HETATM 1 C ACE A 1 3.206 0.100 8.582 1.00 0.00 C HETATM 2 O ACE A 1 3.730 -0.641 7.748 1.00 0.00 O HETATM 3 CH3 ACE A 1 3.977 1.283 9.156 1.00 0.00 C HETATM 4 H1 ACE A 1 4.098 1.197 10.252 1.00 0.00 H HETATM 5 H2 ACE A 1 4.990 1.346 8.716 1.00 0.00 H HETATM 6 H3 ACE A 1 3.467 2.240 8.939 1.00 0.00 H ATOM 7 N ILE A 2 1.957 -0.061 9.047 1.00 0.00 N ATOM 8 CA ILE A 2 1.051 -1.156 8.594 1.00 0.00 C ATOM 9 C ILE A 2 0.345 -0.743 7.268 1.00 0.00 C ATOM 10 O ILE A 2 -0.223 0.347 7.150 1.00 0.00 O ATOM 11 CB ILE A 2 0.086 -1.688 9.719 1.00 0.00 C ATOM 12 CG1 ILE A 2 -0.724 -0.661 10.573 1.00 0.00 C ATOM 13 CG2 ILE A 2 0.853 -2.624 10.688 1.00 0.00 C ATOM 14 CD1 ILE A 2 -1.836 0.117 9.855 1.00 0.00 C ATOM 15 H ILE A 2 1.640 0.661 9.698 1.00 0.00 H ATOM 16 HA ILE A 2 1.702 -2.017 8.335 1.00 0.00 H ATOM 17 HB ILE A 2 -0.656 -2.342 9.223 1.00 0.00 H ATOM 18 HG12 ILE A 2 -1.216 -1.197 11.407 1.00 0.00 H ATOM 19 HG13 ILE A 2 -0.040 0.053 11.068 1.00 0.00 H ATOM 20 HG21 ILE A 2 1.628 -2.082 11.262 1.00 0.00 H ATOM 21 HG22 ILE A 2 0.180 -3.106 11.421 1.00 0.00 H ATOM 22 HG23 ILE A 2 1.363 -3.446 10.151 1.00 0.00 H ATOM 23 HD11 ILE A 2 -2.491 0.631 10.583 1.00 0.00 H ATOM 24 HD12 ILE A 2 -1.431 0.902 9.194 1.00 0.00 H ATOM 25 HD13 ILE A 2 -2.481 -0.544 9.247 1.00 0.00 H ATOM 26 N TRP A 3 0.416 -1.633 6.262 1.00 0.00 N ATOM 27 CA TRP A 3 -0.164 -1.390 4.917 1.00 0.00 C ATOM 28 C TRP A 3 -0.833 -2.699 4.420 1.00 0.00 C ATOM 29 O TRP A 3 -0.164 -3.724 4.240 1.00 0.00 O ATOM 30 CB TRP A 3 0.918 -0.925 3.896 1.00 0.00 C ATOM 31 CG TRP A 3 1.728 0.329 4.271 1.00 0.00 C ATOM 32 CD1 TRP A 3 1.197 1.598 4.578 1.00 0.00 C ATOM 33 CD2 TRP A 3 3.091 0.438 4.488 1.00 0.00 C ATOM 34 NE1 TRP A 3 2.196 2.506 4.973 1.00 0.00 N ATOM 35 CE2 TRP A 3 3.363 1.765 4.910 1.00 0.00 C ATOM 36 CE3 TRP A 3 4.142 -0.509 4.379 1.00 0.00 C ATOM 37 CZ2 TRP A 3 4.686 2.153 5.224 1.00 0.00 C ATOM 38 CZ3 TRP A 3 5.440 -0.101 4.690 1.00 0.00 C ATOM 39 CH2 TRP A 3 5.708 1.209 5.106 1.00 0.00 C ATOM 40 H TRP A 3 0.859 -2.520 6.509 1.00 0.00 H ATOM 41 HA TRP A 3 -0.914 -0.574 4.974 1.00 0.00 H ATOM 42 HB2 TRP A 3 1.613 -1.761 3.694 1.00 0.00 H ATOM 43 HB3 TRP A 3 0.431 -0.733 2.922 1.00 0.00 H ATOM 44 HD1 TRP A 3 0.141 1.815 4.606 1.00 0.00 H ATOM 45 HE1 TRP A 3 2.080 3.477 5.285 1.00 0.00 H ATOM 46 HE3 TRP A 3 3.950 -1.525 4.066 1.00 0.00 H ATOM 47 HZ2 TRP A 3 4.904 3.159 5.553 1.00 0.00 H ATOM 48 HZ3 TRP A 3 6.251 -0.810 4.613 1.00 0.00 H ATOM 49 HH2 TRP A 3 6.722 1.493 5.344 1.00 0.00 H ATOM 50 N GLY A 4 -2.153 -2.648 4.180 1.00 0.00 N ATOM 51 CA GLY A 4 -2.930 -3.810 3.685 1.00 0.00 C ATOM 52 C GLY A 4 -2.757 -4.004 2.159 1.00 0.00 C ATOM 53 O GLY A 4 -3.532 -3.416 1.397 1.00 0.00 O ATOM 54 H GLY A 4 -2.599 -1.771 4.466 1.00 0.00 H ATOM 55 HA2 GLY A 4 -2.704 -4.726 4.263 1.00 0.00 H ATOM 56 HA3 GLY A 4 -4.002 -3.615 3.906 1.00 0.00 H ATOM 57 N GLU A 5 -1.767 -4.812 1.707 1.00 0.00 N ATOM 58 CA GLU A 5 -1.517 -5.027 0.256 1.00 0.00 C ATOM 59 C GLU A 5 -2.498 -6.042 -0.391 1.00 0.00 C ATOM 60 O GLU A 5 -2.410 -7.254 -0.166 1.00 0.00 O ATOM 61 CB GLU A 5 -0.028 -5.431 -0.007 1.00 0.00 C ATOM 62 CG GLU A 5 0.785 -4.387 -0.806 1.00 0.00 C ATOM 63 CD GLU A 5 1.221 -3.145 0.003 1.00 0.00 C ATOM 64 OE1 GLU A 5 0.443 -2.603 0.794 1.00 0.00 O ATOM 65 H GLU A 5 -1.086 -5.152 2.399 1.00 0.00 H ATOM 66 HA GLU A 5 -1.665 -4.043 -0.237 1.00 0.00 H ATOM 67 HB2 GLU A 5 0.513 -5.685 0.926 1.00 0.00 H ATOM 68 HB3 GLU A 5 0.026 -6.375 -0.586 1.00 0.00 H ATOM 69 HG2 GLU A 5 1.659 -4.907 -1.242 1.00 0.00 H ATOM 70 HG3 GLU A 5 0.192 -4.062 -1.685 1.00 0.00 H ATOM 71 N SER A 6 -3.429 -5.510 -1.198 1.00 0.00 N ATOM 72 CA SER A 6 -4.426 -6.316 -1.937 1.00 0.00 C ATOM 73 C SER A 6 -4.942 -5.408 -3.085 1.00 0.00 C ATOM 74 O SER A 6 -5.844 -4.587 -2.883 1.00 0.00 O ATOM 75 CB SER A 6 -5.558 -6.841 -1.016 1.00 0.00 C ATOM 76 OG SER A 6 -6.451 -7.682 -1.739 1.00 0.00 O ATOM 77 H SER A 6 -3.416 -4.486 -1.251 1.00 0.00 H ATOM 78 HA SER A 6 -3.895 -7.190 -2.367 1.00 0.00 H ATOM 79 HB2 SER A 6 -5.139 -7.414 -0.168 1.00 0.00 H ATOM 80 HB3 SER A 6 -6.124 -6.004 -0.565 1.00 0.00 H ATOM 81 HG SER A 6 -5.941 -8.448 -2.013 1.00 0.00 H ATOM 82 N GLY A 7 -4.342 -5.542 -4.283 1.00 0.00 N ATOM 83 CA GLY A 7 -4.727 -4.721 -5.461 1.00 0.00 C ATOM 84 C GLY A 7 -3.762 -3.557 -5.774 1.00 0.00 C ATOM 85 O GLY A 7 -3.236 -3.488 -6.888 1.00 0.00 O ATOM 86 H GLY A 7 -3.531 -6.171 -4.292 1.00 0.00 H ATOM 87 HA2 GLY A 7 -4.770 -5.390 -6.340 1.00 0.00 H ATOM 88 HA3 GLY A 7 -5.758 -4.325 -5.372 1.00 0.00 H ATOM 89 N LYS A 8 -3.543 -2.643 -4.806 1.00 0.00 N ATOM 90 CA LYS A 8 -2.641 -1.470 -4.977 1.00 0.00 C ATOM 91 C LYS A 8 -1.136 -1.853 -5.139 1.00 0.00 C ATOM 92 O LYS A 8 -0.551 -2.532 -4.288 1.00 0.00 O ATOM 93 CB LYS A 8 -2.883 -0.417 -3.860 1.00 0.00 C ATOM 94 CG LYS A 8 -2.618 -0.811 -2.384 1.00 0.00 C ATOM 95 CD LYS A 8 -2.919 0.354 -1.413 1.00 0.00 C ATOM 96 CE LYS A 8 -2.862 0.003 0.086 1.00 0.00 C ATOM 97 NZ LYS A 8 -1.484 -0.195 0.580 1.00 0.00 N ATOM 98 H LYS A 8 -4.048 -2.820 -3.931 1.00 0.00 H ATOM 99 HA LYS A 8 -2.977 -0.965 -5.907 1.00 0.00 H ATOM 100 HB2 LYS A 8 -2.270 0.473 -4.096 1.00 0.00 H ATOM 101 HB3 LYS A 8 -3.927 -0.057 -3.947 1.00 0.00 H ATOM 102 HG2 LYS A 8 -3.237 -1.689 -2.119 1.00 0.00 H ATOM 103 HG3 LYS A 8 -1.567 -1.136 -2.262 1.00 0.00 H ATOM 104 HD2 LYS A 8 -2.249 1.209 -1.629 1.00 0.00 H ATOM 105 HD3 LYS A 8 -3.937 0.734 -1.625 1.00 0.00 H ATOM 106 HE2 LYS A 8 -3.332 0.822 0.665 1.00 0.00 H ATOM 107 HE3 LYS A 8 -3.474 -0.896 0.299 1.00 0.00 H ATOM 108 HZ1 LYS A 8 -1.459 -0.379 1.589 1.00 0.00 H ATOM 109 HZ2 LYS A 8 -1.023 -0.992 0.126 1.00 0.00 H ATOM 110 HZ3 LYS A 8 -0.897 0.630 0.409 1.00 0.00 H ATOM 111 N LEU A 9 -0.530 -1.385 -6.245 1.00 0.00 N ATOM 112 CA LEU A 9 0.902 -1.647 -6.585 1.00 0.00 C ATOM 113 C LEU A 9 2.025 -0.899 -5.788 1.00 0.00 C ATOM 114 O LEU A 9 3.206 -1.135 -6.061 1.00 0.00 O ATOM 115 CB LEU A 9 1.078 -1.563 -8.135 1.00 0.00 C ATOM 116 CG LEU A 9 0.960 -0.227 -8.932 1.00 0.00 C ATOM 117 CD1 LEU A 9 -0.436 0.425 -8.900 1.00 0.00 C ATOM 118 CD2 LEU A 9 2.049 0.814 -8.609 1.00 0.00 C ATOM 119 H LEU A 9 -1.139 -0.857 -6.878 1.00 0.00 H ATOM 120 HA LEU A 9 1.085 -2.712 -6.354 1.00 0.00 H ATOM 121 HB2 LEU A 9 2.066 -2.000 -8.378 1.00 0.00 H ATOM 122 HB3 LEU A 9 0.376 -2.286 -8.596 1.00 0.00 H ATOM 123 HG LEU A 9 1.130 -0.518 -9.985 1.00 0.00 H ATOM 124 HD11 LEU A 9 -0.514 1.251 -9.632 1.00 0.00 H ATOM 125 HD12 LEU A 9 -1.232 -0.300 -9.152 1.00 0.00 H ATOM 126 HD13 LEU A 9 -0.676 0.852 -7.908 1.00 0.00 H ATOM 127 HD21 LEU A 9 3.061 0.369 -8.641 1.00 0.00 H ATOM 128 HD22 LEU A 9 2.044 1.647 -9.336 1.00 0.00 H ATOM 129 HD23 LEU A 9 1.917 1.261 -7.607 1.00 0.00 H ATOM 130 N ILE A 10 1.683 -0.019 -4.828 1.00 0.00 N ATOM 131 CA ILE A 10 2.651 0.736 -3.998 1.00 0.00 C ATOM 132 C ILE A 10 2.087 0.672 -2.540 1.00 0.00 C ATOM 133 O ILE A 10 1.004 1.204 -2.264 1.00 0.00 O ATOM 134 CB ILE A 10 2.960 2.176 -4.548 1.00 0.00 C ATOM 135 CG1 ILE A 10 4.089 2.912 -3.768 1.00 0.00 C ATOM 136 CG2 ILE A 10 1.737 3.117 -4.682 1.00 0.00 C ATOM 137 CD1 ILE A 10 5.446 2.190 -3.744 1.00 0.00 C ATOM 138 H ILE A 10 0.704 -0.069 -4.542 1.00 0.00 H ATOM 139 HA ILE A 10 3.619 0.204 -4.070 1.00 0.00 H ATOM 140 HB ILE A 10 3.340 2.038 -5.579 1.00 0.00 H ATOM 141 HG12 ILE A 10 4.251 3.912 -4.213 1.00 0.00 H ATOM 142 HG13 ILE A 10 3.767 3.110 -2.727 1.00 0.00 H ATOM 143 HG21 ILE A 10 0.939 2.660 -5.295 1.00 0.00 H ATOM 144 HG22 ILE A 10 1.293 3.371 -3.702 1.00 0.00 H ATOM 145 HG23 ILE A 10 2.004 4.070 -5.175 1.00 0.00 H ATOM 146 HD11 ILE A 10 6.226 2.818 -3.279 1.00 0.00 H ATOM 147 HD12 ILE A 10 5.403 1.251 -3.161 1.00 0.00 H ATOM 148 HD13 ILE A 10 5.789 1.930 -4.763 1.00 0.00 H HETATM 149 N SET A 11 2.817 0.031 -1.605 1.00 0.00 N HETATM 150 CA SET A 11 2.384 -0.111 -0.187 1.00 0.00 C HETATM 151 CB SET A 11 2.743 1.155 0.662 1.00 0.00 C HETATM 152 OG SET A 11 3.667 1.127 1.480 1.00 0.00 O HETATM 153 NT SET A 11 2.457 -2.676 -0.229 1.00 0.00 N HETATM 154 C SET A 11 2.970 -1.431 0.402 1.00 0.00 C HETATM 155 H SET A 11 3.598 -0.533 -1.942 1.00 0.00 H HETATM 156 HA SET A 11 1.287 -0.273 -0.146 1.00 0.00 H HETATM 157 HB2 SET A 11 4.074 -1.424 0.327 1.00 0.00 H HETATM 158 HB3 SET A 11 2.774 -1.474 1.492 1.00 0.00 H HETATM 159 HNT2 SET A 11 3.005 -3.201 -0.920 1.00 0.00 H ATOM 160 N THR A 12 2.012 2.271 0.450 1.00 0.00 N ATOM 161 CA THR A 12 2.213 3.548 1.188 1.00 0.00 C ATOM 162 C THR A 12 0.775 4.100 1.440 1.00 0.00 C ATOM 163 O THR A 12 0.252 3.927 2.544 1.00 0.00 O ATOM 164 CB THR A 12 3.221 4.499 0.463 1.00 0.00 C ATOM 165 OG1 THR A 12 4.477 3.851 0.288 1.00 0.00 O ATOM 166 CG2 THR A 12 3.502 5.804 1.226 1.00 0.00 C ATOM 167 H THR A 12 1.466 2.283 -0.420 1.00 0.00 H ATOM 168 HA THR A 12 2.641 3.327 2.187 1.00 0.00 H ATOM 169 HB THR A 12 2.829 4.758 -0.539 1.00 0.00 H ATOM 170 HG1 THR A 12 5.067 4.509 -0.085 1.00 0.00 H ATOM 171 HG21 THR A 12 4.231 6.438 0.689 1.00 0.00 H ATOM 172 HG22 THR A 12 2.587 6.410 1.357 1.00 0.00 H ATOM 173 HG23 THR A 12 3.916 5.609 2.233 1.00 0.00 H ATOM 174 N THR A 13 0.134 4.735 0.433 1.00 0.00 N ATOM 175 CA THR A 13 -1.248 5.282 0.543 1.00 0.00 C ATOM 176 C THR A 13 -2.158 4.585 -0.517 1.00 0.00 C ATOM 177 O THR A 13 -3.028 3.797 -0.133 1.00 0.00 O ATOM 178 CB THR A 13 -1.284 6.843 0.510 1.00 0.00 C ATOM 179 OG1 THR A 13 -0.617 7.368 -0.636 1.00 0.00 O ATOM 180 CG2 THR A 13 -0.692 7.516 1.760 1.00 0.00 C ATOM 181 H THR A 13 0.713 4.951 -0.384 1.00 0.00 H ATOM 182 HA THR A 13 -1.686 4.997 1.520 1.00 0.00 H ATOM 183 HB THR A 13 -2.342 7.154 0.453 1.00 0.00 H ATOM 184 HG1 THR A 13 -1.263 7.369 -1.347 1.00 0.00 H ATOM 185 HG21 THR A 13 -1.203 7.185 2.683 1.00 0.00 H ATOM 186 HG22 THR A 13 0.384 7.290 1.879 1.00 0.00 H ATOM 187 HG23 THR A 13 -0.791 8.616 1.709 1.00 0.00 H ATOM 188 N ALA A 14 -1.964 4.857 -1.826 1.00 0.00 N ATOM 189 CA ALA A 14 -2.770 4.253 -2.917 1.00 0.00 C ATOM 190 C ALA A 14 -1.875 3.986 -4.147 1.00 0.00 C ATOM 191 O ALA A 14 -1.676 2.860 -4.598 1.00 0.00 O ATOM 192 CB ALA A 14 -3.978 5.147 -3.258 1.00 0.00 C ATOM 193 OXT ALA A 14 -1.330 5.128 -4.682 1.00 0.00 O ATOM 194 H ALA A 14 -1.184 5.494 -2.020 1.00 0.00 H ATOM 195 HA ALA A 14 -3.165 3.270 -2.596 1.00 0.00 H ATOM 196 HB1 ALA A 14 -4.641 5.285 -2.383 1.00 0.00 H ATOM 197 HB2 ALA A 14 -3.674 6.155 -3.599 1.00 0.00 H ATOM 198 HB3 ALA A 14 -4.598 4.704 -4.059 1.00 0.00 H ATOM 199 HXT ALA A 14 -0.787 4.928 -5.447 1.00 0.00 H TER 200 ALA A 14