HETATM 1 C ACE A 0 -3.373 -2.603 6.700 1.00 0.00 C HETATM 2 O ACE A 0 -3.682 -3.129 5.615 1.00 0.00 O HETATM 3 CH3 ACE A 0 -3.241 -3.474 7.931 1.00 0.00 C HETATM 4 H1 ACE A 0 -2.208 -3.753 8.060 1.00 0.00 H HETATM 5 H2 ACE A 0 -3.851 -4.364 7.821 1.00 0.00 H HETATM 6 H3 ACE A 0 -3.577 -2.921 8.792 1.00 0.00 H ATOM 7 N HIS A 1 -3.124 -1.259 6.893 1.00 0.00 N ATOM 8 CA HIS A 1 -3.199 -0.242 5.824 1.00 0.00 C ATOM 9 C HIS A 1 -1.862 -0.130 5.099 1.00 0.00 C ATOM 10 O HIS A 1 -1.814 0.346 3.959 1.00 0.00 O ATOM 11 CB HIS A 1 -3.572 1.121 6.408 1.00 0.00 C ATOM 12 CG HIS A 1 -4.252 2.038 5.441 1.00 0.00 C ATOM 13 ND1 HIS A 1 -5.565 1.878 5.040 1.00 0.00 N ATOM 14 CD2 HIS A 1 -3.795 3.131 4.784 1.00 0.00 C ATOM 15 CE1 HIS A 1 -5.881 2.832 4.176 1.00 0.00 C ATOM 16 NE2 HIS A 1 -4.822 3.606 4.008 1.00 0.00 N ATOM 17 H HIS A 1 -2.882 -0.961 7.792 1.00 0.00 H ATOM 18 HA HIS A 1 -3.961 -0.561 5.117 1.00 0.00 H ATOM 19 HB2 HIS A 1 -4.231 0.981 7.246 1.00 0.00 H ATOM 20 HB3 HIS A 1 -2.669 1.611 6.745 1.00 0.00 H ATOM 21 HD1 HIS A 1 -6.184 1.185 5.359 1.00 0.00 H ATOM 22 HD2 HIS A 1 -2.797 3.548 4.859 1.00 0.00 H ATOM 23 HE1 HIS A 1 -6.848 2.960 3.702 1.00 0.00 H ATOM 24 HE2 HIS A 1 -4.780 4.390 3.424 1.00 0.00 H HETATM 25 C MK8 A 2 0.676 -1.246 3.831 1.00 0.00 C HETATM 26 N MK8 A 2 -0.760 -0.596 5.795 1.00 0.00 N HETATM 27 O MK8 A 2 1.113 -0.632 2.827 1.00 0.00 O HETATM 28 CA MK8 A 2 0.645 -0.599 5.289 1.00 0.00 C HETATM 29 CB MK8 A 2 1.466 -1.451 6.337 1.00 0.00 C HETATM 30 CD MK8 A 2 2.831 -3.221 5.148 1.00 0.00 C HETATM 31 CE MK8 A 2 4.137 -3.823 4.576 1.00 0.00 C HETATM 32 CG MK8 A 2 2.898 -1.961 5.992 1.00 0.00 C HETATM 33 CB1 MK8 A 2 1.189 0.851 5.355 1.00 0.00 C HETATM 34 HN MK8 A 2 -0.904 -0.958 6.690 1.00 0.00 H HETATM 35 HB MK8 A 2 0.866 -2.320 6.596 1.00 0.00 H HETATM 36 HBA MK8 A 2 1.561 -0.847 7.221 1.00 0.00 H HETATM 37 HD MK8 A 2 2.171 -3.012 4.318 1.00 0.00 H HETATM 38 HDA MK8 A 2 2.376 -3.990 5.751 1.00 0.00 H HETATM 39 HE MK8 A 2 4.875 -4.098 5.301 1.00 0.00 H HETATM 40 HG MK8 A 2 3.414 -2.180 6.906 1.00 0.00 H HETATM 41 HGA MK8 A 2 3.427 -1.199 5.443 1.00 0.00 H HETATM 42 HB1 MK8 A 2 2.232 0.829 5.629 1.00 0.00 H HETATM 43 HB1A MK8 A 2 0.635 1.413 6.097 1.00 0.00 H HETATM 44 HB1B MK8 A 2 1.082 1.319 4.391 1.00 0.00 H ATOM 45 N ILE A 3 0.221 -2.545 3.804 1.00 0.00 N ATOM 46 CA ILE A 3 0.189 -3.409 2.591 1.00 0.00 C ATOM 47 C ILE A 3 -0.583 -2.739 1.461 1.00 0.00 C ATOM 48 O ILE A 3 -0.200 -2.877 0.289 1.00 0.00 O ATOM 49 CB ILE A 3 -0.391 -4.878 2.794 1.00 0.00 C ATOM 50 CG1 ILE A 3 -0.926 -5.267 4.238 1.00 0.00 C ATOM 51 CG2 ILE A 3 0.615 -5.918 2.276 1.00 0.00 C ATOM 52 CD1 ILE A 3 0.001 -5.096 5.466 1.00 0.00 C ATOM 53 H ILE A 3 -0.073 -2.932 4.645 1.00 0.00 H ATOM 54 HA ILE A 3 1.217 -3.515 2.276 1.00 0.00 H ATOM 55 HB ILE A 3 -1.237 -4.947 2.117 1.00 0.00 H ATOM 56 HG12 ILE A 3 -1.813 -4.695 4.434 1.00 0.00 H ATOM 57 HG13 ILE A 3 -1.202 -6.300 4.201 1.00 0.00 H ATOM 58 HG21 ILE A 3 1.342 -6.125 3.040 1.00 0.00 H ATOM 59 HG22 ILE A 3 1.118 -5.527 1.396 1.00 0.00 H ATOM 60 HG23 ILE A 3 0.097 -6.831 2.014 1.00 0.00 H ATOM 61 HD11 ILE A 3 0.944 -4.680 5.150 1.00 0.00 H ATOM 62 HD12 ILE A 3 0.167 -6.054 5.933 1.00 0.00 H ATOM 63 HD13 ILE A 3 -0.463 -4.426 6.183 1.00 0.00 H ATOM 64 N LEU A 4 -1.658 -1.984 1.867 1.00 0.00 N ATOM 65 CA LEU A 4 -2.535 -1.224 0.961 1.00 0.00 C ATOM 66 C LEU A 4 -1.707 -0.178 0.219 1.00 0.00 C ATOM 67 O LEU A 4 -1.840 -0.035 -1.006 1.00 0.00 O ATOM 68 CB LEU A 4 -3.652 -0.571 1.790 1.00 0.00 C ATOM 69 CG LEU A 4 -4.798 0.110 1.030 1.00 0.00 C ATOM 70 CD1 LEU A 4 -6.030 0.158 1.912 1.00 0.00 C ATOM 71 CD2 LEU A 4 -4.420 1.523 0.599 1.00 0.00 C ATOM 72 H LEU A 4 -1.837 -1.931 2.829 1.00 0.00 H ATOM 73 HA LEU A 4 -2.972 -1.916 0.249 1.00 0.00 H ATOM 74 HB2 LEU A 4 -4.088 -1.341 2.405 1.00 0.00 H ATOM 75 HB3 LEU A 4 -3.196 0.160 2.439 1.00 0.00 H ATOM 76 HG LEU A 4 -5.035 -0.468 0.147 1.00 0.00 H ATOM 77 HD11 LEU A 4 -6.564 -0.774 1.829 1.00 0.00 H ATOM 78 HD12 LEU A 4 -6.664 0.971 1.593 1.00 0.00 H ATOM 79 HD13 LEU A 4 -5.734 0.315 2.945 1.00 0.00 H ATOM 80 HD21 LEU A 4 -5.063 2.234 1.098 1.00 0.00 H ATOM 81 HD22 LEU A 4 -4.539 1.617 -0.469 1.00 0.00 H ATOM 82 HD23 LEU A 4 -3.387 1.718 0.866 1.00 0.00 H ATOM 83 N HIS A 5 -0.847 0.523 1.023 1.00 0.00 N ATOM 84 CA HIS A 5 0.067 1.573 0.553 1.00 0.00 C ATOM 85 C HIS A 5 1.142 1.004 -0.364 1.00 0.00 C ATOM 86 O HIS A 5 1.356 1.544 -1.457 1.00 0.00 O ATOM 87 CB HIS A 5 0.689 2.236 1.762 1.00 0.00 C ATOM 88 CG HIS A 5 0.134 3.592 2.036 1.00 0.00 C ATOM 89 ND1 HIS A 5 0.415 4.685 1.240 1.00 0.00 N ATOM 90 CD2 HIS A 5 -0.695 4.036 3.013 1.00 0.00 C ATOM 91 CE1 HIS A 5 -0.213 5.747 1.716 1.00 0.00 C ATOM 92 NE2 HIS A 5 -0.899 5.385 2.792 1.00 0.00 N ATOM 93 H HIS A 5 -0.834 0.310 1.979 1.00 0.00 H ATOM 94 HA HIS A 5 -0.513 2.305 0.007 1.00 0.00 H ATOM 95 HB2 HIS A 5 0.490 1.620 2.618 1.00 0.00 H ATOM 96 HB3 HIS A 5 1.758 2.328 1.620 1.00 0.00 H ATOM 97 HD1 HIS A 5 0.997 4.682 0.449 1.00 0.00 H ATOM 98 HD2 HIS A 5 -1.125 3.436 3.807 1.00 0.00 H ATOM 99 HE1 HIS A 5 -0.154 6.743 1.303 1.00 0.00 H ATOM 100 HE2 HIS A 5 -1.501 5.973 3.305 1.00 0.00 H HETATM 101 C MK8 A 6 2.362 -1.174 -2.107 1.00 0.00 C HETATM 102 N MK8 A 6 1.815 -0.123 0.095 1.00 0.00 N HETATM 103 O MK8 A 6 3.154 -1.457 -3.047 1.00 0.00 O HETATM 104 CA MK8 A 6 2.897 -0.836 -0.669 1.00 0.00 C HETATM 105 CB MK8 A 6 3.245 -2.212 -0.012 1.00 0.00 C HETATM 106 CD MK8 A 6 3.604 -3.752 1.970 1.00 0.00 C HETATM 107 CE MK8 A 6 4.460 -4.045 3.240 1.00 0.00 C HETATM 108 CG MK8 A 6 3.368 -2.298 1.529 1.00 0.00 C HETATM 109 CB1 MK8 A 6 4.173 0.038 -0.730 1.00 0.00 C HETATM 110 HN MK8 A 6 1.565 -0.473 0.971 1.00 0.00 H HETATM 111 HB MK8 A 6 4.179 -2.556 -0.439 1.00 0.00 H HETATM 112 HBA MK8 A 6 2.474 -2.906 -0.298 1.00 0.00 H HETATM 113 HD MK8 A 6 4.071 -4.268 1.141 1.00 0.00 H HETATM 114 HDA MK8 A 6 2.645 -4.202 2.133 1.00 0.00 H HETATM 115 HE MK8 A 6 5.422 -4.480 3.054 1.00 0.00 H HETATM 116 HG MK8 A 6 2.453 -1.940 1.974 1.00 0.00 H HETATM 117 HGA MK8 A 6 4.194 -1.695 1.856 1.00 0.00 H HETATM 118 HB1 MK8 A 6 4.173 0.744 0.088 1.00 0.00 H HETATM 119 HB1A MK8 A 6 4.189 0.584 -1.667 1.00 0.00 H HETATM 120 HB1B MK8 A 6 5.044 -0.596 -0.663 1.00 0.00 H ATOM 121 N LEU A 7 0.985 -1.174 -2.221 1.00 0.00 N ATOM 122 CA LEU A 7 0.247 -1.496 -3.464 1.00 0.00 C ATOM 123 C LEU A 7 0.117 -0.274 -4.374 1.00 0.00 C ATOM 124 O LEU A 7 0.252 -0.410 -5.599 1.00 0.00 O ATOM 125 CB LEU A 7 -1.184 -2.030 -3.115 1.00 0.00 C ATOM 126 CG LEU A 7 -1.835 -3.216 -3.925 1.00 0.00 C ATOM 127 CD1 LEU A 7 -1.991 -2.976 -5.441 1.00 0.00 C ATOM 128 CD2 LEU A 7 -1.131 -4.545 -3.657 1.00 0.00 C ATOM 129 H LEU A 7 0.462 -0.966 -1.412 1.00 0.00 H ATOM 130 HA LEU A 7 0.793 -2.263 -3.993 1.00 0.00 H ATOM 131 HB2 LEU A 7 -1.165 -2.340 -2.085 1.00 0.00 H ATOM 132 HB3 LEU A 7 -1.854 -1.185 -3.183 1.00 0.00 H ATOM 133 HG LEU A 7 -2.836 -3.327 -3.545 1.00 0.00 H ATOM 134 HD11 LEU A 7 -2.109 -1.918 -5.625 1.00 0.00 H ATOM 135 HD12 LEU A 7 -2.859 -3.503 -5.801 1.00 0.00 H ATOM 136 HD13 LEU A 7 -1.110 -3.335 -5.959 1.00 0.00 H ATOM 137 HD21 LEU A 7 -1.682 -5.348 -4.129 1.00 0.00 H ATOM 138 HD22 LEU A 7 -1.096 -4.713 -2.592 1.00 0.00 H ATOM 139 HD23 LEU A 7 -0.126 -4.512 -4.046 1.00 0.00 H ATOM 140 N LEU A 8 -0.169 0.912 -3.740 1.00 0.00 N ATOM 141 CA LEU A 8 -0.365 2.216 -4.439 1.00 0.00 C ATOM 142 C LEU A 8 0.958 2.842 -4.884 1.00 0.00 C ATOM 143 O LEU A 8 1.008 3.464 -5.963 1.00 0.00 O ATOM 144 CB LEU A 8 -1.121 3.219 -3.527 1.00 0.00 C ATOM 145 CG LEU A 8 -2.405 2.708 -2.825 1.00 0.00 C ATOM 146 CD1 LEU A 8 -2.736 3.609 -1.663 1.00 0.00 C ATOM 147 CD2 LEU A 8 -3.610 2.651 -3.758 1.00 0.00 C ATOM 148 H LEU A 8 -0.272 0.894 -2.769 1.00 0.00 H ATOM 149 HA LEU A 8 -0.970 2.033 -5.314 1.00 0.00 H ATOM 150 HB2 LEU A 8 -0.438 3.554 -2.762 1.00 0.00 H ATOM 151 HB3 LEU A 8 -1.393 4.080 -4.123 1.00 0.00 H ATOM 152 HG LEU A 8 -2.230 1.712 -2.439 1.00 0.00 H ATOM 153 HD11 LEU A 8 -3.780 3.505 -1.417 1.00 0.00 H ATOM 154 HD12 LEU A 8 -2.529 4.633 -1.942 1.00 0.00 H ATOM 155 HD13 LEU A 8 -2.132 3.335 -0.809 1.00 0.00 H ATOM 156 HD21 LEU A 8 -3.761 1.636 -4.079 1.00 0.00 H ATOM 157 HD22 LEU A 8 -3.415 3.275 -4.614 1.00 0.00 H ATOM 158 HD23 LEU A 8 -4.492 3.007 -3.240 1.00 0.00 H ATOM 159 N GLN A 9 2.007 2.670 -4.015 1.00 0.00 N ATOM 160 CA GLN A 9 3.369 3.205 -4.230 1.00 0.00 C ATOM 161 C GLN A 9 4.101 2.402 -5.302 1.00 0.00 C ATOM 162 O GLN A 9 4.903 2.979 -6.060 1.00 0.00 O ATOM 163 CB GLN A 9 4.163 3.161 -2.913 1.00 0.00 C ATOM 164 CG GLN A 9 3.543 3.968 -1.774 1.00 0.00 C ATOM 165 CD GLN A 9 3.659 5.470 -1.964 1.00 0.00 C ATOM 166 OE1 GLN A 9 3.157 6.023 -2.941 1.00 0.00 O ATOM 167 NE2 GLN A 9 4.317 6.132 -1.026 1.00 0.00 N ATOM 168 H GLN A 9 1.839 2.176 -3.195 1.00 0.00 H ATOM 169 HA GLN A 9 3.276 4.230 -4.558 1.00 0.00 H ATOM 170 HB2 GLN A 9 4.237 2.134 -2.599 1.00 0.00 H ATOM 171 HB3 GLN A 9 5.159 3.544 -3.097 1.00 0.00 H ATOM 172 HG2 GLN A 9 2.492 3.713 -1.710 1.00 0.00 H ATOM 173 HG3 GLN A 9 4.031 3.699 -0.843 1.00 0.00 H ATOM 174 HE21 GLN A 9 4.685 5.622 -0.271 1.00 0.00 H ATOM 175 HE22 GLN A 9 4.418 7.101 -1.124 1.00 0.00 H ATOM 176 N ASP A 10 3.790 1.056 -5.337 1.00 0.00 N ATOM 177 CA ASP A 10 4.378 0.099 -6.308 1.00 0.00 C ATOM 178 C ASP A 10 3.855 0.391 -7.711 1.00 0.00 C ATOM 179 O ASP A 10 4.632 0.390 -8.691 1.00 0.00 O ATOM 180 CB ASP A 10 4.039 -1.345 -5.922 1.00 0.00 C ATOM 181 CG ASP A 10 4.857 -2.361 -6.692 1.00 0.00 C ATOM 182 OD1 ASP A 10 4.732 -2.408 -7.929 1.00 0.00 O ATOM 183 OD2 ASP A 10 5.630 -3.104 -6.051 1.00 0.00 O ATOM 184 H ASP A 10 3.146 0.718 -4.686 1.00 0.00 H ATOM 185 HA ASP A 10 5.452 0.230 -6.296 1.00 0.00 H ATOM 186 HB2 ASP A 10 4.232 -1.475 -4.877 1.00 0.00 H ATOM 187 HB3 ASP A 10 2.991 -1.532 -6.118 1.00 0.00 H ATOM 188 N SER A 11 2.500 0.635 -7.763 1.00 0.00 N ATOM 189 CA SER A 11 1.766 0.936 -9.002 1.00 0.00 C ATOM 190 C SER A 11 2.253 2.248 -9.634 1.00 0.00 C ATOM 191 O SER A 11 2.044 2.496 -10.823 1.00 0.00 O ATOM 192 CB SER A 11 0.266 1.019 -8.729 1.00 0.00 C ATOM 193 OG SER A 11 -0.264 -0.223 -8.276 1.00 0.00 O ATOM 194 H SER A 11 1.992 0.602 -6.926 1.00 0.00 H ATOM 195 HA SER A 11 1.951 0.125 -9.688 1.00 0.00 H ATOM 196 HB2 SER A 11 0.090 1.774 -7.977 1.00 0.00 H ATOM 197 HB3 SER A 11 -0.240 1.303 -9.633 1.00 0.00 H ATOM 198 HG SER A 11 -0.082 -0.903 -8.929 1.00 0.00 H HETATM 199 N NH2 A 12 2.749 3.155 -8.805 1.00 0.00 N HETATM 200 HN1 NH2 A 12 2.774 2.944 -7.836 1.00 0.00 H HETATM 201 HN2 NH2 A 12 3.081 4.002 -9.190 1.00 0.00 H TER 202 NH2 A 12