB THR A 81 10.924 1.809 -1.054 1.00 0.00 ATOM 609 CG2 THR A 81 10.124 0.564 -1.406 1.00 0.00 ATOM 610 OG1 THR A 81 10.242 2.519 -0.012 1.00 0.00 ATOM 611 O THR A 81 13.366 2.960 0.954 1.00 0.00 ATOM 612 C THR A 81 13.074 2.713 -0.218 1.00 0.00 ATOM 613 N GLY A 82 13.363 3.537 -1.220 1.00 0.00 ATOM 614 CA GLY A 82 14.028 4.809 -0.981 1.00 0.00 ATOM 615 O GLY A 82 12.206 5.864 0.155 1.00 0.00 ATOM 616 C GLY A 82 13.056 5.950 -0.735 1.00 0.00 ATOM 617 N GLN A 83 13.194 7.035 -1.492 1.00 0.00 ATOM 618 CA GLN A 83 12.316 8.191 -1.334 1.00 0.00 ATOM 619 CB GLN A 83 12.930 9.425 -1.998 1.00 0.00 ATOM 620 CG GLN A 83 14.195 9.929 -1.322 1.00 0.00 ATOM 621 CD GLN A 83 14.800 11.123 -2.033 1.00 0.00 ATOM 622 OE1 GLN A 83 14.292 11.566 -3.063 1.00 0.00 ATOM 623 NE2 GLN A 83 15.889 11.648 -1.484 1.00 0.00 ATOM 624 O GLN A 83 10.148 7.229 -1.376 1.00 0.00 ATOM 625 C GLN A 83 10.954 7.934 -1.974 1.00 0.00 ATOM 626 N THR A 84 10.715 8.593 -3.111 1.00 0.00 ATOM 627 CA THR A 84 9.562 8.466 -3.998 1.00 0.00 ATOM 628 CB THR A 84 9.707 9.360 -5.244 1.00 0.00 ATOM 629 CG2 THR A 84 8.443 9.307 -6.087 1.00 0.00 ATOM 630 OG1 THR A 84 9.938 10.715 -4.838 1.00 0.00 ATOM 631 O THR A 84 9.610 6.758 -5.685 1.00 0.00 ATOM 632 C THR A 84 9.324 7.055 -4.526 1.00 0.00 ATOM 633 N VAL A 85 8.711 6.208 -3.718 1.00 0.00 ATOM 634 CA VAL A 85 8.414 4.854 -4.191 1.00 0.00 ATOM 635 CB VAL A 85 8.026 3.922 -3.028 1.00 0.00 ATOM 636 CG1 VAL A 85 6.633 4.260 -2.517 1.00 0.00 ATOM 637 CG2 VAL A 85 8.032 2.471 -3.483 1.00 0.00 ATOM 638 O VAL A 85 6.581 6.022 -5.009 1.00 0.00 ATOM 639 C VAL A 85 7.254 5.012 -5.159 1.00 0.00 ATOM 640 N LEU A 86 7.001 4.001 -5.983 1.00 0.00 ATOM 641 CA LEU A 86 6.086 3.963 -7.099 1.00 0.00 ATOM 642 CB LEU A 86 6.847 4.088 -8.420 1.00 0.00 ATOM 643 CG LEU A 86 7.609 5.396 -8.642 1.00 0.00 ATOM 644 CD1 LEU A 86 8.512 5.292 -9.862 1.00 0.00 ATOM 645 CD2 LEU A 86 6.644 6.550 -8.862 1.00 0.00 ATOM 646 O LEU A 86 5.725 1.650 -7.702 1.00 0.00 ATOM 647 C LEU A 86 5.350 2.628 -7.049 1.00 0.00 ATOM 648 N LEU A 87 4.290 2.632 -6.259 1.00 0.00 ATOM 649 CA LEU A 87 3.399 1.478 -6.104 1.00 0.00 ATOM 650 CB LEU A 87 2.370 1.740 -5.002 1.00 0.00 ATOM 651 CG LEU A 87 2.923 1.912 -3.586 1.00 0.00 ATOM 652 CD1 LEU A 87 1.811 2.284 -2.617 1.00 0.00 ATOM 653 CD2 LEU A 87 3.566 0.623 -3.099 1.00 0.00 ATOM 654 O LEU A 87 2.412 2.264 -8.056 1.00 0.00 ATOM 655 C LEU A 87 2.689 1.260 -7.435 1.00 0.00 ATOM 656 N THR A 88 2.374 0.006 -7.714 1.00 0.00 ATOM 657 CA THR A 88 1.821 -0.617 -8.882 1.00 0.00 ATOM 658 CB THR A 88 2.837 -1.559 -9.554 1.00 0.00 ATOM 659 CG2 THR A 88 2.283 -2.092 -10.866 1.00 0.00 ATOM 660 OG1 THR A 88 4.052 -0.845 -9.819 1.00 0.00 ATOM 661 O THR A 88 0.724 -2.517 -7.879 1.00 0.00 ATOM 662 C THR A 88 0.615 -1.394 -8.371 1.00 0.00 ATOM 663 N LEU A 89 -0.523 -0.730 -8.389 1.00 0.00 ATOM 664 CA LEU A 89 -1.763 -1.320 -7.847 1.00 0.00 ATOM 665 CB LEU A 89 -2.375 -0.402 -6.787 1.00 0.00 ATOM 666 CG LEU A 89 -1.780 -0.499 -5.381 1.00 0.00 ATOM 667 CD1 LEU A 89 -0.315 -0.091 -5.387 1.00 0.00 ATOM 668 CD2 LEU A 89 -2.524 0.413 -4.418 1.00 0.00 ATOM 669 O LEU A 89 -3.120 -0.810 -9.800 1.00 0.00 ATOM 670 C LEU A 89 -2.884 -1.579 -8.862 1.00 0.00 ATOM 671 N MET A 90 -3.644 -2.653 -8.624 1.00 0.00 ATOM 672 CA MET A 90 -4.736 -3.035 -9.506 1.00 0.00 ATOM 673 CB MET A 90 -4.643 -4.520 -9.861 1.00 0.00 ATOM 674 CG MET A 90 -3.414 -4.888 -10.676 1.00 0.00 ATOM 675 SD MET A 90 -3.356 -6.641 -11.095 1.00 0.00 ATOM 676 CE MET A 90 -1.876 -6.700 -12.102 1.00 0.00 ATOM 677 O MET A 90 -6.311 -2.963 -7.678 1.00 0.00 ATOM 678 C MET A 90 -6.107 -2.807 -8.887 1.00 0.00 ATOM 679 N ARG A 91 -7.035 -2.372 -9.721 1.00 0.00 ATOM 680 CA ARG A 91 -8.412 -2.161 -9.282 1.00 0.00 ATOM 681 CB ARG A 91 -8.890 -0.761 -9.673 1.00 0.00 ATOM 682 CG ARG A 91 -8.075 0.367 -9.062 1.00 0.00 ATOM 683 CD ARG A 91 -8.282 0.446 -7.558 1.00 0.00 ATOM 684 NE ARG A 91 -9.694 0.577 -7.207 1.00 0.00 ATOM 685 CZ ARG A 91 -10.357 1.729 -7.193 1.00 0.00 ATOM 686 NH1 ARG A 91 -11.640 1.751 -6.860 1.00 0.00 ATOM 687 NH2 ARG A 91 -9.735 2.855 -7.512 1.00 0.00 ATOM 688 O ARG A 91 -9.139 -3.619 -11.042 1.00 0.00 ATOM 689 C ARG A 91 -9.359 -3.176 -9.915 1.00 0.00 ATOM 690 N ARG A 92 -10.387 -3.589 -9.181 1.00 0.00 ATOM 691 CA ARG A 92 -11.361 -4.532 -9.723 1.00 0.00 ATOM 692 CB ARG A 92 -11.927 -5.417 -8.610 1.00 0.00 ATOM 693 CG ARG A 92 -12.932 -6.451 -9.090 1.00 0.00 ATOM 694 CD ARG A 92 -13.448 -7.296 -7.937 1.00 0.00 ATOM 695 NE ARG A 92 -14.469 -8.248 -8.370 1.00 0.00 ATOM 696 CZ ARG A 92 -15.186 -9.002 -7.543 1.00 0.00 ATOM 697 NH1 ARG A 92 -16.092 -9.839 -8.027 1.00 0.00 ATOM 698 NH2 ARG A 92 -14.994 -8.916 -6.234 1.00 0.00 ATOM 699 O ARG A 92 -13.127 -2.908 -9.792 1.00 0.00 ATOM 700 C ARG A 92 -12.526 -3.806 -10.386 1.00 0.00 ATOM 701 N GLY A 93 -12.869 -4.212 -11.604 1.00 0.00 ATOM 702 CA GLY A 93 -13.981 -3.600 -12.312 1.00 0.00 ATOM 703 O GLY A 93 -14.805 -5.597 -13.343 1.00 0.00 ATOM 704 C GLY A 93 -15.071 -4.591 -12.679 1.00 0.00 ATOM 705 N GLU A 94 -16.305 -4.296 -12.283 1.00 0.00 ATOM 706 CA GLU A 94 -17.427 -5.189 -12.554 1.00 0.00 ATOM 707 CB GLU A 94 -18.644 -4.790 -11.717 1.00 0.00 ATOM 708 CG GLU A 94 -19.826 -5.737 -11.849 1.00 0.00 ATOM 709 CD GLU A 94 -21.011 -5.310 -11.006 1.00 0.00 ATOM 710 OE1 GLU A 94 -20.891 -4.302 -10.279 1.00 0.00 ATOM 711 OE2 GLU A 94 -22.061 -5.983 -11.072 1.00 0.00 ATOM 712 O GLU A 94 -18.364 -4.139 -14.501 1.00 0.00 ATOM 713 C GLU A 94 -17.837 -5.147 -14.025 1.00 0.00 ATOM 714 N THR A 95 -17.611 -6.247 -14.740 1.00 0.00 ATOM 715 CA THR A 95 -18.017 -6.358 -16.140 1.00 0.00 ATOM 716 CB THR A 95 -18.323 -4.978 -16.750 1.00 0.00 ATOM 717 CG2 THR A 95 -19.434 -4.286 -15.974 1.00 0.00 ATOM 718 OG1 THR A 95 -17.147 -4.160 -16.704 1.00 0.00 ATOM 719 O THR A 95 -17.056 -7.138 -18.198 1.00 0.00 ATOM 720 C THR A 95 -16.916 -7.001 -16.980 1.00 0.00 ATOM 721 N SER A 96 -15.817 -7.381 -16.336 1.00 0.00 ATOM 722 CA SER A 96 -14.680 -7.953 -17.048 1.00 0.00 ATOM 723 CB SER A 96 -13.598 -6.894 -17.268 1.00 0.00 ATOM 724 OG SER A 96 -13.095 -6.415 -16.033 1.00 0.00 ATOM 725 O SER A 96 -13.008 -9.627 -16.654 1.00 0.00 ATOM 726 C SER A 96 -14.057 -9.107 -16.268 1.00 0.00 ATOM 727 N VAL A 97 -14.690 -9.492 -15.165 1.00 0.00 ATOM 728 CA VAL A 97 -14.160 -10.548 -14.309 1.00 0.00 ATOM 729 CB VAL A 97 -14.067 -11.889 -15.060 1.00 0.00 ATOM 730 CG1 VAL A 97 -13.625 -12.998 -14.117 1.00 0.00 ATOM 731 CG2 VAL A 97 -15.419 -12.267 -15.645 1.00 0.00 ATOM 732 O VAL A 97 -12.438 -10.333 -12.650 1.00 0.00 ATOM 733 C VAL A 97 -12.762 -10.169 -13.829 1.00 0.00 ENDMDL