EXPDTA forecast-s_AL3-scwrl MODEL 1 REMARK 44 REMARK 44 model 1 is called forecast-s_AL3-scwrl ATOM 1 C MET 2 4.539 1.187 -19.206 1.00 0.00 ATOM 2 N SER A 3 4.802 0.039 -18.590 1.00 0.00 ATOM 3 CA SER A 3 4.763 -0.014 -17.138 1.00 0.00 ATOM 4 CB SER A 3 4.685 -1.464 -16.657 1.00 0.00 ATOM 5 OG SER A 3 5.878 -2.167 -16.960 1.00 0.00 ATOM 6 O SER A 3 6.999 0.864 -17.208 1.00 0.00 ATOM 7 C SER A 3 6.004 0.617 -16.523 1.00 0.00 ATOM 8 N GLU A 4 5.945 0.879 -15.225 1.00 0.00 ATOM 9 CA GLU A 4 7.080 1.483 -14.552 1.00 0.00 ATOM 10 CB GLU A 4 7.068 3.002 -14.739 1.00 0.00 ATOM 11 CG GLU A 4 8.266 3.711 -14.130 1.00 0.00 ATOM 12 CD GLU A 4 8.225 5.212 -14.345 1.00 0.00 ATOM 13 OE1 GLU A 4 7.251 5.698 -14.956 1.00 0.00 ATOM 14 OE2 GLU A 4 9.168 5.901 -13.903 1.00 0.00 ATOM 15 O GLU A 4 5.993 1.164 -12.442 1.00 0.00 ATOM 16 C GLU A 4 7.057 1.194 -13.062 1.00 0.00 ATOM 17 N THR A 5 8.236 0.976 -12.494 1.00 0.00 ATOM 18 CA THR A 5 8.349 0.738 -11.060 1.00 0.00 ATOM 19 CB THR A 5 9.325 -0.413 -10.754 1.00 0.00 ATOM 20 CG2 THR A 5 9.446 -0.624 -9.253 1.00 0.00 ATOM 21 OG1 THR A 5 8.845 -1.623 -11.355 1.00 0.00 ATOM 22 O THR A 5 9.871 2.574 -10.934 1.00 0.00 ATOM 23 C THR A 5 8.862 2.043 -10.475 1.00 0.00 ATOM 24 N PHE A 6 8.156 2.579 -9.487 1.00 0.00 ATOM 25 CA PHE A 6 8.590 3.818 -8.862 1.00 0.00 ATOM 26 CB PHE A 6 7.835 5.010 -9.454 1.00 0.00 ATOM 27 CG PHE A 6 6.358 4.988 -9.181 1.00 0.00 ATOM 28 CD1 PHE A 6 5.835 5.630 -8.072 1.00 0.00 ATOM 29 CD2 PHE A 6 5.492 4.326 -10.033 1.00 0.00 ATOM 30 CE1 PHE A 6 4.476 5.610 -7.821 1.00 0.00 ATOM 31 CE2 PHE A 6 4.133 4.306 -9.782 1.00 0.00 ATOM 32 CZ PHE A 6 3.624 4.945 -8.682 1.00 0.00 ATOM 33 O PHE A 6 7.703 2.826 -6.873 1.00 0.00 ATOM 34 C PHE A 6 8.323 3.767 -7.365 1.00 0.00 ATOM 35 N ASP A 7 8.810 4.768 -6.640 1.00 0.00 ATOM 36 CA ASP A 7 8.651 4.795 -5.192 1.00 0.00 ATOM 37 CB ASP A 7 9.992 5.077 -4.511 1.00 0.00 ATOM 38 CG ASP A 7 11.007 3.977 -4.746 1.00 0.00 ATOM 39 OD1 ASP A 7 10.673 2.798 -4.504 1.00 0.00 ATOM 40 OD2 ASP A 7 12.138 4.293 -5.171 1.00 0.00 ATOM 41 O ASP A 7 7.691 6.980 -5.263 1.00 0.00 ATOM 42 C ASP A 7 7.677 5.865 -4.748 1.00 0.00 ATOM 43 N VAL A 8 6.836 5.521 -3.780 1.00 0.00 ATOM 44 CA VAL A 8 5.869 6.470 -3.251 1.00 0.00 ATOM 45 CB VAL A 8 4.446 6.165 -3.754 1.00 0.00 ATOM 46 CG1 VAL A 8 3.449 7.149 -3.160 1.00 0.00 ATOM 47 CG2 VAL A 8 4.382 6.271 -5.269 1.00 0.00 ATOM 48 O VAL A 8 5.719 5.324 -1.158 1.00 0.00 ATOM 49 C VAL A 8 5.873 6.395 -1.733 1.00 0.00 ATOM 50 N GLU A 9 6.064 7.538 -1.086 1.00 0.00 ATOM 51 CA GLU A 9 6.051 7.580 0.366 1.00 0.00 ATOM 52 CB GLU A 9 7.253 8.368 0.890 1.00 0.00 ATOM 53 CG GLU A 9 7.309 8.481 2.405 1.00 0.00 ATOM 54 CD GLU A 9 8.507 9.276 2.886 1.00 0.00 ATOM 55 OE1 GLU A 9 9.284 9.754 2.033 1.00 0.00 ATOM 56 OE2 GLU A 9 8.668 9.420 4.116 1.00 0.00 ATOM 57 O GLU A 9 4.419 9.335 0.324 1.00 0.00 ATOM 58 C GLU A 9 4.762 8.259 0.810 1.00 0.00 ATOM 59 N LEU A 10 4.038 7.607 1.709 1.00 0.00 ATOM 60 CA LEU A 10 2.801 8.157 2.238 1.00 0.00 ATOM 61 CB LEU A 10 1.654 7.159 2.065 1.00 0.00 ATOM 62 CG LEU A 10 1.331 6.739 0.630 1.00 0.00 ATOM 63 CD1 LEU A 10 0.236 5.684 0.612 1.00 0.00 ATOM 64 CD2 LEU A 10 0.856 7.932 -0.185 1.00 0.00 ATOM 65 O LEU A 10 3.640 7.672 4.441 1.00 0.00 ATOM 66 C LEU A 10 3.008 8.449 3.721 1.00 0.00 ATOM 67 N THR A 11 2.476 9.579 4.160 1.00 0.00 ATOM 68 CA THR A 11 2.571 10.003 5.549 1.00 0.00 ATOM 69 CB THR A 11 3.399 11.294 5.690 1.00 0.00 ATOM 70 CG2 THR A 11 3.480 11.719 7.148 1.00 0.00 ATOM 71 OG1 THR A 11 4.726 11.069 5.198 1.00 0.00 ATOM 72 O THR A 11 0.448 11.095 5.428 1.00 0.00 ATOM 73 C THR A 11 1.128 10.232 5.982 1.00 0.00 ATOM 74 N LYS A 12 0.648 9.458 6.951 1.00 0.00 ATOM 75 CA LYS A 12 -0.732 9.622 7.389 1.00 0.00 ATOM 76 CB LYS A 12 -1.315 8.280 7.836 1.00 0.00 ATOM 77 CG LYS A 12 -1.418 7.247 6.726 1.00 0.00 ATOM 78 CD LYS A 12 -2.094 5.976 7.216 1.00 0.00 ATOM 79 CE LYS A 12 -2.243 4.963 6.093 1.00 0.00 ATOM 80 NZ LYS A 12 -2.856 3.692 6.569 1.00 0.00 ATOM 81 O LYS A 12 -1.927 10.583 9.220 1.00 0.00 ATOM 82 C LYS A 12 -0.893 10.580 8.557 1.00 0.00 ATOM 83 N ASN A 13 -2.051 13.223 10.733 1.00 0.00 ATOM 84 CA ASN A 13 -3.274 14.005 10.679 1.00 0.00 ATOM 85 CB ASN A 13 -3.041 15.313 9.920 1.00 0.00 ATOM 86 CG ASN A 13 -2.222 16.310 10.716 1.00 0.00 ATOM 87 ND2 ASN A 13 -1.664 17.299 10.027 1.00 0.00 ATOM 88 OD1 ASN A 13 -2.095 16.192 11.934 1.00 0.00 ATOM 89 O ASN A 13 -5.507 13.909 9.826 1.00 0.00 ATOM 90 C ASN A 13 -4.435 13.317 9.990 1.00 0.00 ATOM 91 N VAL A 14 -4.229 12.064 9.592 1.00 0.00 ATOM 92 CA VAL A 14 -5.262 11.284 8.911 1.00 0.00 ATOM 93 CB VAL A 14 -4.881 10.999 7.446 1.00 0.00 ATOM 94 CG1 VAL A 14 -5.926 10.114 6.786 1.00 0.00 ATOM 95 CG2 VAL A 14 -4.784 12.297 6.659 1.00 0.00 ATOM 96 O VAL A 14 -4.543 9.423 10.237 1.00 0.00 ATOM 97 C VAL A 14 -5.462 9.944 9.618 1.00 0.00 ATOM 98 N GLN A 15 -6.667 9.392 9.511 1.00 0.00 ATOM 99 CA GLN A 15 -7.015 8.126 10.151 1.00 0.00 ATOM 100 CB GLN A 15 -8.503 7.822 9.964 1.00 0.00 ATOM 101 CG GLN A 15 -9.427 8.741 10.746 1.00 0.00 ATOM 102 CD GLN A 15 -10.893 8.451 10.487 1.00 0.00 ATOM 103 OE1 GLN A 15 -11.231 7.580 9.684 1.00 0.00 ATOM 104 NE2 GLN A 15 -11.768 9.181 11.167 1.00 0.00 ATOM 105 O GLN A 15 -6.049 5.933 10.364 1.00 0.00 ATOM 106 C GLN A 15 -6.273 6.899 9.630 1.00 0.00 ATOM 107 N GLY A 16 -5.903 6.925 8.360 1.00 0.00 ATOM 108 CA GLY A 16 -5.202 5.792 7.774 1.00 0.00 ATOM 109 O GLY A 16 -4.688 7.395 6.088 1.00 0.00 ATOM 110 C GLY A 16 -4.535 6.246 6.495 1.00 0.00 ATOM 111 N LEU A 17 -3.802 5.345 5.851 1.00 0.00 ATOM 112 CA LEU A 17 -3.127 5.709 4.619 1.00 0.00 ATOM 113 CB LEU A 17 -2.083 4.654 4.248 1.00 0.00 ATOM 114 CG LEU A 17 -1.196 4.972 3.043 1.00 0.00 ATOM 115 CD1 LEU A 17 -0.405 6.250 3.281 1.00 0.00 ATOM 116 CD2 LEU A 17 -0.209 3.843 2.788 1.00 0.00 ATOM 117 O LEU A 17 -3.894 6.578 2.521 1.00 0.00 ATOM 118 C LEU A 17 -4.120 5.823 3.467 1.00 0.00 ATOM 119 N GLY A 18 -5.216 5.074 3.560 1.00 0.00 ATOM 120 CA GLY A 18 -6.256 5.150 2.546 1.00 0.00 ATOM 121 O GLY A 18 -6.695 4.461 0.304 1.00 0.00 ATOM 122 C GLY A 18 -6.185 4.173 1.389 1.00 0.00 ATOM 123 N ILE A 19 -5.549 3.027 1.594 1.00 0.00 ATOM 124 CA ILE A 19 -5.476 2.052 0.520 1.00 0.00 ATOM 125 CB ILE A 19 -4.017 1.735 0.143 1.00 0.00 ATOM 126 CG1 ILE A 19 -3.970 0.737 -1.015 1.00 0.00 ATOM 127 CG2 ILE A 19 -3.279 1.133 1.329 1.00 0.00 ATOM 128 CD1 ILE A 19 -2.602 0.601 -1.648 1.00 0.00 ATOM 129 O ILE A 19 -6.018 0.285 2.044 1.00 0.00 ATOM 130 C ILE A 19 -6.135 0.744 0.907 1.00 0.00 ATOM 131 N THR A 20 -6.858 0.162 -0.043 1.00 0.00 ATOM 132 CA THR A 20 -7.493 -1.126 0.172 1.00 0.00 ATOM 133 CB THR A 20 -9.016 -1.047 -0.039 1.00 0.00 ATOM 134 CG2 THR A 20 -9.657 -2.408 0.184 1.00 0.00 ATOM 135 OG1 THR A 20 -9.582 -0.110 0.887 1.00 0.00 ATOM 136 O THR A 20 -6.674 -1.621 -2.026 1.00 0.00 ATOM 137 C THR A 20 -6.826 -2.013 -0.865 1.00 0.00 ATOM 138 N ILE A 21 -6.416 -3.200 -0.445 1.00 0.00 ATOM 139 CA ILE A 21 -5.692 -4.091 -1.335 1.00 0.00 ATOM 140 CB ILE A 21 -4.263 -4.358 -0.826 1.00 0.00 ATOM 141 CG1 ILE A 21 -4.303 -5.014 0.555 1.00 0.00 ATOM 142 CG2 ILE A 21 -3.484 -3.056 -0.719 1.00 0.00 ATOM 143 CD1 ILE A 21 -2.953 -5.496 1.041 1.00 0.00 ATOM 144 O ILE A 21 -7.170 -5.885 -0.744 1.00 0.00 ATOM 145 C ILE A 21 -6.316 -5.459 -1.521 1.00 0.00 ATOM 146 N ALA A 22 -5.872 -6.146 -2.566 1.00 0.00 ATOM 147 CA ALA A 22 -6.354 -7.490 -2.855 1.00 0.00 ATOM 148 CB ALA A 22 -7.584 -7.432 -3.748 1.00 0.00 ATOM 149 O ALA A 22 -4.383 -7.712 -4.198 1.00 0.00 ATOM 150 C ALA A 22 -5.270 -8.281 -3.563 1.00 0.00 ATOM 151 N GLY A 23 -5.336 -9.599 -3.427 1.00 0.00 ATOM 152 CA GLY A 23 -4.401 -10.474 -4.112 1.00 0.00 ATOM 153 O GLY A 23 -6.189 -10.624 -5.684 1.00 0.00 ATOM 154 C GLY A 23 -4.973 -10.522 -5.517 1.00 0.00 ATOM 155 N TYR A 24 -4.114 -10.446 -6.522 1.00 0.00 ATOM 156 CA TYR A 24 -4.610 -10.486 -7.883 1.00 0.00 ATOM 157 CB TYR A 24 -4.934 -9.075 -8.377 1.00 0.00 ATOM 158 CG TYR A 24 -5.983 -8.363 -7.553 1.00 0.00 ATOM 159 CD1 TYR A 24 -5.617 -7.497 -6.530 1.00 0.00 ATOM 160 CD2 TYR A 24 -7.335 -8.559 -7.800 1.00 0.00 ATOM 161 CE1 TYR A 24 -6.568 -6.842 -5.771 1.00 0.00 ATOM 162 CE2 TYR A 24 -8.301 -7.912 -7.052 1.00 0.00 ATOM 163 CZ TYR A 24 -7.906 -7.049 -6.031 1.00 0.00 ATOM 164 OH TYR A 24 -8.855 -6.398 -5.277 1.00 0.00 ATOM 165 O TYR A 24 -2.536 -11.526 -8.426 1.00 0.00 ATOM 166 C TYR A 24 -3.605 -11.083 -8.837 1.00 0.00 ATOM 167 N ILE A 25 -3.954 -11.104 -10.118 1.00 0.00 ATOM 168 CA ILE A 25 -3.062 -11.643 -11.132 1.00 0.00 ATOM 169 CB ILE A 25 -3.303 -13.148 -11.353 1.00 0.00 ATOM 170 CG1 ILE A 25 -4.768 -13.407 -11.712 1.00 0.00 ATOM 171 CG2 ILE A 25 -2.969 -13.932 -10.093 1.00 0.00 ATOM 172 CD1 ILE A 25 -5.054 -14.836 -12.116 1.00 0.00 ATOM 173 O ILE A 25 -4.377 -10.523 -12.794 1.00 0.00 ATOM 174 C ILE A 25 -3.269 -10.942 -12.462 1.00 0.00 ATOM 175 N GLY A 26 -2.183 -10.811 -13.210 1.00 0.00 ATOM 176 CA GLY A 26 -2.217 -10.175 -14.517 1.00 0.00 ATOM 177 O GLY A 26 -0.413 -11.662 -15.012 1.00 0.00 ATOM 178 C GLY A 26 -1.389 -11.046 -15.442 1.00 0.00 ATOM 179 N ASP A 27 -1.774 -11.122 -16.709 1.00 0.00 ATOM 180 CA ASP A 27 -1.011 -11.952 -17.620 1.00 0.00 ATOM 181 CB ASP A 27 -1.898 -12.448 -18.764 1.00 0.00 ATOM 182 CG ASP A 27 -1.201 -13.468 -19.642 1.00 0.00 ATOM 183 OD1 ASP A 27 -0.020 -13.248 -19.985 1.00 0.00 ATOM 184 OD2 ASP A 27 -1.835 -14.488 -19.986 1.00 0.00 ATOM 185 O ASP A 27 -0.026 -10.271 -19.029 1.00 0.00 ATOM 186 C ASP A 27 0.152 -11.193 -18.231 1.00 0.00 ATOM 187 N LYS A 28 1.339 -11.552 -17.780 1.00 0.00 ATOM 188 CA LYS A 28 2.562 -11.037 -18.307 1.00 0.00 ATOM 189 CB LYS A 28 3.607 -10.899 -17.198 1.00 0.00 ATOM 190 CG LYS A 28 4.931 -10.313 -17.662 1.00 0.00 ATOM 191 CD LYS A 28 5.898 -10.147 -16.502 1.00 0.00 ATOM 192 CE LYS A 28 7.183 -9.467 -16.947 1.00 0.00 ATOM 193 NZ LYS A 28 8.128 -9.269 -15.814 1.00 0.00 ATOM 194 O LYS A 28 3.659 -13.005 -19.042 1.00 0.00 ATOM 195 C LYS A 28 3.136 -11.945 -19.375 1.00 0.00 ATOM 196 N LYS A 29 2.917 -11.577 -20.614 1.00 0.00 ATOM 197 CA LYS A 29 3.272 -12.395 -21.767 1.00 0.00 ATOM 198 CB LYS A 29 2.397 -13.649 -21.825 1.00 0.00 ATOM 199 CG LYS A 29 2.744 -14.596 -22.961 1.00 0.00 ATOM 200 CD LYS A 29 1.885 -15.850 -22.916 1.00 0.00 ATOM 201 CE LYS A 29 2.224 -16.792 -24.060 1.00 0.00 ATOM 202 NZ LYS A 29 1.392 -18.026 -24.028 1.00 0.00 ATOM 203 O LYS A 29 2.091 -10.881 -23.182 1.00 0.00 ATOM 204 C LYS A 29 3.081 -11.625 -23.069 1.00 0.00 ATOM 205 N LEU A 30 1.912 -16.712 -19.702 1.00 0.00 ATOM 206 CA LEU A 30 2.216 -16.760 -18.275 1.00 0.00 ATOM 207 CB LEU A 30 3.712 -16.544 -18.038 1.00 0.00 ATOM 208 CG LEU A 30 4.648 -17.624 -18.585 1.00 0.00 ATOM 209 CD1 LEU A 30 6.102 -17.216 -18.405 1.00 0.00 ATOM 210 CD2 LEU A 30 4.430 -18.942 -17.857 1.00 0.00 ATOM 211 O LEU A 30 0.950 -14.733 -18.107 1.00 0.00 ATOM 212 C LEU A 30 1.458 -15.684 -17.517 1.00 0.00 ATOM 213 N GLU A 31 1.366 -15.856 -16.205 1.00 0.00 ATOM 214 CA GLU A 31 0.679 -14.897 -15.356 1.00 0.00 ATOM 215 CB GLU A 31 -0.671 -15.455 -14.900 1.00 0.00 ATOM 216 CG GLU A 31 -1.657 -15.695 -16.031 1.00 0.00 ATOM 217 CD GLU A 31 -2.986 -16.236 -15.541 1.00 0.00 ATOM 218 OE1 GLU A 31 -3.117 -16.472 -14.321 1.00 0.00 ATOM 219 OE2 GLU A 31 -3.895 -16.424 -16.375 1.00 0.00 ATOM 220 O GLU A 31 2.353 -15.420 -13.722 1.00 0.00 ATOM 221 C GLU A 31 1.527 -14.602 -14.134 1.00 0.00 ATOM 222 N PRO A 32 1.322 -13.420 -13.565 1.00 0.00 ATOM 223 CA PRO A 32 2.043 -13.008 -12.374 1.00 0.00 ATOM 224 CB PRO A 32 2.846 -11.789 -12.831 1.00 0.00 ATOM 225 CG PRO A 32 2.036 -11.200 -13.937 1.00 0.00 ATOM 226 CD PRO A 32 1.370 -12.357 -14.627 1.00 0.00 ATOM 227 O PRO A 32 -0.032 -12.080 -11.613 1.00 0.00 ATOM 228 C PRO A 32 1.005 -12.675 -11.314 1.00 0.00 ATOM 229 N SER A 33 1.277 -13.080 -10.081 1.00 0.00 ATOM 230 CA SER A 33 0.367 -12.821 -8.977 1.00 0.00 ATOM 231 CB SER A 33 0.145 -14.093 -8.156 1.00 0.00 ATOM 232 OG SER A 33 1.354 -14.533 -7.561 1.00 0.00 ATOM 233 O SER A 33 2.185 -11.520 -8.115 1.00 0.00 ATOM 234 C SER A 33 0.974 -11.747 -8.090 1.00 0.00 ATOM 235 N GLY A 34 0.136 -11.075 -7.313 1.00 0.00 ATOM 236 CA GLY A 34 0.660 -10.046 -6.442 1.00 0.00 ATOM 237 O GLY A 34 -1.587 -9.610 -5.739 1.00 0.00 ATOM 238 C GLY A 34 -0.401 -9.284 -5.687 1.00 0.00 ATOM 239 N ILE A 35 0.049 -8.254 -4.978 1.00 0.00 ATOM 240 CA ILE A 35 -0.818 -7.399 -4.187 1.00 0.00 ATOM 241 CB ILE A 35 -0.134 -6.955 -2.880 1.00 0.00 ATOM 242 CG1 ILE A 35 0.216 -8.173 -2.022 1.00 0.00 ATOM 243 CG2 ILE A 35 -1.054 -6.048 -2.079 1.00 0.00 ATOM 244 CD1 ILE A 35 1.084 -7.847 -0.826 1.00 0.00 ATOM 245 O ILE A 35 -0.261 -5.463 -5.471 1.00 0.00 ATOM 246 C ILE A 35 -1.154 -6.169 -5.018 1.00 0.00 ATOM 247 N PHE A 36 -2.442 -5.915 -5.217 1.00 0.00 ATOM 248 CA PHE A 36 -2.862 -4.770 -6.005 1.00 0.00 ATOM 249 CB PHE A 36 -3.691 -5.223 -7.209 1.00 0.00 ATOM 250 CG PHE A 36 -2.925 -6.064 -8.190 1.00 0.00 ATOM 251 CD1 PHE A 36 -2.937 -7.445 -8.097 1.00 0.00 ATOM 252 CD2 PHE A 36 -2.193 -5.474 -9.206 1.00 0.00 ATOM 253 CE1 PHE A 36 -2.232 -8.218 -9.000 1.00 0.00 ATOM 254 CE2 PHE A 36 -1.489 -6.248 -10.109 1.00 0.00 ATOM 255 CZ PHE A 36 -1.506 -7.614 -10.009 1.00 0.00 ATOM 256 O PHE A 36 -4.412 -4.185 -4.281 1.00 0.00 ATOM 257 C PHE A 36 -3.713 -3.797 -5.210 1.00 0.00 ATOM 258 N VAL A 37 -3.643 -2.524 -5.585 1.00 0.00 ATOM 259 CA VAL A 37 -4.460 -1.510 -4.937 1.00 0.00 ATOM 260 CB VAL A 37 -3.903 -0.095 -5.182 1.00 0.00 ATOM 261 CG1 VAL A 37 -4.813 0.951 -4.556 1.00 0.00 ATOM 262 CG2 VAL A 37 -2.517 0.045 -4.572 1.00 0.00 ATOM 263 O VAL A 37 -5.985 -1.559 -6.790 1.00 0.00 ATOM 264 C VAL A 37 -5.839 -1.677 -5.571 1.00 0.00 ATOM 265 N LYS A 38 -6.841 -1.974 -4.752 1.00 0.00 ATOM 266 CA LYS A 38 -8.198 -2.176 -5.258 1.00 0.00 ATOM 267 CB LYS A 38 -8.861 -3.362 -4.554 1.00 0.00 ATOM 268 CG LYS A 38 -10.215 -3.746 -5.129 1.00 0.00 ATOM 269 CD LYS A 38 -10.784 -4.970 -4.429 1.00 0.00 ATOM 270 CE LYS A 38 -12.097 -5.406 -5.060 1.00 0.00 ATOM 271 NZ LYS A 38 -12.660 -6.612 -4.392 1.00 0.00 ATOM 272 O LYS A 38 -10.072 -0.761 -5.721 1.00 0.00 ATOM 273 C LYS A 38 -9.073 -0.956 -5.032 1.00 0.00 ATOM 274 N SER A 39 -8.703 -0.139 -4.052 1.00 0.00 ATOM 275 CA SER A 39 -9.483 1.046 -3.761 1.00 0.00 ATOM 276 CB SER A 39 -10.676 0.697 -2.869 1.00 0.00 ATOM 277 OG SER A 39 -11.414 1.857 -2.527 1.00 0.00 ATOM 278 O SER A 39 -7.664 1.763 -2.404 1.00 0.00 ATOM 279 C SER A 39 -8.659 2.092 -3.045 1.00 0.00 ATOM 280 N ILE A 40 -9.068 3.349 -3.176 1.00 0.00 ATOM 281 CA ILE A 40 -8.389 4.464 -2.521 1.00 0.00 ATOM 282 CB ILE A 40 -7.630 5.338 -3.537 1.00 0.00 ATOM 283 CG1 ILE A 40 -6.563 4.513 -4.258 1.00 0.00 ATOM 284 CG2 ILE A 40 -6.947 6.501 -2.834 1.00 0.00 ATOM 285 CD1 ILE A 40 -5.912 5.235 -5.417 1.00 0.00 ATOM 286 O ILE A 40 -10.435 5.709 -2.410 1.00 0.00 ATOM 287 C ILE A 40 -9.436 5.321 -1.814 1.00 0.00 ATOM 288 N THR A 41 -9.197 5.614 -0.541 1.00 0.00 ATOM 289 CA THR A 41 -10.128 6.417 0.246 1.00 0.00 ATOM 290 CB THR A 41 -9.853 6.283 1.755 1.00 0.00 ATOM 291 CG2 THR A 41 -10.827 7.137 2.552 1.00 0.00 ATOM 292 OG1 THR A 41 -10.005 4.914 2.152 1.00 0.00 ATOM 293 O THR A 41 -8.960 8.491 -0.044 1.00 0.00 ATOM 294 C THR A 41 -10.035 7.902 -0.096 1.00 0.00 ATOM 295 N LYS A 42 -11.169 8.532 -0.440 1.00 0.00 ATOM 296 CA LYS A 42 -11.129 9.957 -0.777 1.00 0.00 ATOM 297 CB LYS A 42 -12.535 10.474 -1.087 1.00 0.00 ATOM 298 CG LYS A 42 -12.579 11.929 -1.525 1.00 0.00 ATOM 299 CD LYS A 42 -13.994 12.356 -1.880 1.00 0.00 ATOM 300 CE LYS A 42 -14.034 13.803 -2.343 1.00 0.00 ATOM 301 NZ LYS A 42 -15.418 14.244 -2.669 1.00 0.00 ATOM 302 O LYS A 42 -10.897 10.659 1.520 1.00 0.00 ATOM 303 C LYS A 42 -10.572 10.838 0.344 1.00 0.00 ATOM 304 N SER A 43 -9.712 11.774 -0.047 1.00 0.00 ATOM 305 CA SER A 43 -9.065 12.718 0.863 1.00 0.00 ATOM 306 CB SER A 43 -10.107 13.420 1.736 1.00 0.00 ATOM 307 OG SER A 43 -11.011 14.172 0.946 1.00 0.00 ATOM 308 O SER A 43 -7.652 12.707 2.805 1.00 0.00 ATOM 309 C SER A 43 -8.059 12.086 1.821 1.00 0.00 ATOM 310 N SER A 44 -7.662 10.850 1.537 1.00 0.00 ATOM 311 CA SER A 44 -6.685 10.156 2.370 1.00 0.00 ATOM 312 CB SER A 44 -6.930 8.646 2.338 1.00 0.00 ATOM 313 OG SER A 44 -6.665 8.113 1.052 1.00 0.00 ATOM 314 O SER A 44 -5.194 11.069 0.734 1.00 0.00 ATOM 315 C SER A 44 -5.304 10.478 1.803 1.00 0.00 ATOM 316 N ALA A 45 -4.229 10.106 2.521 1.00 0.00 ATOM 317 CA ALA A 45 -2.879 10.377 2.017 1.00 0.00 ATOM 318 CB ALA A 45 -1.835 9.790 2.955 1.00 0.00 ATOM 319 O ALA A 45 -2.080 10.387 -0.261 1.00 0.00 ATOM 320 C ALA A 45 -2.667 9.761 0.623 1.00 0.00 ATOM 321 N VAL A 46 -3.147 8.533 0.437 1.00 0.00 ATOM 322 CA VAL A 46 -3.007 7.837 -0.845 1.00 0.00 ATOM 323 CB VAL A 46 -3.640 6.434 -0.798 1.00 0.00 ATOM 324 CG1 VAL A 46 -3.661 5.812 -2.186 1.00 0.00 ATOM 325 CG2 VAL A 46 -2.847 5.522 0.126 1.00 0.00 ATOM 326 O VAL A 46 -3.180 8.702 -3.083 1.00 0.00 ATOM 327 C VAL A 46 -3.692 8.620 -1.966 1.00 0.00 ATOM 328 N GLU A 47 -4.854 9.182 -1.661 1.00 0.00 ATOM 329 CA GLU A 47 -5.614 9.961 -2.632 1.00 0.00 ATOM 330 CB GLU A 47 -7.022 10.245 -2.106 1.00 0.00 ATOM 331 CG GLU A 47 -7.891 11.049 -3.061 1.00 0.00 ATOM 332 CD GLU A 47 -8.227 10.286 -4.326 1.00 0.00 ATOM 333 OE1 GLU A 47 -7.959 9.066 -4.373 1.00 0.00 ATOM 334 OE2 GLU A 47 -8.757 10.906 -5.271 1.00 0.00 ATOM 335 O GLU A 47 -4.723 11.662 -4.081 1.00 0.00 ATOM 336 C GLU A 47 -4.936 11.303 -2.920 1.00 0.00 ATOM 337 N HIS A 48 -4.587 12.032 -1.863 1.00 0.00 ATOM 338 CA HIS A 48 -3.947 13.337 -2.016 1.00 0.00 ATOM 339 CB HIS A 48 -3.741 13.996 -0.651 1.00 0.00 ATOM 340 CG HIS A 48 -5.010 14.452 -0.002 1.00 0.00 ATOM 341 CD2 HIS A 48 -6.383 14.659 -0.439 1.00 0.00 ATOM 342 ND1 HIS A 48 -5.082 14.803 1.329 1.00 0.00 ATOM 343 CE1 HIS A 48 -6.344 15.167 1.618 1.00 0.00 ATOM 344 NE2 HIS A 48 -7.130 15.083 0.563 1.00 0.00 ATOM 345 O HIS A 48 -2.150 14.161 -3.374 1.00 0.00 ATOM 346 C HIS A 48 -2.585 13.235 -2.686 1.00 0.00 ATOM 347 N ASP A 49 -1.918 12.101 -2.490 1.00 0.00 ATOM 348 CA ASP A 49 -0.613 11.850 -3.093 1.00 0.00 ATOM 349 CB ASP A 49 -0.160 10.416 -2.813 1.00 0.00 ATOM 350 CG ASP A 49 1.234 10.132 -3.335 1.00 0.00 ATOM 351 OD1 ASP A 49 2.185 10.808 -2.888 1.00 0.00 ATOM 352 OD2 ASP A 49 1.377 9.235 -4.193 1.00 0.00 ATOM 353 O ASP A 49 0.158 12.718 -5.203 1.00 0.00 ATOM 354 C ASP A 49 -0.690 12.053 -4.606 1.00 0.00 ATOM 355 N GLY A 50 -1.717 11.472 -5.220 1.00 0.00 ATOM 356 CA GLY A 50 -1.901 11.606 -6.653 1.00 0.00 ATOM 357 O GLY A 50 -1.134 10.712 -8.727 1.00 0.00 ATOM 358 C GLY A 50 -0.992 10.740 -7.505 1.00 0.00 ATOM 359 N ARG A 51 -0.058 10.031 -6.879 1.00 0.00 ATOM 360 CA ARG A 51 0.857 9.180 -7.632 1.00 0.00 ATOM 361 CB ARG A 51 2.302 9.429 -7.196 1.00 0.00 ATOM 362 CG ARG A 51 2.819 10.820 -7.525 1.00 0.00 ATOM 363 CD ARG A 51 4.250 11.005 -7.048 1.00 0.00 ATOM 364 NE ARG A 51 4.762 12.338 -7.357 1.00 0.00 ATOM 365 CZ ARG A 51 5.955 12.786 -6.981 1.00 0.00 ATOM 366 NH1 ARG A 51 6.337 14.013 -7.308 1.00 0.00 ATOM 367 NH2 ARG A 51 6.765 12.005 -6.278 1.00 0.00 ATOM 368 O ARG A 51 1.405 6.848 -7.815 1.00 0.00 ATOM 369 C ARG A 51 0.586 7.691 -7.445 1.00 0.00 ATOM 370 N ILE A 52 -0.562 7.379 -6.858 1.00 0.00 ATOM 371 CA ILE A 52 -0.975 5.996 -6.645 1.00 0.00 ATOM 372 CB ILE A 52 -1.183 5.693 -5.149 1.00 0.00 ATOM 373 CG1 ILE A 52 0.121 5.901 -4.377 1.00 0.00 ATOM 374 CG2 ILE A 52 -1.634 4.253 -4.955 1.00 0.00 ATOM 375 CD1 ILE A 52 -0.044 5.846 -2.874 1.00 0.00 ATOM 376 O ILE A 52 -3.195 6.623 -7.287 1.00 0.00 ATOM 377 C ILE A 52 -2.284 5.802 -7.395 1.00 0.00 ATOM 378 N GLN A 53 -2.376 4.717 -8.153 1.00 0.00 ATOM 379 CA GLN A 53 -3.579 4.453 -8.919 1.00 0.00 ATOM 380 CB GLN A 53 -3.277 4.485 -10.419 1.00 0.00 ATOM 381 CG GLN A 53 -2.791 5.833 -10.925 1.00 0.00 ATOM 382 CD GLN A 53 -2.505 5.828 -12.414 1.00 0.00 ATOM 383 OE1 GLN A 53 -2.599 4.790 -13.070 1.00 0.00 ATOM 384 NE2 GLN A 53 -2.155 6.990 -12.952 1.00 0.00 ATOM 385 O GLN A 53 -3.464 2.155 -8.249 1.00 0.00 ATOM 386 C GLN A 53 -4.172 3.096 -8.601 1.00 0.00 ATOM 387 N ILE A 54 -5.488 3.014 -8.718 1.00 0.00 ATOM 388 CA ILE A 54 -6.181 1.762 -8.509 1.00 0.00 ATOM 389 CB ILE A 54 -7.707 1.936 -8.624 1.00 0.00 ATOM 390 CG1 ILE A 54 -8.227 2.836 -7.501 1.00 0.00 ATOM 391 CG2 ILE A 54 -8.405 0.588 -8.523 1.00 0.00 ATOM 392 CD1 ILE A 54 -9.679 3.233 -7.660 1.00 0.00 ATOM 393 O ILE A 54 -5.550 1.292 -10.767 1.00 0.00 ATOM 394 C ILE A 54 -5.637 0.868 -9.611 1.00 0.00 ATOM 395 N GLY A 55 -5.263 -0.355 -9.258 1.00 0.00 ATOM 396 CA GLY A 55 -4.710 -1.269 -10.242 1.00 0.00 ATOM 397 O GLY A 55 -2.601 -2.311 -10.697 1.00 0.00 ATOM 398 C GLY A 55 -3.198 -1.397 -10.128 1.00 0.00 ATOM 399 N ASP A 56 -2.566 -0.475 -9.404 1.00 0.00 ATOM 400 CA ASP A 56 -1.111 -0.538 -9.224 1.00 0.00 ATOM 401 CB ASP A 56 -0.601 0.730 -8.537 1.00 0.00 ATOM 402 CG ASP A 56 -0.627 1.939 -9.452 1.00 0.00 ATOM 403 OD1 ASP A 56 -0.844 1.758 -10.669 1.00 0.00 ATOM 404 OD2 ASP A 56 -0.431 3.067 -8.952 1.00 0.00 ATOM 405 O ASP A 56 -1.561 -2.137 -7.514 1.00 0.00 ATOM 406 C ASP A 56 -0.769 -1.744 -8.363 1.00 0.00 ATOM 407 N GLN A 57 0.403 -2.336 -8.566 1.00 0.00 ATOM 408 CA GLN A 57 0.791 -3.450 -7.715 1.00 0.00 ATOM 409 CB GLN A 57 1.365 -4.592 -8.556 1.00 0.00 ATOM 410 CG GLN A 57 1.687 -5.847 -7.761 1.00 0.00 ATOM 411 CD GLN A 57 2.122 -7.000 -8.644 1.00 0.00 ATOM 412 OE1 GLN A 57 2.261 -6.847 -9.857 1.00 0.00 ATOM 413 NE2 GLN A 57 2.339 -8.160 -8.035 1.00 0.00 ATOM 414 O GLN A 57 2.681 -2.116 -7.043 1.00 0.00 ATOM 415 C GLN A 57 1.854 -2.971 -6.723 1.00 0.00 ATOM 416 N ILE A 58 1.802 -3.500 -5.509 1.00 0.00 ATOM 417 CA ILE A 58 2.776 -3.142 -4.493 1.00 0.00 ATOM 418 CB ILE A 58 2.127 -3.042 -3.100 1.00 0.00 ATOM 419 CG1 ILE A 58 1.042 -1.963 -3.093 1.00 0.00 ATOM 420 CG2 ILE A 58 3.170 -2.683 -2.052 1.00 0.00 ATOM 421 CD1 ILE A 58 0.205 -1.947 -1.833 1.00 0.00 ATOM 422 O ILE A 58 3.556 -5.399 -4.212 1.00 0.00 ATOM 423 C ILE A 58 3.848 -4.231 -4.478 1.00 0.00 ATOM 424 N ILE A 59 5.084 -3.852 -4.796 1.00 0.00 ATOM 425 CA ILE A 59 6.182 -4.811 -4.826 1.00 0.00 ATOM 426 CB ILE A 59 7.287 -4.373 -5.805 1.00 0.00 ATOM 427 CG1 ILE A 59 6.757 -4.369 -7.240 1.00 0.00 ATOM 428 CG2 ILE A 59 8.471 -5.325 -5.732 1.00 0.00 ATOM 429 CD1 ILE A 59 7.693 -3.718 -8.235 1.00 0.00 ATOM 430 O ILE A 59 7.159 -6.082 -3.045 1.00 0.00 ATOM 431 C ILE A 59 6.829 -4.970 -3.457 1.00 0.00 ATOM 432 N ALA A 60 7.017 -3.860 -2.754 1.00 0.00 ATOM 433 CA ALA A 60 7.619 -3.924 -1.429 1.00 0.00 ATOM 434 CB ALA A 60 9.130 -3.774 -1.525 1.00 0.00 ATOM 435 O ALA A 60 6.516 -1.829 -1.072 1.00 0.00 ATOM 436 C ALA A 60 7.068 -2.807 -0.564 1.00 0.00 ATOM 437 N VAL A 61 7.212 -2.974 0.745 1.00 0.00 ATOM 438 CA VAL A 61 6.728 -2.001 1.718 1.00 0.00 ATOM 439 CB VAL A 61 5.447 -2.491 2.417 1.00 0.00 ATOM 440 CG1 VAL A 61 4.965 -1.463 3.429 1.00 0.00 ATOM 441 CG2 VAL A 61 4.339 -2.720 1.400 1.00 0.00 ATOM 442 O VAL A 61 8.176 -2.713 3.484 1.00 0.00 ATOM 443 C VAL A 61 7.814 -1.788 2.764 1.00 0.00 ATOM 444 N ASP A 62 8.334 -0.567 2.841 1.00 0.00 ATOM 445 CA ASP A 62 9.402 -0.256 3.784 1.00 0.00 ATOM 446 CB ASP A 62 8.881 -0.315 5.222 1.00 0.00 ATOM 447 CG ASP A 62 7.816 0.728 5.498 1.00 0.00 ATOM 448 OD1 ASP A 62 8.042 1.910 5.166 1.00 0.00 ATOM 449 OD2 ASP A 62 6.756 0.362 6.048 1.00 0.00 ATOM 450 O ASP A 62 11.100 -1.729 4.643 1.00 0.00 ATOM 451 C ASP A 62 10.550 -1.253 3.649 1.00 0.00 ATOM 452 N GLY A 63 10.897 -1.570 2.405 1.00 0.00 ATOM 453 CA GLY A 63 11.993 -2.485 2.142 1.00 0.00 ATOM 454 O GLY A 63 12.567 -4.795 2.057 1.00 0.00 ATOM 455 C GLY A 63 11.681 -3.963 2.245 1.00 0.00 ATOM 456 N THR A 64 10.433 -4.302 2.542 1.00 0.00 ATOM 457 CA THR A 64 10.049 -5.701 2.659 1.00 0.00 ATOM 458 CB THR A 64 9.143 -5.937 3.882 1.00 0.00 ATOM 459 CG2 THR A 64 8.742 -7.402 3.972 1.00 0.00 ATOM 460 OG1 THR A 64 9.844 -5.574 5.077 1.00 0.00 ATOM 461 O THR A 64 8.268 -5.597 1.059 1.00 0.00 ATOM 462 C THR A 64 9.285 -6.179 1.430 1.00 0.00 ATOM 463 N ASN A 65 9.794 -7.241 0.807 1.00 0.00 ATOM 464 CA ASN A 65 9.189 -7.838 -0.383 1.00 0.00 ATOM 465 CB ASN A 65 10.056 -8.985 -0.907 1.00 0.00 ATOM 466 CG ASN A 65 9.579 -9.510 -2.247 1.00 0.00 ATOM 467 ND2 ASN A 65 10.475 -10.166 -2.976 1.00 0.00 ATOM 468 OD1 ASN A 65 8.421 -9.327 -2.620 1.00 0.00 ATOM 469 O ASN A 65 7.658 -9.242 0.822 1.00 0.00 ATOM 470 C ASN A 65 7.798 -8.392 -0.057 1.00 0.00 ATOM 471 N LEU A 66 6.769 -7.919 -0.757 1.00 0.00 ATOM 472 CA LEU A 66 5.413 -8.402 -0.502 1.00 0.00 ATOM 473 CB LEU A 66 4.513 -7.254 -0.041 1.00 0.00 ATOM 474 CG LEU A 66 4.893 -6.583 1.281 1.00 0.00 ATOM 475 CD1 LEU A 66 4.020 -5.364 1.536 1.00 0.00 ATOM 476 CD2 LEU A 66 4.716 -7.547 2.444 1.00 0.00 ATOM 477 O LEU A 66 3.547 -9.215 -1.789 1.00 0.00 ATOM 478 C LEU A 66 4.767 -9.017 -1.742 1.00 0.00 ATOM 479 N GLN A 67 5.590 -9.338 -2.735 1.00 0.00 ATOM 480 CA GLN A 67 5.090 -9.921 -3.977 1.00 0.00 ATOM 481 CB GLN A 67 6.253 -10.344 -4.877 1.00 0.00 ATOM 482 CG GLN A 67 5.824 -10.910 -6.221 1.00 0.00 ATOM 483 CD GLN A 67 7.002 -11.297 -7.093 1.00 0.00 ATOM 484 OE1 GLN A 67 8.153 -11.240 -6.659 1.00 0.00 ATOM 485 NE2 GLN A 67 6.718 -11.693 -8.328 1.00 0.00 ATOM 486 O GLN A 67 3.229 -11.348 -4.456 1.00 0.00 ATOM 487 C GLN A 67 4.225 -11.158 -3.762 1.00 0.00 ATOM 488 N GLY A 68 4.596 -11.995 -2.799 1.00 0.00 ATOM 489 CA GLY A 68 3.837 -13.217 -2.539 1.00 0.00 ATOM 490 O GLY A 68 2.702 -14.273 -0.709 1.00 0.00 ATOM 491 C GLY A 68 3.133 -13.224 -1.189 1.00 0.00 ATOM 492 N PHE A 69 3.001 -12.050 -0.582 1.00 0.00 ATOM 493 CA PHE A 69 2.354 -11.949 0.717 1.00 0.00 ATOM 494 CB PHE A 69 2.667 -10.600 1.368 1.00 0.00 ATOM 495 CG PHE A 69 4.110 -10.432 1.750 1.00 0.00 ATOM 496 CD1 PHE A 69 4.945 -11.531 1.856 1.00 0.00 ATOM 497 CD2 PHE A 69 4.632 -9.176 2.005 1.00 0.00 ATOM 498 CE1 PHE A 69 6.273 -11.376 2.208 1.00 0.00 ATOM 499 CE2 PHE A 69 5.959 -9.021 2.356 1.00 0.00 ATOM 500 CZ PHE A 69 6.779 -10.115 2.458 1.00 0.00 ATOM 501 O PHE A 69 0.227 -11.835 -0.413 1.00 0.00 ATOM 502 C PHE A 69 0.838 -12.067 0.636 1.00 0.00 ATOM 503 N THR A 70 0.239 -12.455 1.755 1.00 0.00 ATOM 504 CA THR A 70 -1.206 -12.550 1.860 1.00 0.00 ATOM 505 CB THR A 70 -1.628 -13.466 3.023 1.00 0.00 ATOM 506 CG2 THR A 70 -1.032 -14.855 2.851 1.00 0.00 ATOM 507 OG1 THR A 70 -1.167 -12.914 4.262 1.00 0.00 ATOM 508 O THR A 70 -0.819 -10.268 2.466 1.00 0.00 ATOM 509 C THR A 70 -1.645 -11.107 2.098 1.00 0.00 ATOM 510 N ASN A 71 -2.922 -10.807 1.892 1.00 0.00 ATOM 511 CA ASN A 71 -3.399 -9.446 2.117 1.00 0.00 ATOM 512 CB ASN A 71 -4.884 -9.334 1.767 1.00 0.00 ATOM 513 CG ASN A 71 -5.135 -9.372 0.272 1.00 0.00 ATOM 514 ND2 ASN A 71 -6.369 -9.679 -0.112 1.00 0.00 ATOM 515 OD1 ASN A 71 -4.230 -9.127 -0.525 1.00 0.00 ATOM 516 O ASN A 71 -2.734 -7.969 3.888 1.00 0.00 ATOM 517 C ASN A 71 -3.214 -9.058 3.581 1.00 0.00 ATOM 518 N GLN A 72 -3.584 -9.958 4.486 1.00 0.00 ATOM 519 CA GLN A 72 -3.458 -9.671 5.910 1.00 0.00 ATOM 520 CB GLN A 72 -3.924 -10.868 6.741 1.00 0.00 ATOM 521 CG GLN A 72 -5.425 -11.106 6.700 1.00 0.00 ATOM 522 CD GLN A 72 -5.836 -12.363 7.440 1.00 0.00 ATOM 523 OE1 GLN A 72 -4.989 -13.119 7.917 1.00 0.00 ATOM 524 NE2 GLN A 72 -7.141 -12.591 7.539 1.00 0.00 ATOM 525 O GLN A 72 -1.793 -8.494 7.167 1.00 0.00 ATOM 526 C GLN A 72 -2.026 -9.364 6.325 1.00 0.00 ATOM 527 N GLN A 73 -1.067 -10.079 5.743 1.00 0.00 ATOM 528 CA GLN A 73 0.339 -9.865 6.064 1.00 0.00 ATOM 529 CB GLN A 73 1.221 -10.848 5.291 1.00 0.00 ATOM 530 CG GLN A 73 2.696 -10.774 5.651 1.00 0.00 ATOM 531 CD GLN A 73 2.963 -11.157 7.093 1.00 0.00 ATOM 532 OE1 GLN A 73 2.444 -12.158 7.586 1.00 0.00 ATOM 533 NE2 GLN A 73 3.777 -10.359 7.775 1.00 0.00 ATOM 534 O GLN A 73 1.555 -7.824 6.420 1.00 0.00 ATOM 535 C GLN A 73 0.775 -8.448 5.700 1.00 0.00 ATOM 536 N ALA A 74 0.280 -7.941 4.575 1.00 0.00 ATOM 537 CA ALA A 74 0.639 -6.591 4.157 1.00 0.00 ATOM 538 CB ALA A 74 0.169 -6.334 2.733 1.00 0.00 ATOM 539 O ALA A 74 0.593 -4.591 5.482 1.00 0.00 ATOM 540 C ALA A 74 -0.024 -5.586 5.092 1.00 0.00 ATOM 541 N VAL A 75 -1.278 -5.846 5.451 1.00 0.00 ATOM 542 CA VAL A 75 -1.994 -4.950 6.358 1.00 0.00 ATOM 543 CB VAL A 75 -3.438 -5.428 6.601 1.00 0.00 ATOM 544 CG1 VAL A 75 -4.096 -4.601 7.694 1.00 0.00 ATOM 545 CG2 VAL A 75 -4.264 -5.292 5.331 1.00 0.00 ATOM 546 O VAL A 75 -1.112 -3.816 8.281 1.00 0.00 ATOM 547 C VAL A 75 -1.275 -4.894 7.706 1.00 0.00 ATOM 548 N GLU A 76 -0.841 -6.047 8.209 1.00 0.00 ATOM 549 CA GLU A 76 -0.130 -6.070 9.486 1.00 0.00 ATOM 550 CB GLU A 76 0.248 -7.504 9.863 1.00 0.00 ATOM 551 CG GLU A 76 -0.933 -8.374 10.260 1.00 0.00 ATOM 552 CD GLU A 76 -0.538 -9.816 10.507 1.00 0.00 ATOM 553 OE1 GLU A 76 0.647 -10.152 10.296 1.00 0.00 ATOM 554 OE2 GLU A 76 -1.412 -10.611 10.911 1.00 0.00 ATOM 555 O GLU A 76 1.468 -4.474 10.298 1.00 0.00 ATOM 556 C GLU A 76 1.145 -5.237 9.387 1.00 0.00 ATOM 557 N VAL A 77 1.866 -5.384 8.279 1.00 0.00 ATOM 558 CA VAL A 77 3.098 -4.630 8.063 1.00 0.00 ATOM 559 CB VAL A 77 3.729 -4.959 6.697 1.00 0.00 ATOM 560 CG1 VAL A 77 4.893 -4.023 6.409 1.00 0.00 ATOM 561 CG2 VAL A 77 4.246 -6.389 6.680 1.00 0.00 ATOM 562 O VAL A 77 3.585 -2.365 8.704 1.00 0.00 ATOM 563 C VAL A 77 2.829 -3.129 8.101 1.00 0.00 ATOM 564 N LEU A 78 1.754 -2.707 7.446 1.00 0.00 ATOM 565 CA LEU A 78 1.400 -1.296 7.421 1.00 0.00 ATOM 566 CB LEU A 78 0.186 -1.064 6.520 1.00 0.00 ATOM 567 CG LEU A 78 0.410 -1.256 5.018 1.00 0.00 ATOM 568 CD1 LEU A 78 -0.908 -1.174 4.263 1.00 0.00 ATOM 569 CD2 LEU A 78 1.338 -0.182 4.472 1.00 0.00 ATOM 570 O LEU A 78 1.479 0.307 9.202 1.00 0.00 ATOM 571 C LEU A 78 1.054 -0.781 8.816 1.00 0.00 ATOM 572 N ARG A 79 0.287 -1.563 9.571 1.00 0.00 ATOM 573 CA ARG A 79 -0.112 -1.153 10.915 1.00 0.00 ATOM 574 CB ARG A 79 -1.138 -2.131 11.491 1.00 0.00 ATOM 575 CG ARG A 79 -2.502 -2.064 10.823 1.00 0.00 ATOM 576 CD ARG A 79 -3.455 -3.092 11.410 1.00 0.00 ATOM 577 NE ARG A 79 -4.752 -3.083 10.738 1.00 0.00 ATOM 578 CZ ARG A 79 -5.686 -4.014 10.903 1.00 0.00 ATOM 579 NH1 ARG A 79 -6.836 -3.923 10.249 1.00 0.00 ATOM 580 NH2 ARG A 79 -5.467 -5.035 11.720 1.00 0.00 ATOM 581 O ARG A 79 1.020 -0.405 12.894 1.00 0.00 ATOM 582 C ARG A 79 1.063 -1.105 11.881 1.00 0.00 ATOM 583 N HIS A 80 2.120 -1.839 11.558 1.00 0.00 ATOM 584 CA HIS A 80 3.310 -1.869 12.394 1.00 0.00 ATOM 585 CB HIS A 80 4.132 -3.128 12.111 1.00 0.00 ATOM 586 CG HIS A 80 3.472 -4.394 12.559 1.00 0.00 ATOM 587 CD2 HIS A 80 2.280 -4.729 13.324 1.00 0.00 ATOM 588 ND1 HIS A 80 3.978 -5.642 12.265 1.00 0.00 ATOM 589 CE1 HIS A 80 3.173 -6.578 12.798 1.00 0.00 ATOM 590 NE2 HIS A 80 2.152 -6.037 13.434 1.00 0.00 ATOM 591 O HIS A 80 5.107 -0.371 12.908 1.00 0.00 ATOM 592 C HIS A 80 4.194 -0.659 12.134 1.00 0.00 ATOM 593 N THR A 81 3.920 0.050 11.044 1.00 0.00 ATOM 594 CA THR A 81 4.695 1.230 10.698 1.00 0.00 ATOM 595 CB THR A 81 4.528 1.599 9.212 1.00 0.00 ATOM 596 CG2 THR A 81 4.939 0.435 8.325 1.00 0.00 ATOM 597 OG1 THR A 81 3.157 1.922 8.948 1.00 0.00 ATOM 598 O THR A 81 3.144 2.400 12.112 1.00 0.00 ATOM 599 C THR A 81 4.233 2.416 11.542 1.00 0.00 ATOM 600 N GLY A 82 5.068 3.443 11.630 1.00 0.00 ATOM 601 CA GLY A 82 4.711 4.622 12.405 1.00 0.00 ATOM 602 O GLY A 82 2.532 5.021 11.477 1.00 0.00 ATOM 603 C GLY A 82 3.684 5.432 11.619 1.00 0.00 ATOM 604 N GLN A 83 4.111 6.575 11.097 1.00 0.00 ATOM 605 CA GLN A 83 3.229 7.436 10.326 1.00 0.00 ATOM 606 CB GLN A 83 3.366 8.890 10.782 1.00 0.00 ATOM 607 CG GLN A 83 2.919 9.136 12.214 1.00 0.00 ATOM 608 CD GLN A 83 3.077 10.585 12.632 1.00 0.00 ATOM 609 OE1 GLN A 83 3.240 11.470 11.792 1.00 0.00 ATOM 610 NE2 GLN A 83 3.028 10.831 13.936 1.00 0.00 ATOM 611 O GLN A 83 2.819 7.942 8.027 1.00 0.00 ATOM 612 C GLN A 83 3.550 7.382 8.838 1.00 0.00 ATOM 613 N THR A 84 4.639 6.709 8.479 1.00 0.00 ATOM 614 CA THR A 84 5.020 6.629 7.074 1.00 0.00 ATOM 615 CB THR A 84 6.295 7.444 6.788 1.00 0.00 ATOM 616 CG2 THR A 84 6.091 8.903 7.165 1.00 0.00 ATOM 617 OG1 THR A 84 7.385 6.915 7.553 1.00 0.00 ATOM 618 O THR A 84 5.792 4.350 7.256 1.00 0.00 ATOM 619 C THR A 84 5.318 5.237 6.542 1.00 0.00 ATOM 620 N VAL A 85 5.029 5.059 5.261 1.00 0.00 ATOM 621 CA VAL A 85 5.300 3.803 4.584 1.00 0.00 ATOM 622 CB VAL A 85 4.024 2.953 4.439 1.00 0.00 ATOM 623 CG1 VAL A 85 4.325 1.662 3.693 1.00 0.00 ATOM 624 CG2 VAL A 85 3.462 2.598 5.807 1.00 0.00 ATOM 625 O VAL A 85 5.335 5.079 2.555 1.00 0.00 ATOM 626 C VAL A 85 5.845 4.165 3.210 1.00 0.00 ATOM 627 N LEU A 86 6.907 3.480 2.795 1.00 0.00 ATOM 628 CA LEU A 86 7.483 3.726 1.486 1.00 0.00 ATOM 629 CB LEU A 86 9.005 3.842 1.584 1.00 0.00 ATOM 630 CG LEU A 86 9.756 4.049 0.266 1.00 0.00 ATOM 631 CD1 LEU A 86 9.383 5.383 -0.361 1.00 0.00 ATOM 632 CD2 LEU A 86 11.259 4.034 0.496 1.00 0.00 ATOM 633 O LEU A 86 7.369 1.391 0.995 1.00 0.00 ATOM 634 C LEU A 86 7.080 2.533 0.644 1.00 0.00 ATOM 635 N LEU A 87 6.409 2.808 -0.465 1.00 0.00 ATOM 636 CA LEU A 87 5.923 1.755 -1.340 1.00 0.00 ATOM 637 CB LEU A 87 4.437 1.955 -1.645 1.00 0.00 ATOM 638 CG LEU A 87 3.491 1.947 -0.443 1.00 0.00 ATOM 639 CD1 LEU A 87 2.064 2.241 -0.880 1.00 0.00 ATOM 640 CD2 LEU A 87 3.507 0.590 0.244 1.00 0.00 ATOM 641 O LEU A 87 6.836 2.731 -3.315 1.00 0.00 ATOM 642 C LEU A 87 6.646 1.702 -2.673 1.00 0.00 ATOM 643 N THR A 88 7.057 0.499 -3.069 1.00 0.00 ATOM 644 CA THR A 88 7.696 0.284 -4.365 1.00 0.00 ATOM 645 CB THR A 88 8.772 -0.815 -4.288 1.00 0.00 ATOM 646 CG2 THR A 88 9.409 -1.033 -5.652 1.00 0.00 ATOM 647 OG1 THR A 88 9.791 -0.426 -3.358 1.00 0.00 ATOM 648 O THR A 88 5.846 -1.147 -4.876 1.00 0.00 ATOM 649 C THR A 88 6.460 -0.115 -5.160 1.00 0.00 ATOM 650 N LEU A 89 6.106 0.709 -6.137 1.00 0.00 ATOM 651 CA LEU A 89 4.898 0.519 -6.936 1.00 0.00 ATOM 652 CB LEU A 89 4.026 1.776 -6.896 1.00 0.00 ATOM 653 CG LEU A 89 3.536 2.217 -5.516 1.00 0.00 ATOM 654 CD1 LEU A 89 2.759 3.521 -5.613 1.00 0.00 ATOM 655 CD2 LEU A 89 2.623 1.164 -4.907 1.00 0.00 ATOM 656 O LEU A 89 6.075 0.824 -8.997 1.00 0.00 ATOM 657 C LEU A 89 5.186 0.224 -8.404 1.00 0.00 ATOM 658 N MET A 90 4.439 -0.715 -8.981 1.00 0.00 ATOM 659 CA MET A 90 4.576 -1.015 -10.404 1.00 0.00 ATOM 660 CB MET A 90 4.788 -2.515 -10.617 1.00 0.00 ATOM 661 CG MET A 90 4.958 -2.917 -12.073 1.00 0.00 ATOM 662 SD MET A 90 5.266 -4.682 -12.277 1.00 0.00 ATOM 663 CE MET A 90 6.981 -4.787 -11.771 1.00 0.00 ATOM 664 O MET A 90 2.188 -1.013 -10.592 1.00 0.00 ATOM 665 C MET A 90 3.254 -0.534 -10.986 1.00 0.00 ATOM 666 N ARG A 91 3.325 0.419 -11.911 1.00 0.00 ATOM 667 CA ARG A 91 2.126 1.016 -12.489 1.00 0.00 ATOM 668 CB ARG A 91 1.980 2.470 -12.036 1.00 0.00 ATOM 669 CG ARG A 91 3.050 3.401 -12.583 1.00 0.00 ATOM 670 CD ARG A 91 2.921 4.797 -11.995 1.00 0.00 ATOM 671 NE ARG A 91 3.918 5.715 -12.540 1.00 0.00 ATOM 672 CZ ARG A 91 4.119 6.950 -12.094 1.00 0.00 ATOM 673 NH1 ARG A 91 5.049 7.714 -12.651 1.00 0.00 ATOM 674 NH2 ARG A 91 3.390 7.420 -11.090 1.00 0.00 ATOM 675 O ARG A 91 3.030 0.759 -14.704 1.00 0.00 ATOM 676 C ARG A 91 2.057 1.060 -14.012 1.00 0.00 ATOM 677 N ARG 92 0.886 1.467 -14.503 1.00 0.00 ATOM 678 CA ARG 92 0.595 1.602 -15.927 1.00 0.00 ENDMDL