HETATM 1 C ACE A 29 5.334 2.887 8.899 1.00 0.00 C HETATM 2 O ACE A 29 5.839 3.322 9.928 1.00 0.00 O HETATM 3 CH3 ACE A 29 4.490 3.785 8.055 1.00 0.00 C ATOM 4 N GLU A 30 5.568 1.600 8.549 1.00 0.00 N ATOM 5 CA GLU A 30 5.160 0.763 7.426 1.00 0.00 C ATOM 6 C GLU A 30 3.783 0.817 6.771 1.00 0.00 C ATOM 7 O GLU A 30 3.751 0.645 5.550 1.00 0.00 O ATOM 8 CB GLU A 30 5.535 -0.733 7.679 1.00 0.00 C ATOM 9 CG GLU A 30 5.706 -1.667 6.427 1.00 0.00 C ATOM 10 CD GLU A 30 6.925 -1.298 5.626 1.00 0.00 C ATOM 11 OE2 GLU A 30 7.939 -1.992 5.661 1.00 0.00 O ATOM 12 H GLU A 30 4.824 2.179 8.910 1.00 0.00 H ATOM 13 HA GLU A 30 5.827 1.104 6.634 1.00 0.00 H ATOM 14 HB2 GLU A 30 6.479 -0.744 8.224 1.00 0.00 H ATOM 15 HB3 GLU A 30 4.751 -1.164 8.301 1.00 0.00 H ATOM 16 HG2 GLU A 30 5.802 -2.700 6.764 1.00 0.00 H ATOM 17 HG3 GLU A 30 4.824 -1.577 5.793 1.00 0.00 H ATOM 18 HE2 GLU A 30 8.663 -1.674 5.116 1.00 0.00 H ATOM 19 N ALA A 31 2.644 1.069 7.482 1.00 0.00 N ATOM 20 CA ALA A 31 1.276 0.789 6.995 1.00 0.00 C ATOM 21 C ALA A 31 1.008 1.447 5.597 1.00 0.00 C ATOM 22 O ALA A 31 0.525 0.773 4.712 1.00 0.00 O ATOM 23 CB ALA A 31 0.232 1.357 7.971 1.00 0.00 C ATOM 24 H ALA A 31 2.733 1.472 8.403 1.00 0.00 H ATOM 25 HA ALA A 31 1.153 -0.291 6.915 1.00 0.00 H ATOM 26 HB1 ALA A 31 -0.773 1.127 7.618 1.00 0.00 H ATOM 27 HB2 ALA A 31 0.378 0.912 8.955 1.00 0.00 H ATOM 28 HB3 ALA A 31 0.352 2.438 8.039 1.00 0.00 H ATOM 29 N HIS A 32 1.345 2.747 5.326 1.00 0.00 N ATOM 30 CA HIS A 32 1.277 3.507 4.029 1.00 0.00 C ATOM 31 C HIS A 32 2.279 3.227 2.927 1.00 0.00 C ATOM 32 O HIS A 32 1.947 3.469 1.793 1.00 0.00 O ATOM 33 CB HIS A 32 1.154 5.052 4.255 1.00 0.00 C ATOM 34 CG HIS A 32 -0.005 5.467 5.142 1.00 0.00 C ATOM 35 ND1 HIS A 32 0.163 5.840 6.455 1.00 0.00 N ATOM 36 CD2 HIS A 32 -1.327 5.592 4.865 1.00 0.00 C ATOM 37 CE1 HIS A 32 -1.022 6.177 6.961 1.00 0.00 C ATOM 38 NE2 HIS A 32 -1.939 6.031 6.015 1.00 0.00 N ATOM 39 H HIS A 32 1.691 3.279 6.111 1.00 0.00 H ATOM 40 HA HIS A 32 0.322 3.193 3.606 1.00 0.00 H ATOM 41 HB2 HIS A 32 2.079 5.407 4.710 1.00 0.00 H ATOM 42 HB3 HIS A 32 1.032 5.532 3.284 1.00 0.00 H ATOM 43 HD1 HIS A 32 1.041 5.855 6.954 1.00 0.00 H ATOM 44 HD2 HIS A 32 -1.807 5.385 3.920 1.00 0.00 H ATOM 45 HE1 HIS A 32 -1.204 6.512 7.971 1.00 0.00 H ATOM 46 HE2 HIS A 32 -2.926 6.212 6.122 1.00 0.00 H ATOM 47 N LYS A 33 3.525 2.761 3.100 1.00 0.00 N ATOM 48 CA LYS A 33 4.326 2.264 1.933 1.00 0.00 C ATOM 49 C LYS A 33 3.559 1.042 1.400 1.00 0.00 C ATOM 50 O LYS A 33 3.206 0.973 0.226 1.00 0.00 O ATOM 51 CB LYS A 33 5.867 1.917 2.170 1.00 0.00 C ATOM 52 CG LYS A 33 6.539 2.699 3.464 1.00 0.00 C ATOM 53 CD LYS A 33 7.630 2.194 4.587 1.00 0.00 C ATOM 54 CE LYS A 33 7.944 0.639 4.481 1.00 0.00 C ATOM 55 NZ LYS A 33 6.830 -0.163 4.906 1.00 0.00 N ATOM 56 H LYS A 33 3.940 2.739 4.020 1.00 0.00 H ATOM 57 HA LYS A 33 4.302 3.047 1.175 1.00 0.00 H ATOM 58 HB2 LYS A 33 5.955 0.843 2.334 1.00 0.00 H ATOM 59 HB3 LYS A 33 6.423 2.194 1.274 1.00 0.00 H ATOM 60 HG2 LYS A 33 7.009 3.577 3.022 1.00 0.00 H ATOM 61 HG3 LYS A 33 5.679 3.007 4.058 1.00 0.00 H ATOM 62 HD2 LYS A 33 8.559 2.747 4.445 1.00 0.00 H ATOM 63 HD3 LYS A 33 7.231 2.402 5.579 1.00 0.00 H ATOM 64 HE2 LYS A 33 8.180 0.395 3.445 1.00 0.00 H ATOM 65 HE3 LYS A 33 8.805 0.408 5.108 1.00 0.00 H ATOM 66 HZ1 LYS A 33 7.071 -1.141 4.823 1.00 0.00 H ATOM 67 HZ2 LYS A 33 6.610 0.049 5.868 1.00 0.00 H ATOM 68 HZ3 LYS A 33 6.029 0.037 4.324 1.00 0.00 H ATOM 69 N ASN A 34 3.215 0.106 2.324 1.00 0.00 N ATOM 70 CA ASN A 34 2.083 -0.860 2.196 1.00 0.00 C ATOM 71 C ASN A 34 0.489 -0.859 1.986 1.00 0.00 C ATOM 72 O ASN A 34 0.251 -1.590 1.015 1.00 0.00 O ATOM 73 CB ASN A 34 2.335 -1.734 3.519 1.00 0.00 C ATOM 74 CG ASN A 34 1.228 -2.649 4.091 1.00 0.00 C ATOM 75 OD1 ASN A 34 1.301 -3.876 4.113 1.00 0.00 O ATOM 76 ND2 ASN A 34 0.149 -1.974 4.572 1.00 0.00 N ATOM 77 H ASN A 34 3.765 0.053 3.169 1.00 0.00 H ATOM 78 HA ASN A 34 2.408 -1.440 1.332 1.00 0.00 H ATOM 79 HB2 ASN A 34 3.192 -2.376 3.310 1.00 0.00 H ATOM 80 HB3 ASN A 34 2.597 -1.033 4.311 1.00 0.00 H ATOM 81 HD21 ASN A 34 0.118 -0.965 4.540 1.00 0.00 H ATOM 82 HD22 ASN A 34 -0.627 -2.487 4.965 1.00 0.00 H ATOM 83 N ARG A 35 -0.657 -0.219 2.633 1.00 0.00 N ATOM 84 CA ARG A 35 -2.019 -0.548 2.036 1.00 0.00 C ATOM 85 C ARG A 35 -2.128 0.099 0.670 1.00 0.00 C ATOM 86 O ARG A 35 -2.751 -0.478 -0.214 1.00 0.00 O ATOM 87 CB ARG A 35 -3.453 -0.684 2.841 1.00 0.00 C ATOM 88 CG ARG A 35 -4.500 -1.509 1.869 1.00 0.00 C ATOM 89 CD ARG A 35 -4.045 -2.861 1.075 1.00 0.00 C ATOM 90 NE ARG A 35 -3.592 -3.923 2.031 1.00 0.00 N ATOM 91 CZ ARG A 35 -4.356 -4.943 2.432 1.00 0.00 C ATOM 92 NH1 ARG A 35 -5.655 -4.857 2.703 1.00 0.00 N ATOM 93 NH2 ARG A 35 -3.713 -6.099 2.528 1.00 0.00 N ATOM 94 H ARG A 35 -0.567 0.401 3.424 1.00 0.00 H ATOM 95 HA ARG A 35 -1.850 -1.596 1.784 1.00 0.00 H ATOM 96 HB2 ARG A 35 -3.304 -1.229 3.773 1.00 0.00 H ATOM 97 HB3 ARG A 35 -3.851 0.307 3.058 1.00 0.00 H ATOM 98 HG2 ARG A 35 -5.344 -1.792 2.497 1.00 0.00 H ATOM 99 HG3 ARG A 35 -4.833 -0.804 1.107 1.00 0.00 H ATOM 100 HD2 ARG A 35 -4.889 -3.238 0.497 1.00 0.00 H ATOM 101 HD3 ARG A 35 -3.227 -2.619 0.396 1.00 0.00 H ATOM 102 HE ARG A 35 -2.649 -3.853 2.387 1.00 0.00 H ATOM 103 HH11 ARG A 35 -6.127 -3.969 2.614 1.00 0.00 H ATOM 104 HH12 ARG A 35 -6.176 -5.671 2.996 1.00 0.00 H ATOM 105 HH21 ARG A 35 -2.728 -6.158 2.312 1.00 0.00 H ATOM 106 HH22 ARG A 35 -4.230 -6.916 2.821 1.00 0.00 H ATOM 107 N LYS A 36 -1.428 1.234 0.410 1.00 0.00 N ATOM 108 CA LYS A 36 -1.264 1.658 -0.986 1.00 0.00 C ATOM 109 C LYS A 36 -0.740 0.676 -2.072 1.00 0.00 C ATOM 110 O LYS A 36 -1.443 0.538 -3.081 1.00 0.00 O ATOM 111 CB LYS A 36 -0.042 2.655 -0.880 1.00 0.00 C ATOM 112 CG LYS A 36 -0.260 3.693 0.259 1.00 0.00 C ATOM 113 CD LYS A 36 0.580 4.985 0.058 1.00 0.00 C ATOM 114 CE LYS A 36 0.099 5.927 -1.073 1.00 0.00 C ATOM 115 NZ LYS A 36 0.971 7.143 -1.180 1.00 0.00 N ATOM 116 H LYS A 36 -1.023 1.785 1.153 1.00 0.00 H ATOM 117 HA LYS A 36 -2.183 2.132 -1.329 1.00 0.00 H ATOM 118 HB2 LYS A 36 0.865 2.085 -0.674 1.00 0.00 H ATOM 119 HB3 LYS A 36 0.069 3.183 -1.827 1.00 0.00 H ATOM 120 HG2 LYS A 36 -1.315 3.963 0.287 1.00 0.00 H ATOM 121 HG3 LYS A 36 0.024 3.236 1.207 1.00 0.00 H ATOM 122 HD2 LYS A 36 0.562 5.546 0.992 1.00 0.00 H ATOM 123 HD3 LYS A 36 1.605 4.687 -0.167 1.00 0.00 H ATOM 124 HE2 LYS A 36 0.123 5.387 -2.020 1.00 0.00 H ATOM 125 HE3 LYS A 36 -0.924 6.240 -0.865 1.00 0.00 H ATOM 126 HZ1 LYS A 36 0.633 7.736 -1.925 1.00 0.00 H ATOM 127 HZ2 LYS A 36 0.948 7.651 -0.308 1.00 0.00 H ATOM 128 HZ3 LYS A 36 1.920 6.860 -1.380 1.00 0.00 H ATOM 129 N LEU A 37 0.408 -0.045 -1.909 1.00 0.00 N ATOM 130 CA LEU A 37 1.222 -0.124 -3.169 1.00 0.00 C ATOM 131 C LEU A 37 0.844 -0.930 -4.472 1.00 0.00 C ATOM 132 O LEU A 37 0.781 -0.342 -5.548 1.00 0.00 O ATOM 133 CB LEU A 37 2.535 -1.102 -2.819 1.00 0.00 C ATOM 134 CG LEU A 37 2.400 -2.544 -2.015 1.00 0.00 C ATOM 135 CD1 LEU A 37 3.116 -2.214 -0.729 1.00 0.00 C ATOM 136 CD2 LEU A 37 0.994 -3.177 -1.699 1.00 0.00 C ATOM 137 H LEU A 37 0.697 -0.485 -1.047 1.00 0.00 H ATOM 138 HA LEU A 37 1.499 0.896 -3.434 1.00 0.00 H ATOM 139 HB2 LEU A 37 2.999 -1.336 -3.778 1.00 0.00 H ATOM 140 HB3 LEU A 37 3.215 -0.491 -2.226 1.00 0.00 H ATOM 141 HG LEU A 37 1.763 -1.841 -1.480 1.00 0.00 H ATOM 142 HD11 LEU A 37 2.702 -2.606 0.200 1.00 0.00 H ATOM 143 HD12 LEU A 37 4.134 -2.597 -0.802 1.00 0.00 H ATOM 144 HD13 LEU A 37 3.142 -1.130 -0.626 1.00 0.00 H ATOM 145 HD21 LEU A 37 0.696 -3.476 -0.694 1.00 0.00 H ATOM 146 HD22 LEU A 37 0.238 -2.458 -2.014 1.00 0.00 H ATOM 147 HD23 LEU A 37 0.906 -4.084 -2.298 1.00 0.00 H ATOM 148 N MET A 38 0.548 -2.246 -4.459 1.00 0.00 N ATOM 149 CA MET A 38 -0.382 -3.066 -5.207 1.00 0.00 C ATOM 150 C MET A 38 -1.807 -2.956 -4.698 1.00 0.00 C ATOM 151 O MET A 38 -2.770 -2.760 -5.443 1.00 0.00 O ATOM 152 CB MET A 38 0.121 -4.553 -5.219 1.00 0.00 C ATOM 153 CG MET A 38 -0.696 -5.613 -6.011 1.00 0.00 C ATOM 154 SD MET A 38 -0.383 -7.340 -5.384 1.00 0.00 S ATOM 155 CE MET A 38 -1.047 -7.423 -3.658 1.00 0.00 C ATOM 156 H MET A 38 1.088 -2.774 -3.788 1.00 0.00 H ATOM 157 HA MET A 38 -0.378 -2.705 -6.236 1.00 0.00 H ATOM 158 HB2 MET A 38 1.129 -4.548 -5.636 1.00 0.00 H ATOM 159 HB3 MET A 38 0.159 -4.888 -4.183 1.00 0.00 H ATOM 160 HG2 MET A 38 -1.758 -5.389 -5.917 1.00 0.00 H ATOM 161 HG3 MET A 38 -0.420 -5.563 -7.065 1.00 0.00 H ATOM 162 HE1 MET A 38 -0.905 -8.407 -3.209 1.00 0.00 H ATOM 163 HE2 MET A 38 -0.532 -6.686 -3.042 1.00 0.00 H ATOM 164 HE3 MET A 38 -2.114 -7.202 -3.675 1.00 0.00 H ATOM 165 N GLU A 39 -1.917 -3.121 -3.353 1.00 0.00 N ATOM 166 CA GLU A 39 -3.123 -3.474 -2.619 1.00 0.00 C ATOM 167 C GLU A 39 -4.213 -2.345 -2.616 1.00 0.00 C ATOM 168 O GLU A 39 -5.381 -2.737 -2.628 1.00 0.00 O ATOM 169 CB GLU A 39 -3.065 -4.674 -1.548 1.00 0.00 C ATOM 170 CG GLU A 39 -1.837 -4.608 -0.631 1.00 0.00 C ATOM 171 CD GLU A 39 -1.731 -5.747 0.368 1.00 0.00 C ATOM 172 OE1 GLU A 39 -2.018 -6.929 0.075 1.00 0.00 O ATOM 173 OE2 GLU A 39 -1.376 -5.437 1.539 1.00 0.00 O ATOM 174 H GLU A 39 -1.082 -2.986 -2.801 1.00 0.00 H ATOM 175 HA GLU A 39 -3.567 -4.066 -3.420 1.00 0.00 H ATOM 176 HB2 GLU A 39 -3.961 -4.631 -0.930 1.00 0.00 H ATOM 177 HB3 GLU A 39 -3.042 -5.621 -2.089 1.00 0.00 H ATOM 178 HG2 GLU A 39 -0.943 -4.619 -1.256 1.00 0.00 H ATOM 179 HG3 GLU A 39 -1.875 -3.671 -0.076 1.00 0.00 H ATOM 180 HE2 GLU A 39 -1.331 -6.183 2.142 1.00 0.00 H ATOM 181 N ILE A 40 -3.952 -0.962 -2.613 1.00 0.00 N ATOM 182 CA ILE A 40 -4.938 0.015 -3.134 1.00 0.00 C ATOM 183 C ILE A 40 -4.934 0.056 -4.688 1.00 0.00 C ATOM 184 O ILE A 40 -5.993 -0.039 -5.316 1.00 0.00 O ATOM 185 CB ILE A 40 -4.736 1.453 -2.540 1.00 0.00 C ATOM 186 CG1 ILE A 40 -5.033 1.516 -0.970 1.00 0.00 C ATOM 187 CG2 ILE A 40 -5.858 2.342 -3.159 1.00 0.00 C ATOM 188 CD1 ILE A 40 -4.721 2.856 -0.260 1.00 0.00 C ATOM 189 H ILE A 40 -3.075 -0.616 -2.251 1.00 0.00 H ATOM 190 HA ILE A 40 -5.921 -0.332 -2.817 1.00 0.00 H ATOM 191 HB ILE A 40 -3.736 1.824 -2.766 1.00 0.00 H ATOM 192 HG12 ILE A 40 -6.092 1.303 -0.824 1.00 0.00 H ATOM 193 HG13 ILE A 40 -4.437 0.740 -0.489 1.00 0.00 H ATOM 194 HG21 ILE A 40 -5.763 3.357 -2.775 1.00 0.00 H ATOM 195 HG22 ILE A 40 -5.757 2.351 -4.245 1.00 0.00 H ATOM 196 HG23 ILE A 40 -6.833 1.938 -2.888 1.00 0.00 H ATOM 197 HD11 ILE A 40 -4.957 2.799 0.802 1.00 0.00 H ATOM 198 HD12 ILE A 40 -3.661 3.085 -0.376 1.00 0.00 H ATOM 199 HD13 ILE A 40 -5.315 3.649 -0.713 1.00 0.00 H ATOM 200 N ILE A 41 -3.726 0.208 -5.315 1.00 0.00 N ATOM 201 CA ILE A 41 -3.581 0.713 -6.746 1.00 0.00 C ATOM 202 C ILE A 41 -4.191 -0.272 -7.823 1.00 0.00 C ATOM 203 O ILE A 41 -4.415 0.070 -8.989 1.00 0.00 O ATOM 204 CB ILE A 41 -2.161 1.294 -7.120 1.00 0.00 C ATOM 205 CG1 ILE A 41 -1.716 2.363 -6.048 1.00 0.00 C ATOM 206 CG2 ILE A 41 -2.102 1.951 -8.555 1.00 0.00 C ATOM 207 CD1 ILE A 41 -0.235 2.796 -6.040 1.00 0.00 C ATOM 208 H ILE A 41 -2.881 -0.025 -4.812 1.00 0.00 H ATOM 209 HA ILE A 41 -4.235 1.583 -6.777 1.00 0.00 H ATOM 210 HB ILE A 41 -1.451 0.467 -7.102 1.00 0.00 H ATOM 211 HG12 ILE A 41 -2.315 3.258 -6.212 1.00 0.00 H ATOM 212 HG13 ILE A 41 -1.939 1.950 -5.064 1.00 0.00 H ATOM 213 HG21 ILE A 41 -1.097 2.314 -8.770 1.00 0.00 H ATOM 214 HG22 ILE A 41 -2.379 1.207 -9.303 1.00 0.00 H ATOM 215 HG23 ILE A 41 -2.800 2.786 -8.598 1.00 0.00 H ATOM 216 HD11 ILE A 41 -0.041 3.535 -5.263 1.00 0.00 H ATOM 217 HD12 ILE A 41 0.392 1.922 -5.859 1.00 0.00 H ATOM 218 HD13 ILE A 41 0.017 3.229 -7.008 1.00 0.00 H HETATM 219 N NH2 A 42 -4.569 -1.503 -7.395 1.00 0.00 N TER 220 NH2 A 42