HETATM 1 C ACE A 29 4.779 3.243 7.503 1.00 0.00 C HETATM 2 O ACE A 29 4.065 3.591 6.562 1.00 0.00 O HETATM 3 CH3 ACE A 29 5.145 4.207 8.565 1.00 0.00 C ATOM 4 N GLU A 30 5.269 1.982 7.635 1.00 0.00 N ATOM 5 CA GLU A 30 5.022 0.915 6.641 1.00 0.00 C ATOM 6 C GLU A 30 3.551 0.598 6.353 1.00 0.00 C ATOM 7 O GLU A 30 3.238 0.258 5.222 1.00 0.00 O ATOM 8 CB GLU A 30 5.895 -0.382 6.674 1.00 0.00 C ATOM 9 CG GLU A 30 5.832 -1.246 5.349 1.00 0.00 C ATOM 10 CD GLU A 30 6.305 -0.666 4.012 1.00 0.00 C ATOM 11 OE2 GLU A 30 5.962 -1.224 2.979 1.00 0.00 O ATOM 12 H GLU A 30 4.469 2.291 8.167 1.00 0.00 H ATOM 13 HA GLU A 30 5.356 1.403 5.725 1.00 0.00 H ATOM 14 HB2 GLU A 30 6.932 -0.091 6.842 1.00 0.00 H ATOM 15 HB3 GLU A 30 5.553 -1.003 7.502 1.00 0.00 H ATOM 16 HG2 GLU A 30 6.430 -2.140 5.529 1.00 0.00 H ATOM 17 HG3 GLU A 30 4.790 -1.534 5.212 1.00 0.00 H ATOM 18 HE2 GLU A 30 6.300 -0.799 2.187 1.00 0.00 H ATOM 19 N ALA A 31 2.593 0.711 7.313 1.00 0.00 N ATOM 20 CA ALA A 31 1.176 0.486 7.003 1.00 0.00 C ATOM 21 C ALA A 31 0.569 1.398 5.903 1.00 0.00 C ATOM 22 O ALA A 31 -0.347 0.961 5.212 1.00 0.00 O ATOM 23 CB ALA A 31 0.274 0.348 8.233 1.00 0.00 C ATOM 24 H ALA A 31 2.850 0.952 8.259 1.00 0.00 H ATOM 25 HA ALA A 31 1.175 -0.508 6.555 1.00 0.00 H ATOM 26 HB1 ALA A 31 -0.739 0.058 7.954 1.00 0.00 H ATOM 27 HB2 ALA A 31 0.688 -0.413 8.895 1.00 0.00 H ATOM 28 HB3 ALA A 31 0.235 1.303 8.756 1.00 0.00 H ATOM 29 N HIS A 32 1.033 2.677 5.715 1.00 0.00 N ATOM 30 CA HIS A 32 0.909 3.440 4.428 1.00 0.00 C ATOM 31 C HIS A 32 1.818 3.087 3.250 1.00 0.00 C ATOM 32 O HIS A 32 1.263 2.910 2.172 1.00 0.00 O ATOM 33 CB HIS A 32 0.771 4.995 4.585 1.00 0.00 C ATOM 34 CG HIS A 32 -0.269 5.387 5.610 1.00 0.00 C ATOM 35 ND1 HIS A 32 -1.614 5.198 5.400 1.00 0.00 N ATOM 36 CD2 HIS A 32 -0.130 5.887 6.862 1.00 0.00 C ATOM 37 CE1 HIS A 32 -2.275 5.571 6.492 1.00 0.00 C ATOM 38 NE2 HIS A 32 -1.395 5.990 7.391 1.00 0.00 N ATOM 39 H HIS A 32 1.488 3.142 6.487 1.00 0.00 H ATOM 40 HA HIS A 32 -0.075 3.124 4.081 1.00 0.00 H ATOM 41 HB2 HIS A 32 1.735 5.404 4.887 1.00 0.00 H ATOM 42 HB3 HIS A 32 0.493 5.422 3.621 1.00 0.00 H ATOM 43 HD1 HIS A 32 -2.032 4.835 4.555 1.00 0.00 H ATOM 44 HD2 HIS A 32 0.796 6.153 7.350 1.00 0.00 H ATOM 45 HE1 HIS A 32 -3.346 5.538 6.624 1.00 0.00 H ATOM 46 HE2 HIS A 32 -1.618 6.330 8.315 1.00 0.00 H ATOM 47 N LYS A 33 3.173 2.943 3.362 1.00 0.00 N ATOM 48 CA LYS A 33 4.029 2.497 2.190 1.00 0.00 C ATOM 49 C LYS A 33 3.804 1.086 1.693 1.00 0.00 C ATOM 50 O LYS A 33 3.913 0.859 0.483 1.00 0.00 O ATOM 51 CB LYS A 33 5.597 2.742 2.137 1.00 0.00 C ATOM 52 CG LYS A 33 6.247 3.460 3.445 1.00 0.00 C ATOM 53 CD LYS A 33 7.216 2.859 4.647 1.00 0.00 C ATOM 54 CE LYS A 33 7.808 1.344 4.572 1.00 0.00 C ATOM 55 NZ LYS A 33 7.056 0.417 3.787 1.00 0.00 N ATOM 56 H LYS A 33 3.628 3.135 4.243 1.00 0.00 H ATOM 57 HA LYS A 33 3.643 3.134 1.394 1.00 0.00 H ATOM 58 HB2 LYS A 33 6.082 1.774 2.011 1.00 0.00 H ATOM 59 HB3 LYS A 33 5.808 3.369 1.271 1.00 0.00 H ATOM 60 HG2 LYS A 33 6.828 4.283 3.028 1.00 0.00 H ATOM 61 HG3 LYS A 33 5.384 3.857 3.979 1.00 0.00 H ATOM 62 HD2 LYS A 33 8.077 3.524 4.712 1.00 0.00 H ATOM 63 HD3 LYS A 33 6.639 2.919 5.569 1.00 0.00 H ATOM 64 HE2 LYS A 33 8.814 1.395 4.154 1.00 0.00 H ATOM 65 HE3 LYS A 33 7.862 0.952 5.588 1.00 0.00 H ATOM 66 HZ1 LYS A 33 7.498 -0.492 3.799 1.00 0.00 H ATOM 67 HZ2 LYS A 33 6.123 0.337 4.165 1.00 0.00 H ATOM 68 HZ3 LYS A 33 7.006 0.749 2.834 1.00 0.00 H ATOM 69 N ASN A 34 3.522 0.092 2.563 1.00 0.00 N ATOM 70 CA ASN A 34 2.440 -0.842 2.247 1.00 0.00 C ATOM 71 C ASN A 34 0.861 -0.750 2.116 1.00 0.00 C ATOM 72 O ASN A 34 0.582 -1.230 1.010 1.00 0.00 O ATOM 73 CB ASN A 34 2.715 -2.127 3.109 1.00 0.00 C ATOM 74 CG ASN A 34 2.265 -3.483 2.527 1.00 0.00 C ATOM 75 OD1 ASN A 34 3.026 -4.376 2.160 1.00 0.00 O ATOM 76 ND2 ASN A 34 0.926 -3.594 2.472 1.00 0.00 N ATOM 77 H ASN A 34 4.042 -0.017 3.422 1.00 0.00 H ATOM 78 HA ASN A 34 2.717 -1.096 1.223 1.00 0.00 H ATOM 79 HB2 ASN A 34 3.790 -2.184 3.279 1.00 0.00 H ATOM 80 HB3 ASN A 34 2.207 -1.997 4.064 1.00 0.00 H ATOM 81 HD21 ASN A 34 0.327 -2.845 2.785 1.00 0.00 H ATOM 82 HD22 ASN A 34 0.512 -4.442 2.112 1.00 0.00 H ATOM 83 N ARG A 35 -0.253 -0.270 2.906 1.00 0.00 N ATOM 84 CA ARG A 35 -1.622 -0.507 2.335 1.00 0.00 C ATOM 85 C ARG A 35 -1.810 0.083 0.961 1.00 0.00 C ATOM 86 O ARG A 35 -2.523 -0.555 0.193 1.00 0.00 O ATOM 87 CB ARG A 35 -3.030 -0.760 3.057 1.00 0.00 C ATOM 88 CG ARG A 35 -3.889 -1.921 2.239 1.00 0.00 C ATOM 89 CD ARG A 35 -3.192 -3.228 1.530 1.00 0.00 C ATOM 90 NE ARG A 35 -2.861 -4.140 2.688 1.00 0.00 N ATOM 91 CZ ARG A 35 -3.650 -5.127 3.154 1.00 0.00 C ATOM 92 NH1 ARG A 35 -4.881 -5.353 2.688 1.00 0.00 N ATOM 93 NH2 ARG A 35 -3.197 -5.923 4.130 1.00 0.00 N ATOM 94 H ARG A 35 -0.132 0.198 3.792 1.00 0.00 H ATOM 95 HA ARG A 35 -1.428 -1.544 2.059 1.00 0.00 H ATOM 96 HB2 ARG A 35 -2.856 -1.094 4.080 1.00 0.00 H ATOM 97 HB3 ARG A 35 -3.600 0.168 3.069 1.00 0.00 H ATOM 98 HG2 ARG A 35 -4.609 -2.319 2.953 1.00 0.00 H ATOM 99 HG3 ARG A 35 -4.417 -1.397 1.443 1.00 0.00 H ATOM 100 HD2 ARG A 35 -3.885 -3.710 0.839 1.00 0.00 H ATOM 101 HD3 ARG A 35 -2.290 -2.940 0.989 1.00 0.00 H ATOM 102 HE ARG A 35 -1.972 -3.989 3.143 1.00 0.00 H ATOM 103 HH11 ARG A 35 -5.251 -4.768 1.953 1.00 0.00 H ATOM 104 HH12 ARG A 35 -5.449 -6.101 3.058 1.00 0.00 H ATOM 105 HH21 ARG A 35 -2.271 -5.780 4.508 1.00 0.00 H ATOM 106 HH22 ARG A 35 -3.777 -6.667 4.490 1.00 0.00 H ATOM 107 N LYS A 36 -1.107 1.209 0.596 1.00 0.00 N ATOM 108 CA LYS A 36 -1.184 1.624 -0.821 1.00 0.00 C ATOM 109 C LYS A 36 -0.850 0.548 -1.922 1.00 0.00 C ATOM 110 O LYS A 36 -1.639 0.403 -2.873 1.00 0.00 O ATOM 111 CB LYS A 36 -0.070 2.701 -1.119 1.00 0.00 C ATOM 112 CG LYS A 36 1.399 2.427 -0.679 1.00 0.00 C ATOM 113 CD LYS A 36 2.233 3.747 -0.647 1.00 0.00 C ATOM 114 CE LYS A 36 2.143 4.673 -1.899 1.00 0.00 C ATOM 115 NZ LYS A 36 2.989 5.911 -1.763 1.00 0.00 N ATOM 116 H LYS A 36 -0.557 1.739 1.256 1.00 0.00 H ATOM 117 HA LYS A 36 -2.181 2.029 -0.994 1.00 0.00 H ATOM 118 HB2 LYS A 36 -0.054 2.851 -2.199 1.00 0.00 H ATOM 119 HB3 LYS A 36 -0.381 3.623 -0.629 1.00 0.00 H ATOM 120 HG2 LYS A 36 1.396 1.984 0.317 1.00 0.00 H ATOM 121 HG3 LYS A 36 1.858 1.733 -1.384 1.00 0.00 H ATOM 122 HD2 LYS A 36 1.900 4.325 0.214 1.00 0.00 H ATOM 123 HD3 LYS A 36 3.280 3.471 -0.517 1.00 0.00 H ATOM 124 HE2 LYS A 36 2.477 4.114 -2.774 1.00 0.00 H ATOM 125 HE3 LYS A 36 1.105 4.972 -2.041 1.00 0.00 H ATOM 126 HZ1 LYS A 36 2.900 6.478 -2.594 1.00 0.00 H ATOM 127 HZ2 LYS A 36 2.682 6.441 -0.961 1.00 0.00 H ATOM 128 HZ3 LYS A 36 3.956 5.645 -1.641 1.00 0.00 H ATOM 129 N LEU A 37 0.321 -0.164 -1.830 1.00 0.00 N ATOM 130 CA LEU A 37 1.111 -0.296 -3.059 1.00 0.00 C ATOM 131 C LEU A 37 0.700 -1.242 -4.242 1.00 0.00 C ATOM 132 O LEU A 37 0.600 -0.766 -5.373 1.00 0.00 O ATOM 133 CB LEU A 37 2.594 -0.983 -2.591 1.00 0.00 C ATOM 134 CG LEU A 37 2.802 -2.532 -1.995 1.00 0.00 C ATOM 135 CD1 LEU A 37 3.758 -2.468 -0.807 1.00 0.00 C ATOM 136 CD2 LEU A 37 1.510 -3.252 -1.509 1.00 0.00 C ATOM 137 H LEU A 37 0.637 -0.582 -0.967 1.00 0.00 H ATOM 138 HA LEU A 37 1.248 0.710 -3.456 1.00 0.00 H ATOM 139 HB2 LEU A 37 3.230 -0.928 -3.475 1.00 0.00 H ATOM 140 HB3 LEU A 37 2.987 -0.323 -1.819 1.00 0.00 H ATOM 141 HG LEU A 37 2.329 -1.954 -1.202 1.00 0.00 H ATOM 142 HD11 LEU A 37 3.540 -3.029 0.102 1.00 0.00 H ATOM 143 HD12 LEU A 37 4.732 -2.821 -1.147 1.00 0.00 H ATOM 144 HD13 LEU A 37 3.836 -1.425 -0.502 1.00 0.00 H ATOM 145 HD21 LEU A 37 1.458 -3.745 -0.538 1.00 0.00 H ATOM 146 HD22 LEU A 37 0.710 -2.513 -1.499 1.00 0.00 H ATOM 147 HD23 LEU A 37 1.277 -4.030 -2.237 1.00 0.00 H ATOM 148 N MET A 38 0.427 -2.556 -4.073 1.00 0.00 N ATOM 149 CA MET A 38 -0.284 -3.479 -4.932 1.00 0.00 C ATOM 150 C MET A 38 -1.823 -3.408 -4.916 1.00 0.00 C ATOM 151 O MET A 38 -2.468 -3.288 -5.960 1.00 0.00 O ATOM 152 CB MET A 38 0.165 -4.955 -4.531 1.00 0.00 C ATOM 153 CG MET A 38 0.027 -5.999 -5.658 1.00 0.00 C ATOM 154 SD MET A 38 0.605 -7.693 -5.151 1.00 0.00 S ATOM 155 CE MET A 38 2.416 -7.560 -4.790 1.00 0.00 C ATOM 156 H MET A 38 0.772 -2.962 -3.215 1.00 0.00 H ATOM 157 HA MET A 38 0.039 -3.277 -5.954 1.00 0.00 H ATOM 158 HB2 MET A 38 1.211 -4.922 -4.226 1.00 0.00 H ATOM 159 HB3 MET A 38 -0.448 -5.281 -3.691 1.00 0.00 H ATOM 160 HG2 MET A 38 -1.020 -6.061 -5.954 1.00 0.00 H ATOM 161 HG3 MET A 38 0.614 -5.671 -6.516 1.00 0.00 H ATOM 162 HE1 MET A 38 2.845 -8.514 -4.483 1.00 0.00 H ATOM 163 HE2 MET A 38 2.935 -7.222 -5.687 1.00 0.00 H ATOM 164 HE3 MET A 38 2.568 -6.838 -3.988 1.00 0.00 H ATOM 165 N GLU A 39 -2.438 -3.469 -3.715 1.00 0.00 N ATOM 166 CA GLU A 39 -3.839 -3.572 -3.414 1.00 0.00 C ATOM 167 C GLU A 39 -4.585 -2.216 -3.643 1.00 0.00 C ATOM 168 O GLU A 39 -5.651 -2.294 -4.266 1.00 0.00 O ATOM 169 CB GLU A 39 -4.213 -4.492 -2.149 1.00 0.00 C ATOM 170 CG GLU A 39 -3.104 -5.481 -1.607 1.00 0.00 C ATOM 171 CD GLU A 39 -1.714 -4.941 -1.217 1.00 0.00 C ATOM 172 OE1 GLU A 39 -1.509 -3.705 -1.206 1.00 0.00 O ATOM 173 OE2 GLU A 39 -0.830 -5.791 -0.921 1.00 0.00 O ATOM 174 H GLU A 39 -1.830 -3.438 -2.909 1.00 0.00 H ATOM 175 HA GLU A 39 -4.206 -4.178 -4.243 1.00 0.00 H ATOM 176 HB2 GLU A 39 -4.483 -3.826 -1.330 1.00 0.00 H ATOM 177 HB3 GLU A 39 -5.077 -5.095 -2.428 1.00 0.00 H ATOM 178 HG2 GLU A 39 -3.515 -5.962 -0.720 1.00 0.00 H ATOM 179 HG3 GLU A 39 -2.944 -6.233 -2.381 1.00 0.00 H ATOM 180 HE2 GLU A 39 0.015 -5.400 -0.687 1.00 0.00 H ATOM 181 N ILE A 40 -4.135 -0.952 -3.223 1.00 0.00 N ATOM 182 CA ILE A 40 -5.001 0.238 -3.484 1.00 0.00 C ATOM 183 C ILE A 40 -4.970 0.710 -4.927 1.00 0.00 C ATOM 184 O ILE A 40 -5.992 0.803 -5.608 1.00 0.00 O ATOM 185 CB ILE A 40 -4.854 1.459 -2.536 1.00 0.00 C ATOM 186 CG1 ILE A 40 -4.634 1.060 -1.054 1.00 0.00 C ATOM 187 CG2 ILE A 40 -6.255 2.093 -2.570 1.00 0.00 C ATOM 188 CD1 ILE A 40 -4.707 2.129 0.070 1.00 0.00 C ATOM 189 H ILE A 40 -3.247 -0.836 -2.755 1.00 0.00 H ATOM 190 HA ILE A 40 -6.011 -0.134 -3.315 1.00 0.00 H ATOM 191 HB ILE A 40 -4.070 2.134 -2.879 1.00 0.00 H ATOM 192 HG12 ILE A 40 -5.386 0.307 -0.818 1.00 0.00 H ATOM 193 HG13 ILE A 40 -3.641 0.612 -0.995 1.00 0.00 H ATOM 194 HG21 ILE A 40 -6.248 2.971 -1.925 1.00 0.00 H ATOM 195 HG22 ILE A 40 -6.500 2.385 -3.591 1.00 0.00 H ATOM 196 HG23 ILE A 40 -6.991 1.374 -2.211 1.00 0.00 H ATOM 197 HD11 ILE A 40 -4.533 1.701 1.057 1.00 0.00 H ATOM 198 HD12 ILE A 40 -3.950 2.891 -0.116 1.00 0.00 H ATOM 199 HD13 ILE A 40 -5.695 2.587 0.059 1.00 0.00 H ATOM 200 N ILE A 41 -3.753 0.864 -5.462 1.00 0.00 N ATOM 201 CA ILE A 41 -3.375 0.712 -6.892 1.00 0.00 C ATOM 202 C ILE A 41 -3.783 -0.765 -7.364 1.00 0.00 C ATOM 203 O ILE A 41 -3.350 -1.239 -8.417 1.00 0.00 O ATOM 204 CB ILE A 41 -1.845 1.036 -7.178 1.00 0.00 C ATOM 205 CG1 ILE A 41 -1.225 1.974 -6.026 1.00 0.00 C ATOM 206 CG2 ILE A 41 -1.734 1.707 -8.609 1.00 0.00 C ATOM 207 CD1 ILE A 41 0.262 2.351 -6.152 1.00 0.00 C ATOM 208 H ILE A 41 -3.004 1.109 -4.831 1.00 0.00 H ATOM 209 HA ILE A 41 -3.966 1.425 -7.466 1.00 0.00 H ATOM 210 HB ILE A 41 -1.285 0.100 -7.189 1.00 0.00 H ATOM 211 HG12 ILE A 41 -1.797 2.901 -6.013 1.00 0.00 H ATOM 212 HG13 ILE A 41 -1.351 1.455 -5.076 1.00 0.00 H ATOM 213 HG21 ILE A 41 -0.686 1.909 -8.830 1.00 0.00 H ATOM 214 HG22 ILE A 41 -2.141 1.030 -9.361 1.00 0.00 H ATOM 215 HG23 ILE A 41 -2.295 2.641 -8.618 1.00 0.00 H ATOM 216 HD11 ILE A 41 0.578 2.986 -5.325 1.00 0.00 H ATOM 217 HD12 ILE A 41 0.864 1.442 -6.149 1.00 0.00 H ATOM 218 HD13 ILE A 41 0.418 2.886 -7.089 1.00 0.00 H HETATM 219 N NH2 A 42 -4.680 -1.465 -6.609 1.00 0.00 N TER 220 NH2 A 42