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test_lig_XMLObjects_0.pdb
5982 lines (5980 loc) · 490 KB
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test_lig_XMLObjects_0.pdb
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HEADER 07-OCT-19 XXXX
EXPDTA THEORETICAL MODEL
REMARK 220
REMARK 220 EXPERIMENTAL DETAILS
REMARK 220 EXPERIMENT TYPE : THEORETICAL MODELLING
REMARK 220 DATE OF DATA COLLECTION : 07-OCT-19
REMARK 220
REMARK 220 REMARK: MODEL GENERATED BY ROSETTA
REMARK 220 VERSION 2019.39+release.93456a5
HETNAM TPA X 1 TPA
ATOM 1 N VAL E 15 -6.512 -12.177 -13.595 1.00 64.39 N
ATOM 2 CA VAL E 15 -5.276 -11.431 -13.476 1.00 47.83 C
ATOM 3 C VAL E 15 -4.815 -10.815 -14.785 1.00 35.56 C
ATOM 4 O VAL E 15 -4.806 -9.592 -14.904 1.00 99.02 O
ATOM 5 CB VAL E 15 -4.193 -12.092 -12.629 1.00100.00 C
ATOM 6 CG1 VAL E 15 -2.823 -11.529 -12.987 1.00 50.97 C
ATOM 7 CG2 VAL E 15 -4.494 -11.830 -11.149 1.00 35.72 C
ATOM 8 1H VAL E 15 -6.761 -12.556 -12.703 1.00 0.00 H
ATOM 9 2H VAL E 15 -7.240 -11.569 -13.913 1.00 0.00 H
ATOM 10 3H VAL E 15 -6.390 -12.922 -14.251 1.00 0.00 H
ATOM 11 HA VAL E 15 -5.494 -10.474 -13.000 1.00 0.00 H
ATOM 12 HB VAL E 15 -4.194 -13.164 -12.826 1.00 0.00 H
ATOM 13 1HG1 VAL E 15 -2.060 -12.011 -12.375 1.00 0.00 H
ATOM 14 2HG1 VAL E 15 -2.615 -11.719 -14.040 1.00 0.00 H
ATOM 15 3HG1 VAL E 15 -2.811 -10.455 -12.802 1.00 0.00 H
ATOM 16 1HG2 VAL E 15 -3.727 -12.298 -10.533 1.00 0.00 H
ATOM 17 2HG2 VAL E 15 -4.502 -10.756 -10.964 1.00 0.00 H
ATOM 18 3HG2 VAL E 15 -5.468 -12.249 -10.896 1.00 0.00 H
ATOM 19 N LYS E 16 -4.475 -11.641 -15.778 1.00 35.94 N
ATOM 20 CA LYS E 16 -4.060 -11.108 -17.074 1.00 55.13 C
ATOM 21 C LYS E 16 -5.100 -10.105 -17.531 1.00 59.23 C
ATOM 22 O LYS E 16 -4.877 -9.036 -18.103 1.00 35.80 O
ATOM 23 CB LYS E 16 -3.916 -12.209 -18.110 1.00 47.57 C
ATOM 24 CG LYS E 16 -2.850 -11.886 -19.158 1.00100.00 C
ATOM 25 CD LYS E 16 -1.491 -12.525 -18.888 1.00 94.01 C
ATOM 26 CE LYS E 16 -0.665 -11.794 -17.836 1.00100.00 C
ATOM 27 NZ LYS E 16 -0.505 -12.557 -16.586 1.00 89.11 N
ATOM 28 H LYS E 16 -4.501 -12.642 -15.643 1.00 0.00 H
ATOM 29 HA LYS E 16 -3.089 -10.625 -16.955 1.00 0.00 H
ATOM 30 1HB LYS E 16 -3.653 -13.144 -17.614 1.00 0.00 H
ATOM 31 2HB LYS E 16 -4.871 -12.363 -18.613 1.00 0.00 H
ATOM 32 1HG LYS E 16 -3.185 -12.231 -20.137 1.00 0.00 H
ATOM 33 2HG LYS E 16 -2.701 -10.808 -19.205 1.00 0.00 H
ATOM 34 1HD LYS E 16 -1.633 -13.551 -18.545 1.00 0.00 H
ATOM 35 2HD LYS E 16 -0.909 -12.546 -19.809 1.00 0.00 H
ATOM 36 1HE LYS E 16 0.327 -11.584 -18.234 1.00 0.00 H
ATOM 37 2HE LYS E 16 -1.143 -10.845 -17.593 1.00 0.00 H
ATOM 38 1HZ LYS E 16 0.049 -12.021 -15.932 1.00 0.00 H
ATOM 39 2HZ LYS E 16 -1.414 -12.742 -16.185 1.00 0.00 H
ATOM 40 3HZ LYS E 16 -0.040 -13.432 -16.782 1.00 0.00 H
ATOM 41 N GLU E 17 -6.278 -10.506 -17.222 1.00 46.28 N
ATOM 42 CA GLU E 17 -7.452 -9.768 -17.502 1.00 73.06 C
ATOM 43 C GLU E 17 -7.322 -8.347 -16.938 1.00 46.61 C
ATOM 44 O GLU E 17 -7.332 -7.346 -17.671 1.00 32.00 O
ATOM 45 CB GLU E 17 -8.575 -10.616 -16.862 1.00100.00 C
ATOM 46 CG GLU E 17 -8.356 -12.141 -17.142 1.00100.00 C
ATOM 47 CD GLU E 17 -7.798 -13.009 -16.015 1.00 91.73 C
ATOM 48 OE1 GLU E 17 -8.235 -12.995 -14.882 1.00 52.28 O
ATOM 49 OE2 GLU E 17 -6.824 -13.826 -16.389 1.00 38.71 O
ATOM 50 H GLU E 17 -6.357 -11.398 -16.754 1.00 0.00 H
ATOM 51 HA GLU E 17 -7.565 -9.695 -18.584 1.00 0.00 H
ATOM 52 1HB GLU E 17 -8.596 -10.440 -15.786 1.00 0.00 H
ATOM 53 2HB GLU E 17 -9.540 -10.305 -17.263 1.00 0.00 H
ATOM 54 1HG GLU E 17 -9.309 -12.589 -17.423 1.00 0.00 H
ATOM 55 2HG GLU E 17 -7.672 -12.251 -17.983 1.00 0.00 H
ATOM 56 N PHE E 18 -7.181 -8.270 -15.609 1.00100.00 N
ATOM 57 CA PHE E 18 -7.050 -7.008 -14.884 1.00 25.33 C
ATOM 58 C PHE E 18 -5.978 -6.082 -15.467 1.00 18.77 C
ATOM 59 O PHE E 18 -6.204 -4.945 -15.911 1.00 42.08 O
ATOM 60 CB PHE E 18 -6.759 -7.267 -13.392 1.00 45.47 C
ATOM 61 CG PHE E 18 -6.523 -5.962 -12.692 1.00 57.92 C
ATOM 62 CD1 PHE E 18 -7.536 -5.003 -12.655 1.00 87.67 C
ATOM 63 CD2 PHE E 18 -5.291 -5.668 -12.107 1.00 43.65 C
ATOM 64 CE1 PHE E 18 -7.343 -3.774 -12.030 1.00 56.21 C
ATOM 65 CE2 PHE E 18 -5.088 -4.445 -11.469 1.00 13.42 C
ATOM 66 CZ PHE E 18 -6.110 -3.497 -11.436 1.00 99.47 C
ATOM 67 H PHE E 18 -7.166 -9.138 -15.093 1.00 0.00 H
ATOM 68 HA PHE E 18 -7.991 -6.463 -14.965 1.00 0.00 H
ATOM 69 1HB PHE E 18 -7.602 -7.791 -12.943 1.00 0.00 H
ATOM 70 2HB PHE E 18 -5.886 -7.911 -13.298 1.00 0.00 H
ATOM 71 HD1 PHE E 18 -8.495 -5.223 -13.124 1.00 0.00 H
ATOM 72 HD2 PHE E 18 -4.491 -6.409 -12.133 1.00 0.00 H
ATOM 73 HE1 PHE E 18 -8.150 -3.042 -12.008 1.00 0.00 H
ATOM 74 HE2 PHE E 18 -4.130 -4.229 -10.996 1.00 0.00 H
ATOM 75 HZ PHE E 18 -5.943 -2.539 -10.946 1.00 0.00 H
ATOM 76 N LEU E 19 -4.789 -6.615 -15.444 1.00 25.01 N
ATOM 77 CA LEU E 19 -3.634 -5.937 -15.936 1.00 57.90 C
ATOM 78 C LEU E 19 -3.888 -5.316 -17.314 1.00 36.17 C
ATOM 79 O LEU E 19 -3.441 -4.191 -17.624 1.00 22.80 O
ATOM 80 CB LEU E 19 -2.459 -6.934 -15.920 1.00 26.96 C
ATOM 81 CG LEU E 19 -1.499 -6.777 -14.726 1.00100.00 C
ATOM 82 CD1 LEU E 19 -2.165 -6.192 -13.498 1.00 21.18 C
ATOM 83 CD2 LEU E 19 -0.942 -8.123 -14.318 1.00 23.73 C
ATOM 84 H LEU E 19 -4.688 -7.544 -15.062 1.00 0.00 H
ATOM 85 HA LEU E 19 -3.418 -5.098 -15.275 1.00 0.00 H
ATOM 86 1HB LEU E 19 -2.862 -7.945 -15.903 1.00 0.00 H
ATOM 87 2HB LEU E 19 -1.885 -6.809 -16.838 1.00 0.00 H
ATOM 88 HG LEU E 19 -0.674 -6.121 -15.006 1.00 0.00 H
ATOM 89 1HD1 LEU E 19 -1.434 -6.107 -12.693 1.00 0.00 H
ATOM 90 2HD1 LEU E 19 -2.560 -5.204 -13.734 1.00 0.00 H
ATOM 91 3HD1 LEU E 19 -2.979 -6.843 -13.181 1.00 0.00 H
ATOM 92 1HD2 LEU E 19 -0.264 -7.996 -13.473 1.00 0.00 H
ATOM 93 2HD2 LEU E 19 -1.760 -8.783 -14.030 1.00 0.00 H
ATOM 94 3HD2 LEU E 19 -0.399 -8.561 -15.156 1.00 0.00 H
ATOM 95 N ALA E 20 -4.624 -6.063 -18.137 1.00 46.11 N
ATOM 96 CA ALA E 20 -4.955 -5.628 -19.488 1.00 30.37 C
ATOM 97 C ALA E 20 -5.528 -4.228 -19.456 1.00 60.33 C
ATOM 98 O ALA E 20 -5.016 -3.297 -20.077 1.00 39.81 O
ATOM 99 CB ALA E 20 -5.936 -6.595 -20.132 1.00100.00 C
ATOM 100 H ALA E 20 -4.961 -6.958 -17.812 1.00 0.00 H
ATOM 101 HA ALA E 20 -4.036 -5.615 -20.074 1.00 0.00 H
ATOM 102 1HB ALA E 20 -6.173 -6.255 -21.140 1.00 0.00 H
ATOM 103 2HB ALA E 20 -5.490 -7.588 -20.179 1.00 0.00 H
ATOM 104 3HB ALA E 20 -6.849 -6.635 -19.540 1.00 0.00 H
ATOM 105 N LYS E 21 -6.604 -4.117 -18.698 1.00 35.73 N
ATOM 106 CA LYS E 21 -7.307 -2.889 -18.527 1.00 21.49 C
ATOM 107 C LYS E 21 -6.412 -1.856 -17.917 1.00 22.86 C
ATOM 108 O LYS E 21 -6.486 -0.663 -18.236 1.00 36.77 O
ATOM 109 CB LYS E 21 -8.514 -3.116 -17.640 1.00 36.64 C
ATOM 110 CG LYS E 21 -9.779 -3.359 -18.444 1.00100.00 C
ATOM 111 CD LYS E 21 -10.379 -2.078 -19.022 1.00100.00 C
ATOM 112 CE LYS E 21 -11.794 -2.262 -19.578 1.00100.00 C
ATOM 113 NZ LYS E 21 -11.852 -3.014 -20.848 1.00100.00 N
ATOM 114 H LYS E 21 -6.936 -4.944 -18.223 1.00 0.00 H
ATOM 115 HA LYS E 21 -7.643 -2.543 -19.505 1.00 0.00 H
ATOM 116 1HB LYS E 21 -8.334 -3.975 -16.993 1.00 0.00 H
ATOM 117 2HB LYS E 21 -8.662 -2.248 -16.998 1.00 0.00 H
ATOM 118 1HG LYS E 21 -9.560 -4.033 -19.273 1.00 0.00 H
ATOM 119 2HG LYS E 21 -10.530 -3.826 -17.808 1.00 0.00 H
ATOM 120 1HD LYS E 21 -10.421 -1.313 -18.245 1.00 0.00 H
ATOM 121 2HD LYS E 21 -9.747 -1.714 -19.832 1.00 0.00 H
ATOM 122 1HE LYS E 21 -12.404 -2.795 -18.850 1.00 0.00 H
ATOM 123 2HE LYS E 21 -12.246 -1.286 -19.752 1.00 0.00 H
ATOM 124 1HZ LYS E 21 -12.813 -3.093 -21.150 1.00 0.00 H
ATOM 125 2HZ LYS E 21 -11.317 -2.527 -21.553 1.00 0.00 H
ATOM 126 3HZ LYS E 21 -11.466 -3.937 -20.711 1.00 0.00 H
ATOM 127 N ALA E 22 -5.570 -2.359 -17.018 1.00 47.73 N
ATOM 128 CA ALA E 22 -4.635 -1.532 -16.303 1.00 42.43 C
ATOM 129 C ALA E 22 -3.651 -0.868 -17.229 1.00 32.95 C
ATOM 130 O ALA E 22 -3.344 0.330 -17.102 1.00 23.50 O
ATOM 131 CB ALA E 22 -3.932 -2.325 -15.235 1.00 25.69 C
ATOM 132 H ALA E 22 -5.590 -3.352 -16.834 1.00 0.00 H
ATOM 133 HA ALA E 22 -5.192 -0.723 -15.829 1.00 0.00 H
ATOM 134 1HB ALA E 22 -3.229 -1.681 -14.706 1.00 0.00 H
ATOM 135 2HB ALA E 22 -4.666 -2.717 -14.530 1.00 0.00 H
ATOM 136 3HB ALA E 22 -3.391 -3.152 -15.693 1.00 0.00 H
ATOM 137 N LYS E 23 -3.161 -1.652 -18.170 1.00 44.30 N
ATOM 138 CA LYS E 23 -2.214 -1.113 -19.110 1.00 11.58 C
ATOM 139 C LYS E 23 -2.695 0.172 -19.794 1.00 40.32 C
ATOM 140 O LYS E 23 -1.919 1.124 -19.959 1.00 38.01 O
ATOM 141 CB LYS E 23 -1.587 -2.135 -20.053 1.00 30.95 C
ATOM 142 CG LYS E 23 -0.170 -1.728 -20.509 1.00 31.73 C
ATOM 143 CD LYS E 23 0.766 -2.903 -20.829 1.00 12.23 C
ATOM 144 CE LYS E 23 2.203 -2.482 -21.170 1.00 20.87 C
ATOM 145 NZ LYS E 23 2.563 -2.729 -22.576 1.00 50.91 N
ATOM 146 H LYS E 23 -3.434 -2.621 -18.247 1.00 0.00 H
ATOM 147 HA LYS E 23 -1.391 -0.663 -18.553 1.00 0.00 H
ATOM 148 1HB LYS E 23 -1.532 -3.104 -19.556 1.00 0.00 H
ATOM 149 2HB LYS E 23 -2.219 -2.254 -20.933 1.00 0.00 H
ATOM 150 1HG LYS E 23 -0.239 -1.117 -21.410 1.00 0.00 H
ATOM 151 2HG LYS E 23 0.308 -1.139 -19.727 1.00 0.00 H
ATOM 152 1HD LYS E 23 0.813 -3.575 -19.971 1.00 0.00 H
ATOM 153 2HD LYS E 23 0.375 -3.458 -21.682 1.00 0.00 H
ATOM 154 1HE LYS E 23 2.327 -1.419 -20.970 1.00 0.00 H
ATOM 155 2HE LYS E 23 2.902 -3.032 -20.540 1.00 0.00 H
ATOM 156 1HZ LYS E 23 3.515 -2.433 -22.737 1.00 0.00 H
ATOM 157 2HZ LYS E 23 2.478 -3.716 -22.778 1.00 0.00 H
ATOM 158 3HZ LYS E 23 1.943 -2.208 -23.179 1.00 0.00 H
ATOM 159 N GLU E 24 -3.980 0.209 -20.177 1.00 32.85 N
ATOM 160 CA GLU E 24 -4.555 1.385 -20.848 1.00 22.29 C
ATOM 161 C GLU E 24 -4.564 2.699 -20.047 1.00 42.05 C
ATOM 162 O GLU E 24 -4.196 3.734 -20.594 1.00 45.13 O
ATOM 163 CB GLU E 24 -5.925 1.088 -21.453 1.00 58.69 C
ATOM 164 CG GLU E 24 -6.072 -0.389 -21.842 1.00100.00 C
ATOM 165 CD GLU E 24 -6.810 -0.561 -23.140 1.00100.00 C
ATOM 166 OE1 GLU E 24 -6.453 -0.020 -24.181 1.00100.00 O
ATOM 167 OE2 GLU E 24 -7.871 -1.337 -23.021 1.00 73.68 O
ATOM 168 H GLU E 24 -4.568 -0.593 -20.000 1.00 0.00 H
ATOM 169 HA GLU E 24 -3.888 1.681 -21.659 1.00 0.00 H
ATOM 170 1HB GLU E 24 -6.704 1.348 -20.736 1.00 0.00 H
ATOM 171 2HB GLU E 24 -6.074 1.707 -22.337 1.00 0.00 H
ATOM 172 1HG GLU E 24 -5.080 -0.831 -21.932 1.00 0.00 H
ATOM 173 2HG GLU E 24 -6.602 -0.912 -21.047 1.00 0.00 H
ATOM 174 N ASP E 25 -4.982 2.669 -18.759 1.00 43.55 N
ATOM 175 CA ASP E 25 -4.999 3.887 -17.949 1.00 26.76 C
ATOM 176 C ASP E 25 -3.654 4.546 -18.075 1.00 31.24 C
ATOM 177 O ASP E 25 -3.495 5.640 -18.589 1.00 35.75 O
ATOM 178 CB ASP E 25 -5.141 3.611 -16.411 1.00100.00 C
ATOM 179 CG ASP E 25 -4.644 4.759 -15.500 1.00100.00 C
ATOM 180 OD1 ASP E 25 -5.270 5.805 -15.446 1.00 65.61 O
ATOM 181 OD2 ASP E 25 -3.507 4.542 -14.769 1.00 31.92 O
ATOM 182 H ASP E 25 -5.287 1.799 -18.346 1.00 0.00 H
ATOM 183 HA ASP E 25 -5.856 4.490 -18.249 1.00 0.00 H
ATOM 184 1HB ASP E 25 -6.188 3.425 -16.170 1.00 0.00 H
ATOM 185 2HB ASP E 25 -4.581 2.713 -16.149 1.00 0.00 H
ATOM 186 N PHE E 26 -2.704 3.778 -17.543 1.00 25.72 N
ATOM 187 CA PHE E 26 -1.343 4.147 -17.448 1.00 54.72 C
ATOM 188 C PHE E 26 -0.863 4.831 -18.673 1.00 19.08 C
ATOM 189 O PHE E 26 -0.370 5.957 -18.630 1.00 35.72 O
ATOM 190 CB PHE E 26 -0.459 2.984 -17.007 1.00 19.65 C
ATOM 191 CG PHE E 26 0.995 3.327 -17.115 1.00 23.45 C
ATOM 192 CD1 PHE E 26 1.650 3.923 -16.039 1.00 8.06 C
ATOM 193 CD2 PHE E 26 1.718 3.067 -18.281 1.00 21.85 C
ATOM 194 CE1 PHE E 26 3.006 4.252 -16.136 1.00 9.56 C
ATOM 195 CE2 PHE E 26 3.081 3.369 -18.382 1.00 16.79 C
ATOM 196 CZ PHE E 26 3.725 3.965 -17.299 1.00 12.41 C
ATOM 197 H PHE E 26 -2.995 2.878 -17.190 1.00 0.00 H
ATOM 198 HA PHE E 26 -1.250 4.938 -16.702 1.00 0.00 H
ATOM 199 1HB PHE E 26 -0.692 2.720 -15.976 1.00 0.00 H
ATOM 200 2HB PHE E 26 -0.671 2.112 -17.624 1.00 0.00 H
ATOM 201 HD1 PHE E 26 1.093 4.128 -15.124 1.00 0.00 H
ATOM 202 HD2 PHE E 26 1.200 2.601 -19.120 1.00 0.00 H
ATOM 203 HE1 PHE E 26 3.510 4.736 -15.300 1.00 0.00 H
ATOM 204 HE2 PHE E 26 3.639 3.146 -19.291 1.00 0.00 H
ATOM 205 HZ PHE E 26 4.785 4.208 -17.359 1.00 0.00 H
ATOM 206 N LEU E 27 -1.033 4.138 -19.758 1.00 14.50 N
ATOM 207 CA LEU E 27 -0.603 4.675 -21.016 1.00 56.30 C
ATOM 208 C LEU E 27 -1.134 6.071 -21.249 1.00 40.02 C
ATOM 209 O LEU E 27 -0.405 7.006 -21.535 1.00 32.17 O
ATOM 210 CB LEU E 27 -1.013 3.746 -22.149 1.00 33.59 C
ATOM 211 CG LEU E 27 0.149 2.927 -22.680 1.00 35.32 C
ATOM 212 CD1 LEU E 27 1.478 3.534 -22.234 1.00 42.15 C
ATOM 213 CD2 LEU E 27 0.008 1.486 -22.198 1.00 23.25 C
ATOM 214 H LEU E 27 -1.464 3.225 -19.734 1.00 0.00 H
ATOM 215 HA LEU E 27 0.483 4.756 -21.004 1.00 0.00 H
ATOM 216 1HB LEU E 27 -1.790 3.076 -21.785 1.00 0.00 H
ATOM 217 2HB LEU E 27 -1.430 4.347 -22.957 1.00 0.00 H
ATOM 218 HG LEU E 27 0.143 2.950 -23.770 1.00 0.00 H
ATOM 219 1HD1 LEU E 27 2.301 2.934 -22.624 1.00 0.00 H
ATOM 220 2HD1 LEU E 27 1.559 4.552 -22.616 1.00 0.00 H
ATOM 221 3HD1 LEU E 27 1.524 3.549 -21.146 1.00 0.00 H
ATOM 222 1HD2 LEU E 27 0.840 0.892 -22.577 1.00 0.00 H
ATOM 223 2HD2 LEU E 27 0.014 1.465 -21.108 1.00 0.00 H
ATOM 224 3HD2 LEU E 27 -0.931 1.070 -22.564 1.00 0.00 H
ATOM 225 N LYS E 28 -2.432 6.218 -21.113 1.00 29.31 N
ATOM 226 CA LYS E 28 -3.028 7.510 -21.333 1.00 13.60 C
ATOM 227 C LYS E 28 -2.373 8.565 -20.484 1.00 16.10 C
ATOM 228 O LYS E 28 -2.063 9.646 -20.947 1.00 35.47 O
ATOM 229 CB LYS E 28 -4.536 7.501 -21.184 1.00 45.22 C
ATOM 230 CG LYS E 28 -5.204 6.378 -21.961 1.00 91.35 C
ATOM 231 CD LYS E 28 -5.906 6.857 -23.222 1.00100.00 C
ATOM 232 CE LYS E 28 -5.326 6.256 -24.499 1.00100.00 C
ATOM 233 NZ LYS E 28 -4.440 7.172 -25.241 1.00100.00 N
ATOM 234 H LYS E 28 -3.024 5.441 -20.856 1.00 0.00 H
ATOM 235 HA LYS E 28 -2.803 7.826 -22.352 1.00 0.00 H
ATOM 236 1HB LYS E 28 -4.797 7.398 -20.130 1.00 0.00 H
ATOM 237 2HB LYS E 28 -4.942 8.452 -21.530 1.00 0.00 H
ATOM 238 1HG LYS E 28 -4.455 5.641 -22.252 1.00 0.00 H
ATOM 239 2HG LYS E 28 -5.944 5.888 -21.329 1.00 0.00 H
ATOM 240 1HD LYS E 28 -6.963 6.592 -23.174 1.00 0.00 H
ATOM 241 2HD LYS E 28 -5.825 7.942 -23.294 1.00 0.00 H
ATOM 242 1HE LYS E 28 -4.752 5.364 -24.253 1.00 0.00 H
ATOM 243 2HE LYS E 28 -6.138 5.966 -25.166 1.00 0.00 H
ATOM 244 1HZ LYS E 28 -4.095 6.710 -26.070 1.00 0.00 H
ATOM 245 2HZ LYS E 28 -4.956 7.999 -25.507 1.00 0.00 H
ATOM 246 3HZ LYS E 28 -3.661 7.436 -24.655 1.00 0.00 H
ATOM 247 N LYS E 29 -2.172 8.244 -19.230 1.00 20.39 N
ATOM 248 CA LYS E 29 -1.533 9.193 -18.355 1.00 14.46 C
ATOM 249 C LYS E 29 -0.073 9.346 -18.713 1.00 38.12 C
ATOM 250 O LYS E 29 0.484 10.441 -18.665 1.00 21.58 O
ATOM 251 CB LYS E 29 -1.716 8.805 -16.920 1.00 23.78 C
ATOM 252 CG LYS E 29 -3.190 8.557 -16.583 1.00 22.39 C
ATOM 253 CD LYS E 29 -3.416 8.275 -15.106 1.00 50.53 C
ATOM 254 CE LYS E 29 -4.619 8.986 -14.507 1.00100.00 C
ATOM 255 NZ LYS E 29 -5.502 8.076 -13.752 1.00100.00 N
ATOM 256 H LYS E 29 -2.454 7.347 -18.861 1.00 0.00 H
ATOM 257 HA LYS E 29 -1.993 10.170 -18.509 1.00 0.00 H
ATOM 258 1HB LYS E 29 -1.142 7.902 -16.711 1.00 0.00 H
ATOM 259 2HB LYS E 29 -1.328 9.595 -16.277 1.00 0.00 H
ATOM 260 1HG LYS E 29 -3.779 9.433 -16.857 1.00 0.00 H
ATOM 261 2HG LYS E 29 -3.555 7.703 -17.153 1.00 0.00 H
ATOM 262 1HD LYS E 29 -3.563 7.204 -14.958 1.00 0.00 H
ATOM 263 2HD LYS E 29 -2.539 8.586 -14.538 1.00 0.00 H
ATOM 264 1HE LYS E 29 -4.279 9.772 -13.834 1.00 0.00 H
ATOM 265 2HE LYS E 29 -5.203 9.448 -15.303 1.00 0.00 H
ATOM 266 1HZ LYS E 29 -6.282 8.597 -13.377 1.00 0.00 H
ATOM 267 2HZ LYS E 29 -5.846 7.352 -14.367 1.00 0.00 H
ATOM 268 3HZ LYS E 29 -4.984 7.655 -12.994 1.00 0.00 H
ATOM 269 N TRP E 30 0.534 8.235 -19.102 1.00 13.64 N
ATOM 270 CA TRP E 30 1.921 8.244 -19.473 1.00 17.41 C
ATOM 271 C TRP E 30 2.169 9.278 -20.542 1.00 27.45 C
ATOM 272 O TRP E 30 3.118 10.089 -20.426 1.00 21.76 O
ATOM 273 CB TRP E 30 2.330 6.868 -20.009 1.00 15.35 C
ATOM 274 CG TRP E 30 3.709 6.812 -20.607 1.00 30.81 C
ATOM 275 CD1 TRP E 30 3.994 6.727 -21.925 1.00 22.83 C
ATOM 276 CD2 TRP E 30 4.993 6.895 -19.931 1.00 17.41 C
ATOM 277 NE1 TRP E 30 5.352 6.702 -22.124 1.00 35.21 N
ATOM 278 CE2 TRP E 30 5.995 6.821 -20.914 1.00 53.24 C
ATOM 279 CE3 TRP E 30 5.384 7.013 -18.594 1.00 15.55 C
ATOM 280 CZ2 TRP E 30 7.357 6.822 -20.596 1.00 17.22 C
ATOM 281 CZ3 TRP E 30 6.724 7.029 -18.282 1.00 25.08 C
ATOM 282 CH2 TRP E 30 7.706 6.915 -19.267 1.00 45.68 C
ATOM 283 H TRP E 30 0.020 7.366 -19.140 1.00 0.00 H
ATOM 284 HA TRP E 30 2.515 8.467 -18.587 1.00 0.00 H
ATOM 285 1HB TRP E 30 2.288 6.136 -19.202 1.00 0.00 H
ATOM 286 2HB TRP E 30 1.623 6.551 -20.775 1.00 0.00 H
ATOM 287 HD1 TRP E 30 3.253 6.684 -22.721 1.00 0.00 H
ATOM 288 HE1 TRP E 30 5.814 6.610 -23.017 1.00 0.00 H
ATOM 289 HE3 TRP E 30 4.630 7.094 -17.812 1.00 0.00 H
ATOM 290 HZ2 TRP E 30 8.131 6.754 -21.361 1.00 0.00 H
ATOM 291 HZ3 TRP E 30 6.998 7.134 -17.232 1.00 0.00 H
ATOM 292 HH2 TRP E 30 8.760 6.898 -18.988 1.00 0.00 H
ATOM 293 N GLU E 31 1.285 9.195 -21.578 1.00 17.58 N
ATOM 294 CA GLU E 31 1.291 10.054 -22.768 1.00 42.32 C
ATOM 295 C GLU E 31 0.989 11.522 -22.523 1.00 16.33 C
ATOM 296 O GLU E 31 1.596 12.404 -23.136 1.00 76.98 O
ATOM 297 CB GLU E 31 0.432 9.534 -23.928 1.00 52.50 C
ATOM 298 CG GLU E 31 0.362 8.005 -23.998 1.00100.00 C
ATOM 299 CD GLU E 31 0.915 7.429 -25.259 1.00100.00 C
ATOM 300 OE1 GLU E 31 0.055 7.483 -26.258 1.00 96.20 O
ATOM 301 OE2 GLU E 31 2.038 6.951 -25.320 1.00 98.06 O
ATOM 302 H GLU E 31 0.580 8.476 -21.494 1.00 0.00 H
ATOM 303 HA GLU E 31 2.314 10.122 -23.140 1.00 0.00 H
ATOM 304 1HB GLU E 31 -0.583 9.920 -23.831 1.00 0.00 H
ATOM 305 2HB GLU E 31 0.833 9.903 -24.872 1.00 0.00 H
ATOM 306 1HG GLU E 31 0.918 7.587 -23.159 1.00 0.00 H
ATOM 307 2HG GLU E 31 -0.677 7.695 -23.900 1.00 0.00 H
ATOM 308 N THR E 32 0.042 11.783 -21.629 1.00 95.23 N
ATOM 309 CA THR E 32 -0.349 13.144 -21.293 1.00 14.13 C
ATOM 310 C THR E 32 -0.291 13.360 -19.791 1.00 34.92 C
ATOM 311 O THR E 32 -1.285 13.365 -19.069 1.00 45.19 O
ATOM 312 CB THR E 32 -1.699 13.556 -21.967 1.00 43.93 C
ATOM 313 OG1 THR E 32 -2.131 12.551 -22.893 1.00 35.19 O
ATOM 314 CG2 THR E 32 -1.533 14.872 -22.729 1.00 18.94 C
ATOM 315 H THR E 32 -0.419 11.011 -21.170 1.00 0.00 H
ATOM 316 HA THR E 32 0.424 13.824 -21.652 1.00 0.00 H
ATOM 317 HB THR E 32 -2.465 13.678 -21.202 1.00 0.00 H
ATOM 318 HG1 THR E 32 -1.495 11.832 -22.903 1.00 0.00 H
ATOM 319 1HG2 THR E 32 -2.481 15.146 -23.192 1.00 0.00 H
ATOM 320 2HG2 THR E 32 -1.226 15.657 -22.038 1.00 0.00 H
ATOM 321 3HG2 THR E 32 -0.774 14.752 -23.501 1.00 0.00 H
ATOM 322 N PRO E 33 0.931 13.513 -19.326 1.00 41.99 N
ATOM 323 CA PRO E 33 1.203 13.723 -17.938 1.00 37.35 C
ATOM 324 C PRO E 33 0.718 15.099 -17.515 1.00100.00 C
ATOM 325 O PRO E 33 0.745 16.037 -18.334 1.00 21.69 O
ATOM 326 CB PRO E 33 2.735 13.669 -17.818 1.00 14.27 C
ATOM 327 CG PRO E 33 3.320 13.724 -19.217 1.00100.00 C
ATOM 328 CD PRO E 33 2.154 13.594 -20.175 1.00 19.71 C
ATOM 329 HA PRO E 33 0.750 12.909 -17.353 1.00 0.00 H
ATOM 330 1HB PRO E 33 3.095 14.512 -17.209 1.00 0.00 H
ATOM 331 2HB PRO E 33 3.040 12.747 -17.302 1.00 0.00 H
ATOM 332 1HG PRO E 33 3.863 14.669 -19.365 1.00 0.00 H
ATOM 333 2HG PRO E 33 4.051 12.913 -19.355 1.00 0.00 H
ATOM 334 1HD PRO E 33 2.111 14.482 -20.823 1.00 0.00 H
ATOM 335 2HD PRO E 33 2.272 12.680 -20.776 1.00 0.00 H
ATOM 336 N SER E 34 0.275 15.204 -16.248 1.00 62.63 N
ATOM 337 CA SER E 34 -0.206 16.475 -15.725 1.00 17.64 C
ATOM 338 C SER E 34 0.911 17.336 -15.147 1.00 91.45 C
ATOM 339 O SER E 34 1.930 16.835 -14.654 1.00 35.12 O
ATOM 340 CB SER E 34 -1.508 16.430 -14.938 1.00 51.20 C
ATOM 341 OG SER E 34 -1.239 16.443 -13.567 1.00 33.12 O
ATOM 342 H SER E 34 0.274 14.393 -15.647 1.00 0.00 H
ATOM 343 HA SER E 34 -0.390 17.147 -16.564 1.00 0.00 H
ATOM 344 1HB SER E 34 -2.126 17.286 -15.207 1.00 0.00 H
ATOM 345 2HB SER E 34 -2.062 15.531 -15.203 1.00 0.00 H
ATOM 346 HG SER E 34 -0.283 16.478 -13.485 1.00 0.00 H
ATOM 347 N GLN E 35 0.686 18.638 -15.257 1.00 18.83 N
ATOM 348 CA GLN E 35 1.598 19.679 -14.850 1.00 83.48 C
ATOM 349 C GLN E 35 0.953 20.784 -14.015 1.00 30.01 C
ATOM 350 O GLN E 35 -0.220 21.081 -14.207 1.00 61.43 O
ATOM 351 CB GLN E 35 2.037 20.298 -16.174 1.00 30.71 C
ATOM 352 CG GLN E 35 3.418 19.829 -16.631 1.00 82.08 C
ATOM 353 CD GLN E 35 4.161 20.951 -17.306 1.00 40.25 C
ATOM 354 OE1 GLN E 35 3.712 21.480 -18.334 1.00 65.77 O
ATOM 355 NE2 GLN E 35 5.284 21.344 -16.707 1.00100.00 N
ATOM 356 H GLN E 35 -0.203 18.894 -15.662 1.00 0.00 H
ATOM 357 HA GLN E 35 2.431 19.220 -14.318 1.00 0.00 H
ATOM 358 1HB GLN E 35 1.313 20.049 -16.950 1.00 0.00 H
ATOM 359 2HB GLN E 35 2.055 21.384 -16.080 1.00 0.00 H
ATOM 360 1HG GLN E 35 3.984 19.497 -15.761 1.00 0.00 H
ATOM 361 2HG GLN E 35 3.296 19.005 -17.334 1.00 0.00 H
ATOM 362 1HE2 GLN E 35 5.829 22.086 -17.101 1.00 0.00 H
ATOM 363 2HE2 GLN E 35 5.584 20.898 -15.863 1.00 0.00 H
ATOM 364 N ASN E 36 1.745 21.397 -13.114 1.00 24.75 N
ATOM 365 CA ASN E 36 1.304 22.492 -12.228 1.00100.00 C
ATOM 366 C ASN E 36 -0.176 22.504 -11.821 1.00 25.06 C
ATOM 367 O ASN E 36 -1.000 23.292 -12.284 1.00 40.41 O
ATOM 368 CB ASN E 36 1.855 23.894 -12.585 1.00 34.00 C
ATOM 369 CG ASN E 36 3.169 24.166 -11.864 1.00100.00 C
ATOM 370 OD1 ASN E 36 4.226 23.614 -12.223 1.00 61.43 O
ATOM 371 ND2 ASN E 36 3.109 25.003 -10.826 1.00 90.99 N
ATOM 372 H ASN E 36 2.699 21.072 -13.056 1.00 0.00 H
ATOM 373 HA ASN E 36 1.648 22.277 -11.215 1.00 0.00 H
ATOM 374 1HB ASN E 36 2.008 23.961 -13.663 1.00 0.00 H
ATOM 375 2HB ASN E 36 1.123 24.653 -12.310 1.00 0.00 H
ATOM 376 1HD2 ASN E 36 3.939 25.222 -10.311 1.00 0.00 H
ATOM 377 2HD2 ASN E 36 2.235 25.411 -10.563 1.00 0.00 H
ATOM 378 N THR E 37 -0.510 21.609 -10.918 1.00 43.44 N
ATOM 379 CA THR E 37 -1.859 21.509 -10.465 1.00 28.96 C
ATOM 380 C THR E 37 -2.059 22.260 -9.165 1.00 30.33 C
ATOM 381 O THR E 37 -3.074 22.075 -8.527 1.00 39.40 O
ATOM 382 CB THR E 37 -2.206 20.017 -10.338 1.00 65.75 C
ATOM 383 OG1 THR E 37 -1.015 19.295 -10.177 1.00 39.19 O
ATOM 384 CG2 THR E 37 -2.797 19.527 -11.640 1.00 25.69 C
ATOM 385 H THR E 37 0.185 20.983 -10.536 1.00 0.00 H
ATOM 386 HA THR E 37 -2.508 21.979 -11.205 1.00 0.00 H
ATOM 387 HB THR E 37 -2.926 19.878 -9.532 1.00 0.00 H
ATOM 388 HG1 THR E 37 -0.270 19.901 -10.184 1.00 0.00 H
ATOM 389 1HG2 THR E 37 -3.044 18.469 -11.552 1.00 0.00 H
ATOM 390 2HG2 THR E 37 -3.700 20.094 -11.866 1.00 0.00 H
ATOM 391 3HG2 THR E 37 -2.073 19.664 -12.442 1.00 0.00 H
ATOM 392 N ALA E 38 -1.089 23.101 -8.762 1.00 35.92 N
ATOM 393 CA ALA E 38 -1.208 23.853 -7.500 1.00 35.16 C
ATOM 394 C ALA E 38 -0.062 24.835 -7.226 1.00 40.10 C
ATOM 395 O ALA E 38 0.865 24.921 -8.017 1.00 45.44 O
ATOM 396 CB ALA E 38 -1.333 22.889 -6.334 1.00 19.11 C
ATOM 397 H ALA E 38 -0.263 23.222 -9.331 1.00 0.00 H
ATOM 398 HA ALA E 38 -2.108 24.466 -7.555 1.00 0.00 H
ATOM 399 1HB ALA E 38 -1.421 23.452 -5.405 1.00 0.00 H
ATOM 400 2HB ALA E 38 -2.220 22.269 -6.468 1.00 0.00 H
ATOM 401 3HB ALA E 38 -0.450 22.254 -6.291 1.00 0.00 H
ATOM 402 N GLN E 39 -0.133 25.575 -6.088 1.00 32.14 N
ATOM 403 CA GLN E 39 0.905 26.536 -5.715 1.00 18.44 C
ATOM 404 C GLN E 39 1.343 26.366 -4.295 1.00 19.28 C
ATOM 405 O GLN E 39 0.605 25.884 -3.440 1.00 23.26 O
ATOM 406 CB GLN E 39 0.524 28.009 -5.812 1.00 48.20 C
ATOM 407 CG GLN E 39 0.309 28.549 -7.213 1.00 45.50 C
ATOM 408 CD GLN E 39 -0.930 29.418 -7.244 1.00 30.31 C
ATOM 409 OE1 GLN E 39 -1.733 29.355 -8.193 1.00100.00 O
ATOM 410 NE2 GLN E 39 -1.111 30.201 -6.177 1.00 37.40 N
ATOM 411 H GLN E 39 -0.932 25.454 -5.482 1.00 0.00 H
ATOM 412 HA GLN E 39 1.755 26.404 -6.384 1.00 0.00 H
ATOM 413 1HB GLN E 39 -0.398 28.184 -5.258 1.00 0.00 H
ATOM 414 2HB GLN E 39 1.302 28.617 -5.352 1.00 0.00 H
ATOM 415 1HG GLN E 39 1.178 29.141 -7.500 1.00 0.00 H
ATOM 416 2HG GLN E 39 0.185 27.711 -7.899 1.00 0.00 H
ATOM 417 1HE2 GLN E 39 -1.909 30.803 -6.127 1.00 0.00 H
ATOM 418 2HE2 GLN E 39 -0.449 30.186 -5.427 1.00 0.00 H
ATOM 419 N LEU E 40 2.565 26.794 -4.040 1.00 34.46 N
ATOM 420 CA LEU E 40 3.116 26.678 -2.701 1.00 47.32 C
ATOM 421 C LEU E 40 2.136 27.238 -1.696 1.00 26.47 C
ATOM 422 O LEU E 40 1.756 26.553 -0.763 1.00 32.52 O
ATOM 423 CB LEU E 40 4.484 27.393 -2.598 1.00 31.55 C
ATOM 424 CG LEU E 40 5.541 26.681 -1.763 1.00 31.49 C
ATOM 425 CD1 LEU E 40 6.287 27.704 -0.907 1.00 17.27 C
ATOM 426 CD2 LEU E 40 4.920 25.611 -0.876 1.00 33.77 C
ATOM 427 H LEU E 40 3.129 27.205 -4.770 1.00 0.00 H
ATOM 428 HA LEU E 40 3.263 25.622 -2.478 1.00 0.00 H
ATOM 429 1HB LEU E 40 4.886 27.520 -3.602 1.00 0.00 H
ATOM 430 2HB LEU E 40 4.328 28.380 -2.163 1.00 0.00 H
ATOM 431 HG LEU E 40 6.266 26.205 -2.423 1.00 0.00 H
ATOM 432 1HD1 LEU E 40 7.044 27.196 -0.309 1.00 0.00 H
ATOM 433 2HD1 LEU E 40 6.769 28.437 -1.554 1.00 0.00 H
ATOM 434 3HD1 LEU E 40 5.582 28.209 -0.247 1.00 0.00 H
ATOM 435 1HD2 LEU E 40 5.702 25.122 -0.294 1.00 0.00 H
ATOM 436 2HD2 LEU E 40 4.199 26.072 -0.200 1.00 0.00 H
ATOM 437 3HD2 LEU E 40 4.414 24.872 -1.497 1.00 0.00 H
ATOM 438 N ASP E 41 1.737 28.499 -1.964 1.00 32.94 N
ATOM 439 CA ASP E 41 0.826 29.328 -1.179 1.00 85.30 C
ATOM 440 C ASP E 41 -0.434 28.639 -0.682 1.00 25.48 C
ATOM 441 O ASP E 41 -0.925 28.935 0.412 1.00 40.17 O
ATOM 442 CB ASP E 41 0.525 30.687 -1.864 1.00 28.29 C
ATOM 443 CG ASP E 41 -0.472 30.594 -2.983 1.00100.00 C
ATOM 444 OD1 ASP E 41 -1.092 29.580 -3.221 1.00 54.16 O
ATOM 445 OD2 ASP E 41 -0.609 31.713 -3.661 1.00 86.00 O
ATOM 446 H ASP E 41 2.137 28.875 -2.812 1.00 0.00 H
ATOM 447 HA ASP E 41 1.292 29.538 -0.216 1.00 0.00 H
ATOM 448 1HB ASP E 41 0.142 31.390 -1.124 1.00 0.00 H
ATOM 449 2HB ASP E 41 1.449 31.105 -2.265 1.00 0.00 H
ATOM 450 N GLN E 42 -0.960 27.730 -1.487 1.00 15.20 N
ATOM 451 CA GLN E 42 -2.155 27.011 -1.105 1.00 15.39 C
ATOM 452 C GLN E 42 -1.913 25.922 -0.057 1.00 24.32 C
ATOM 453 O GLN E 42 -2.784 25.088 0.144 1.00 17.42 O
ATOM 454 CB GLN E 42 -2.858 26.417 -2.338 1.00 20.47 C
ATOM 455 CG GLN E 42 -2.186 26.820 -3.676 1.00 27.09 C
ATOM 456 CD GLN E 42 -2.968 26.363 -4.912 1.00 37.54 C
ATOM 457 OE1 GLN E 42 -3.051 25.165 -5.213 1.00 43.09 O
ATOM 458 NE2 GLN E 42 -3.559 27.312 -5.637 1.00 45.62 N
ATOM 459 H GLN E 42 -0.529 27.530 -2.378 1.00 0.00 H
ATOM 460 HA GLN E 42 -2.839 27.709 -0.622 1.00 0.00 H
ATOM 461 1HB GLN E 42 -2.862 25.329 -2.266 1.00 0.00 H
ATOM 462 2HB GLN E 42 -3.897 26.747 -2.359 1.00 0.00 H
ATOM 463 1HG GLN E 42 -2.104 27.906 -3.717 1.00 0.00 H
ATOM 464 2HG GLN E 42 -1.195 26.369 -3.723 1.00 0.00 H
ATOM 465 1HE2 GLN E 42 -4.082 27.065 -6.454 1.00 0.00 H
ATOM 466 2HE2 GLN E 42 -3.480 28.271 -5.365 1.00 0.00 H
ATOM 467 N PHE E 43 -0.758 25.899 0.609 1.00 33.75 N
ATOM 468 CA PHE E 43 -0.460 24.890 1.628 1.00 17.38 C
ATOM 469 C PHE E 43 0.208 25.516 2.795 1.00 98.41 C
ATOM 470 O PHE E 43 0.880 26.519 2.621 1.00 15.74 O
ATOM 471 CB PHE E 43 0.553 23.837 1.182 1.00 30.93 C
ATOM 472 CG PHE E 43 0.072 23.096 -0.015 1.00 32.01 C
ATOM 473 CD1 PHE E 43 -0.751 21.979 0.119 1.00 32.90 C
ATOM 474 CD2 PHE E 43 0.429 23.548 -1.280 1.00 25.76 C
ATOM 475 CE1 PHE E 43 -1.198 21.307 -1.012 1.00 7.78 C
ATOM 476 CE2 PHE E 43 -0.016 22.898 -2.423 1.00 32.36 C
ATOM 477 CZ PHE E 43 -0.828 21.777 -2.272 1.00 27.17 C
ATOM 478 H PHE E 43 -0.067 26.605 0.399 1.00 0.00 H
ATOM 479 HA PHE E 43 -1.382 24.360 1.871 1.00 0.00 H
ATOM 480 1HB PHE E 43 1.502 24.320 0.953 1.00 0.00 H
ATOM 481 2HB PHE E 43 0.731 23.136 1.996 1.00 0.00 H
ATOM 482 HD1 PHE E 43 -1.036 21.644 1.117 1.00 0.00 H
ATOM 483 HD2 PHE E 43 1.067 24.428 -1.367 1.00 0.00 H
ATOM 484 HE1 PHE E 43 -1.829 20.425 -0.907 1.00 0.00 H
ATOM 485 HE2 PHE E 43 0.255 23.243 -3.420 1.00 0.00 H
ATOM 486 HZ PHE E 43 -1.173 21.265 -3.169 1.00 0.00 H
ATOM 487 N ASP E 44 0.051 24.884 3.954 1.00 29.19 N
ATOM 488 CA ASP E 44 0.670 25.357 5.177 1.00 23.46 C
ATOM 489 C ASP E 44 1.747 24.351 5.584 1.00 26.12 C
ATOM 490 O ASP E 44 1.438 23.167 5.731 1.00 30.52 O
ATOM 491 CB ASP E 44 -0.398 25.484 6.296 1.00 28.01 C
ATOM 492 CG ASP E 44 -1.043 26.847 6.364 1.00100.00 C
ATOM 493 OD1 ASP E 44 -0.437 27.914 6.307 1.00 36.02 O
ATOM 494 OD2 ASP E 44 -2.338 26.762 6.478 1.00 47.44 O
ATOM 495 H ASP E 44 -0.517 24.049 3.981 1.00 0.00 H
ATOM 496 HA ASP E 44 1.102 26.340 4.988 1.00 0.00 H
ATOM 497 1HB ASP E 44 -1.181 24.742 6.137 1.00 0.00 H
ATOM 498 2HB ASP E 44 0.061 25.274 7.263 1.00 0.00 H
ATOM 499 N ARG E 45 3.004 24.807 5.734 1.00 56.00 N
ATOM 500 CA ARG E 45 4.093 23.912 6.110 1.00 24.19 C
ATOM 501 C ARG E 45 3.996 23.536 7.577 1.00 22.06 C
ATOM 502 O ARG E 45 3.912 24.383 8.477 1.00 76.30 O
ATOM 503 CB ARG E 45 5.477 24.448 5.841 1.00 43.54 C
ATOM 504 CG ARG E 45 6.337 24.143 7.069 1.00100.00 C
ATOM 505 CD ARG E 45 7.385 25.186 7.441 1.00100.00 C
ATOM 506 NE ARG E 45 8.663 24.527 7.666 1.00 44.70 N
ATOM 507 CZ ARG E 45 9.745 24.716 6.905 1.00100.00 C
ATOM 508 NH1 ARG E 45 9.719 25.580 5.861 1.00 32.80 N
ATOM 509 NH2 ARG E 45 10.874 24.021 7.209 1.00 24.16 N
ATOM 510 H ARG E 45 3.201 25.786 5.584 1.00 0.00 H
ATOM 511 HA ARG E 45 4.000 22.992 5.532 1.00 0.00 H
ATOM 512 1HB ARG E 45 5.881 23.978 4.946 1.00 0.00 H
ATOM 513 2HB ARG E 45 5.421 25.520 5.651 1.00 0.00 H
ATOM 514 1HG ARG E 45 5.697 24.039 7.945 1.00 0.00 H
ATOM 515 2HG ARG E 45 6.885 23.214 6.908 1.00 0.00 H
ATOM 516 1HD ARG E 45 7.485 25.907 6.630 1.00 0.00 H
ATOM 517 2HD ARG E 45 7.077 25.703 8.349 1.00 0.00 H
ATOM 518 HE ARG E 45 8.731 23.888 8.447 1.00 0.00 H
ATOM 519 1HH1 ARG E 45 8.874 26.091 5.649 1.00 0.00 H
ATOM 520 2HH1 ARG E 45 10.544 25.713 5.295 1.00 0.00 H
ATOM 521 1HH2 ARG E 45 10.879 23.382 7.993 1.00 0.00 H
ATOM 522 2HH2 ARG E 45 11.707 24.143 6.652 1.00 0.00 H
ATOM 523 N ILE E 46 4.018 22.249 7.811 1.00 51.90 N
ATOM 524 CA ILE E 46 3.895 21.762 9.147 1.00 27.34 C
ATOM 525 C ILE E 46 5.158 21.190 9.770 1.00 39.49 C
ATOM 526 O ILE E 46 5.886 21.901 10.456 1.00 54.52 O
ATOM 527 CB ILE E 46 2.690 20.850 9.194 1.00 27.09 C
ATOM 528 CG1 ILE E 46 1.521 21.660 8.631 1.00 22.52 C
ATOM 529 CG2 ILE E 46 2.403 20.441 10.634 1.00 24.68 C
ATOM 530 CD1 ILE E 46 0.187 20.921 8.647 1.00 42.28 C
ATOM 531 H ILE E 46 4.122 21.588 7.054 1.00 0.00 H
ATOM 532 HA ILE E 46 3.745 22.612 9.812 1.00 0.00 H
ATOM 533 HB ILE E 46 2.886 19.958 8.600 1.00 0.00 H
ATOM 534 1HG1 ILE E 46 1.406 22.579 9.204 1.00 0.00 H
ATOM 535 2HG1 ILE E 46 1.737 21.943 7.601 1.00 0.00 H
ATOM 536 1HG2 ILE E 46 1.533 19.785 10.659 1.00 0.00 H
ATOM 537 2HG2 ILE E 46 3.266 19.916 11.042 1.00 0.00 H
ATOM 538 3HG2 ILE E 46 2.204 21.330 11.232 1.00 0.00 H
ATOM 539 1HD1 ILE E 46 -0.590 21.563 8.231 1.00 0.00 H
ATOM 540 2HD1 ILE E 46 0.267 20.013 8.048 1.00 0.00 H
ATOM 541 3HD1 ILE E 46 -0.071 20.658 9.672 1.00 0.00 H
ATOM 542 N LYS E 47 5.392 19.908 9.522 1.00 33.76 N
ATOM 543 CA LYS E 47 6.537 19.181 10.036 1.00 46.17 C
ATOM 544 C LYS E 47 7.234 18.359 8.943 1.00 24.94 C
ATOM 545 O LYS E 47 6.683 18.009 7.891 1.00 31.24 O
ATOM 546 CB LYS E 47 6.157 18.296 11.248 1.00 25.33 C
ATOM 547 CG LYS E 47 7.356 17.892 12.126 1.00 94.99 C
ATOM 548 CD LYS E 47 7.096 16.737 13.111 1.00 35.66 C
ATOM 549 CE LYS E 47 8.164 15.620 13.090 1.00100.00 C
ATOM 550 NZ LYS E 47 7.872 14.416 12.249 1.00 46.39 N
ATOM 551 H LYS E 47 4.724 19.425 8.939 1.00 0.00 H
ATOM 552 HA LYS E 47 7.285 19.902 10.366 1.00 0.00 H
ATOM 553 1HB LYS E 47 5.440 18.827 11.876 1.00 0.00 H
ATOM 554 2HB LYS E 47 5.672 17.385 10.896 1.00 0.00 H
ATOM 555 1HG LYS E 47 8.186 17.583 11.489 1.00 0.00 H
ATOM 556 2HG LYS E 47 7.676 18.747 12.720 1.00 0.00 H
ATOM 557 1HD LYS E 47 7.056 17.128 14.128 1.00 0.00 H
ATOM 558 2HD LYS E 47 6.138 16.272 12.881 1.00 0.00 H
ATOM 559 1HE LYS E 47 9.106 16.025 12.723 1.00 0.00 H
ATOM 560 2HE LYS E 47 8.323 15.250 14.103 1.00 0.00 H
ATOM 561 1HZ LYS E 47 8.639 13.762 12.318 1.00 0.00 H
ATOM 562 2HZ LYS E 47 7.024 13.974 12.575 1.00 0.00 H
ATOM 563 3HZ LYS E 47 7.756 14.697 11.286 1.00 0.00 H
ATOM 564 N THR E 48 8.481 18.035 9.212 1.00 93.29 N
ATOM 565 CA THR E 48 9.228 17.238 8.289 1.00 10.48 C
ATOM 566 C THR E 48 9.083 15.755 8.671 1.00 20.54 C
ATOM 567 O THR E 48 9.461 15.346 9.761 1.00 34.03 O
ATOM 568 CB THR E 48 10.696 17.688 8.147 1.00 46.57 C
ATOM 569 OG1 THR E 48 10.756 18.910 7.439 1.00 24.67 O
ATOM 570 CG2 THR E 48 11.520 16.640 7.406 1.00 14.79 C
ATOM 571 H THR E 48 8.923 18.342 10.067 1.00 0.00 H
ATOM 572 HA THR E 48 8.766 17.323 7.305 1.00 0.00 H
ATOM 573 HB THR E 48 11.127 17.841 9.136 1.00 0.00 H
ATOM 574 HG1 THR E 48 9.867 19.187 7.204 1.00 0.00 H
ATOM 575 1HG2 THR E 48 12.551 16.982 7.320 1.00 0.00 H
ATOM 576 2HG2 THR E 48 11.494 15.700 7.957 1.00 0.00 H
ATOM 577 3HG2 THR E 48 11.105 16.488 6.411 1.00 0.00 H
ATOM 578 N LEU E 49 8.521 14.964 7.739 1.00 0.00 N
ATOM 579 CA LEU E 49 8.269 13.546 7.914 1.00 0.00 C
ATOM 580 C LEU E 49 9.418 12.623 7.712 1.00 0.00 C
ATOM 581 O LEU E 49 9.471 11.567 8.335 1.00 0.00 O
ATOM 582 CB LEU E 49 7.150 13.116 6.957 1.00 0.00 C
ATOM 583 CG LEU E 49 5.791 13.794 7.175 1.00 0.00 C
ATOM 584 CD1 LEU E 49 4.832 13.378 6.069 1.00 0.00 C
ATOM 585 CD2 LEU E 49 5.247 13.413 8.544 1.00 0.00 C
ATOM 586 H LEU E 49 8.265 15.405 6.867 1.00 0.00 H
ATOM 587 HA LEU E 49 8.027 13.364 8.961 1.00 0.00 H
ATOM 588 1HB LEU E 49 7.465 13.327 5.937 1.00 0.00 H
ATOM 589 2HB LEU E 49 7.003 12.041 7.055 1.00 0.00 H
ATOM 590 HG LEU E 49 5.912 14.877 7.122 1.00 0.00 H
ATOM 591 1HD1 LEU E 49 3.866 13.860 6.224 1.00 0.00 H
ATOM 592 2HD1 LEU E 49 5.237 13.680 5.103 1.00 0.00 H
ATOM 593 3HD1 LEU E 49 4.704 12.296 6.087 1.00 0.00 H
ATOM 594 1HD2 LEU E 49 4.282 13.896 8.699 1.00 0.00 H
ATOM 595 2HD2 LEU E 49 5.124 12.331 8.598 1.00 0.00 H
ATOM 596 3HD2 LEU E 49 5.944 13.738 9.316 1.00 0.00 H
ATOM 597 N GLY E 50 10.301 13.000 6.819 1.00 0.00 N
ATOM 598 CA GLY E 50 11.421 12.150 6.532 1.00 0.00 C
ATOM 599 C GLY E 50 12.189 12.719 5.383 1.00 0.00 C
ATOM 600 O GLY E 50 11.693 13.604 4.679 1.00 0.00 O
ATOM 601 H GLY E 50 10.211 13.877 6.327 1.00 0.00 H
ATOM 602 1HA GLY E 50 12.053 12.070 7.417 1.00 0.00 H
ATOM 603 2HA GLY E 50 11.066 11.147 6.299 1.00 0.00 H
ATOM 604 N THR E 51 13.397 12.202 5.216 1.00 0.00 N
ATOM 605 CA THR E 51 14.240 12.612 4.129 1.00 0.00 C
ATOM 606 C THR E 51 14.873 11.441 3.398 1.00 0.00 C
ATOM 607 O THR E 51 14.783 10.308 3.850 1.00 0.00 O
ATOM 608 CB THR E 51 15.345 13.558 4.636 1.00 0.00 C
ATOM 609 OG1 THR E 51 16.279 12.821 5.435 1.00 0.00 O
ATOM 610 CG2 THR E 51 14.745 14.680 5.469 1.00 0.00 C
ATOM 611 H THR E 51 13.735 11.506 5.865 1.00 0.00 H
ATOM 612 HA THR E 51 13.629 13.139 3.397 1.00 0.00 H
ATOM 613 HB THR E 51 15.874 13.987 3.785 1.00 0.00 H
ATOM 614 HG1 THR E 51 17.031 12.567 4.895 1.00 0.00 H
ATOM 615 1HG2 THR E 51 15.540 15.339 5.818 1.00 0.00 H
ATOM 616 2HG2 THR E 51 14.042 15.249 4.860 1.00 0.00 H
ATOM 617 3HG2 THR E 51 14.222 14.257 6.326 1.00 0.00 H
ATOM 618 N GLY E 52 15.523 11.720 2.265 1.00 0.00 N
ATOM 619 CA GLY E 52 16.220 10.681 1.596 1.00 0.00 C
ATOM 620 C GLY E 52 16.902 11.150 0.313 1.00 0.00 C
ATOM 621 O GLY E 52 16.933 12.315 -0.026 1.00 0.00 O
ATOM 622 H GLY E 52 15.533 12.651 1.872 1.00 0.00 H
ATOM 623 1HA GLY E 52 16.975 10.261 2.261 1.00 0.00 H
ATOM 624 2HA GLY E 52 15.526 9.878 1.350 1.00 0.00 H
ATOM 625 N SER E 53 19.507 12.266 0.048 1.00 0.00 N
ATOM 626 CA SER E 53 20.399 13.102 -0.710 1.00 0.00 C
ATOM 627 C SER E 53 19.657 13.858 -1.757 1.00 0.00 C
ATOM 628 O SER E 53 20.256 14.698 -2.405 1.00 0.00 O
ATOM 629 CB SER E 53 21.486 12.265 -1.357 1.00 0.00 C
ATOM 630 OG SER E 53 20.942 11.357 -2.274 1.00 0.00 O
ATOM 631 H SER E 53 19.502 11.271 -0.123 1.00 0.00 H
ATOM 632 HA SER E 53 20.893 13.792 -0.025 1.00 0.00 H
ATOM 633 1HB SER E 53 22.194 12.919 -1.865 1.00 0.00 H
ATOM 634 2HB SER E 53 22.035 11.725 -0.587 1.00 0.00 H
ATOM 635 HG SER E 53 20.457 10.713 -1.752 1.00 0.00 H
ATOM 636 N PHE E 54 18.382 13.513 -1.954 1.00 0.00 N
ATOM 637 CA PHE E 54 17.580 14.185 -2.938 1.00 0.00 C
ATOM 638 C PHE E 54 16.606 15.162 -2.418 1.00 0.00 C
ATOM 639 O PHE E 54 16.296 16.122 -3.119 1.00 0.00 O
ATOM 640 CB PHE E 54 16.818 13.151 -3.769 1.00 0.00 C
ATOM 641 CG PHE E 54 17.704 12.148 -4.449 1.00 0.00 C
ATOM 642 CD1 PHE E 54 19.020 12.460 -4.760 1.00 0.00 C
ATOM 643 CD2 PHE E 54 17.225 10.890 -4.781 1.00 0.00 C
ATOM 644 CE1 PHE E 54 19.836 11.538 -5.386 1.00 0.00 C
ATOM 645 CE2 PHE E 54 18.039 9.965 -5.406 1.00 0.00 C
ATOM 646 CZ PHE E 54 19.346 10.290 -5.709 1.00 0.00 C
ATOM 647 H PHE E 54 17.969 12.771 -1.407 1.00 0.00 H
ATOM 648 HA PHE E 54 18.230 14.827 -3.534 1.00 0.00 H
ATOM 649 1HB PHE E 54 16.122 12.611 -3.128 1.00 0.00 H
ATOM 650 2HB PHE E 54 16.231 13.660 -4.533 1.00 0.00 H
ATOM 651 HD1 PHE E 54 19.407 13.447 -4.503 1.00 0.00 H
ATOM 652 HD2 PHE E 54 16.193 10.633 -4.542 1.00 0.00 H
ATOM 653 HE1 PHE E 54 20.867 11.797 -5.624 1.00 0.00 H
ATOM 654 HE2 PHE E 54 17.651 8.979 -5.661 1.00 0.00 H
ATOM 655 HZ PHE E 54 19.989 9.563 -6.203 1.00 0.00 H
ATOM 656 N GLY E 55 16.109 14.920 -1.228 1.00 0.00 N
ATOM 657 CA GLY E 55 15.093 15.827 -0.810 1.00 0.00 C
ATOM 658 C GLY E 55 14.430 15.493 0.473 1.00 0.00 C
ATOM 659 O GLY E 55 14.872 14.677 1.282 1.00 0.00 O
ATOM 660 H GLY E 55 16.382 14.169 -0.610 1.00 0.00 H
ATOM 661 1HA GLY E 55 15.516 16.827 -0.710 1.00 0.00 H
ATOM 662 2HA GLY E 55 14.318 15.882 -1.575 1.00 0.00 H
ATOM 663 N ARG E 56 13.360 16.214 0.645 1.00 0.00 N
ATOM 664 CA ARG E 56 12.622 16.032 1.863 1.00 0.00 C
ATOM 665 C ARG E 56 11.141 16.048 1.688 1.00 0.00 C
ATOM 666 O ARG E 56 10.598 16.680 0.780 1.00 0.00 O
ATOM 667 CB ARG E 56 13.001 17.113 2.865 1.00 0.00 C
ATOM 668 CG ARG E 56 12.656 18.530 2.437 1.00 0.00 C
ATOM 669 CD ARG E 56 13.069 19.528 3.457 1.00 0.00 C
ATOM 670 NE ARG E 56 14.510 19.541 3.650 1.00 0.00 N
ATOM 671 CZ ARG E 56 15.379 20.224 2.880 1.00 0.00 C
ATOM 672 NH1 ARG E 56 14.939 20.943 1.871 1.00 0.00 N
ATOM 673 NH2 ARG E 56 16.674 20.171 3.138 1.00 0.00 N
ATOM 674 H ARG E 56 13.032 16.887 -0.033 1.00 0.00 H
ATOM 675 HA ARG E 56 12.886 15.062 2.286 1.00 0.00 H
ATOM 676 1HB ARG E 56 12.498 16.923 3.812 1.00 0.00 H
ATOM 677 2HB ARG E 56 14.074 17.076 3.051 1.00 0.00 H
ATOM 678 1HG ARG E 56 13.168 18.763 1.503 1.00 0.00 H
ATOM 679 2HG ARG E 56 11.579 18.615 2.291 1.00 0.00 H
ATOM 680 1HD ARG E 56 12.759 20.523 3.140 1.00 0.00 H
ATOM 681 2HD ARG E 56 12.600 19.288 4.411 1.00 0.00 H
ATOM 682 HE ARG E 56 14.887 19.000 4.417 1.00 0.00 H
ATOM 683 1HH1 ARG E 56 13.949 20.983 1.673 1.00 0.00 H
ATOM 684 2HH1 ARG E 56 15.590 21.454 1.293 1.00 0.00 H
ATOM 685 1HH2 ARG E 56 17.013 19.619 3.914 1.00 0.00 H
ATOM 686 2HH2 ARG E 56 17.325 20.683 2.561 1.00 0.00 H
ATOM 687 N VAL E 57 10.513 15.374 2.658 1.00 0.00 N
ATOM 688 CA VAL E 57 9.071 15.276 2.760 1.00 0.00 C
ATOM 689 C VAL E 57 8.495 15.978 3.974 1.00 0.00 C
ATOM 690 O VAL E 57 8.833 15.699 5.132 1.00 0.00 O
ATOM 691 CB VAL E 57 8.657 13.793 2.803 1.00 0.00 C
ATOM 692 CG1 VAL E 57 7.145 13.665 2.923 1.00 0.00 C
ATOM 693 CG2 VAL E 57 9.162 13.078 1.559 1.00 0.00 C
ATOM 694 H VAL E 57 11.087 14.914 3.350 1.00 0.00 H
ATOM 695 HA VAL E 57 8.627 15.792 1.908 1.00 0.00 H
ATOM 696 HB VAL E 57 9.089 13.330 3.690 1.00 0.00 H
ATOM 697 1HG1 VAL E 57 6.870 12.610 2.953 1.00 0.00 H
ATOM 698 2HG1 VAL E 57 6.810 14.152 3.838 1.00 0.00 H
ATOM 699 3HG1 VAL E 57 6.671 14.139 2.064 1.00 0.00 H
ATOM 700 1HG2 VAL E 57 8.866 12.030 1.597 1.00 0.00 H
ATOM 701 2HG2 VAL E 57 8.733 13.545 0.672 1.00 0.00 H
ATOM 702 3HG2 VAL E 57 10.249 13.147 1.516 1.00 0.00 H
ATOM 703 N MET E 58 7.575 16.886 3.695 1.00 50.79 N
ATOM 704 CA MET E 58 6.909 17.597 4.755 1.00 25.02 C
ATOM 705 C MET E 58 5.430 17.324 4.779 1.00 37.66 C
ATOM 706 O MET E 58 4.821 17.130 3.711 1.00 15.48 O
ATOM 707 CB MET E 58 7.054 19.136 4.602 1.00 15.81 C
ATOM 708 CG MET E 58 8.472 19.676 4.727 1.00 25.21 C
ATOM 709 SD MET E 58 8.463 21.425 5.189 1.00 36.97 S
ATOM 710 CE MET E 58 9.807 22.030 4.159 1.00 51.77 C
ATOM 711 H MET E 58 7.330 17.090 2.736 1.00 0.00 H
ATOM 712 HA MET E 58 7.364 17.310 5.703 1.00 0.00 H
ATOM 713 1HB MET E 58 6.676 19.442 3.627 1.00 0.00 H
ATOM 714 2HB MET E 58 6.449 19.636 5.359 1.00 0.00 H
ATOM 715 1HG MET E 58 9.013 19.107 5.483 1.00 0.00 H
ATOM 716 2HG MET E 58 8.991 19.558 3.776 1.00 0.00 H
ATOM 717 1HE MET E 58 9.937 23.100 4.322 1.00 0.00 H
ATOM 718 2HE MET E 58 10.729 21.508 4.419 1.00 0.00 H
ATOM 719 3HE MET E 58 9.571 21.849 3.110 1.00 0.00 H
ATOM 720 N LEU E 59 4.891 17.353 6.023 1.00 28.68 N
ATOM 721 CA LEU E 59 3.460 17.225 6.302 1.00 22.25 C
ATOM 722 C LEU E 59 2.970 18.619 5.971 1.00 56.39 C
ATOM 723 O LEU E 59 3.511 19.585 6.489 1.00 17.19 O
ATOM 724 CB LEU E 59 3.145 17.045 7.794 1.00 16.75 C
ATOM 725 CG LEU E 59 1.884 16.227 8.070 1.00 23.26 C
ATOM 726 CD1 LEU E 59 1.356 16.551 9.462 1.00 15.32 C
ATOM 727 CD2 LEU E 59 0.815 16.448 7.004 1.00 34.97 C
ATOM 728 H LEU E 59 5.534 17.471 6.793 1.00 0.00 H
ATOM 729 HA LEU E 59 3.084 16.343 5.784 1.00 0.00 H
ATOM 730 1HB LEU E 59 3.990 16.550 8.270 1.00 0.00 H
ATOM 731 2HB LEU E 59 3.025 18.030 8.245 1.00 0.00 H
ATOM 732 HG LEU E 59 2.135 15.166 8.086 1.00 0.00 H
ATOM 733 1HD1 LEU E 59 0.457 15.966 9.655 1.00 0.00 H
ATOM 734 2HD1 LEU E 59 2.115 16.305 10.205 1.00 0.00 H
ATOM 735 3HD1 LEU E 59 1.118 17.612 9.523 1.00 0.00 H
ATOM 736 1HD2 LEU E 59 -0.064 15.847 7.239 1.00 0.00 H
ATOM 737 2HD2 LEU E 59 0.538 17.502 6.980 1.00 0.00 H
ATOM 738 3HD2 LEU E 59 1.206 16.153 6.030 1.00 0.00 H
ATOM 739 N VAL E 60 1.991 18.734 5.099 1.00 30.65 N
ATOM 740 CA VAL E 60 1.499 20.021 4.669 1.00 12.39 C
ATOM 741 C VAL E 60 -0.015 20.073 4.790 1.00 12.94 C
ATOM 742 O VAL E 60 -0.677 19.066 5.051 1.00 34.70 O
ATOM 743 CB VAL E 60 1.988 20.193 3.242 1.00 13.97 C
ATOM 744 CG1 VAL E 60 0.871 20.146 2.218 1.00 20.12 C
ATOM 745 CG2 VAL E 60 2.938 21.371 3.082 1.00 32.94 C
ATOM 746 H VAL E 60 1.573 17.896 4.721 1.00 0.00 H
ATOM 747 HA VAL E 60 1.921 20.788 5.320 1.00 0.00 H
ATOM 748 HB VAL E 60 2.516 19.289 2.937 1.00 0.00 H
ATOM 749 1HG1 VAL E 60 1.288 20.275 1.219 1.00 0.00 H
ATOM 750 2HG1 VAL E 60 0.363 19.184 2.278 1.00 0.00 H
ATOM 751 3HG1 VAL E 60 0.159 20.946 2.419 1.00 0.00 H
ATOM 752 1HG2 VAL E 60 3.255 21.444 2.042 1.00 0.00 H
ATOM 753 2HG2 VAL E 60 2.430 22.291 3.372 1.00 0.00 H
ATOM 754 3HG2 VAL E 60 3.811 21.223 3.718 1.00 0.00 H
ATOM 755 N LYS E 61 -0.576 21.244 4.658 1.00 45.19 N
ATOM 756 CA LYS E 61 -1.999 21.268 4.785 1.00 17.44 C
ATOM 757 C LYS E 61 -2.613 22.145 3.768 1.00 38.97 C
ATOM 758 O LYS E 61 -2.231 23.305 3.632 1.00 19.65 O
ATOM 759 CB LYS E 61 -2.476 21.658 6.153 1.00 56.87 C
ATOM 760 CG LYS E 61 -3.942 22.008 6.128 1.00 22.06 C
ATOM 761 CD LYS E 61 -4.656 21.608 7.404 1.00 29.13 C
ATOM 762 CE LYS E 61 -5.614 22.683 7.901 1.00 78.18 C
ATOM 763 NZ LYS E 61 -6.933 22.157 8.281 1.00100.00 N
ATOM 764 H LYS E 61 -0.084 22.107 4.477 1.00 0.00 H
ATOM 765 HA LYS E 61 -2.381 20.266 4.587 1.00 0.00 H
ATOM 766 1HB LYS E 61 -2.305 20.834 6.847 1.00 0.00 H
ATOM 767 2HB LYS E 61 -1.899 22.511 6.510 1.00 0.00 H
ATOM 768 1HG LYS E 61 -4.057 23.084 5.993 1.00 0.00 H
ATOM 769 2HG LYS E 61 -4.423 21.501 5.292 1.00 0.00 H
ATOM 770 1HD LYS E 61 -5.225 20.694 7.231 1.00 0.00 H
ATOM 771 2HD LYS E 61 -3.922 21.416 8.187 1.00 0.00 H
ATOM 772 1HE LYS E 61 -5.184 23.179 8.770 1.00 0.00 H
ATOM 773 2HE LYS E 61 -5.760 23.429 7.120 1.00 0.00 H
ATOM 774 1HZ LYS E 61 -7.519 22.915 8.600 1.00 0.00 H
ATOM 775 2HZ LYS E 61 -7.362 21.713 7.481 1.00 0.00 H
ATOM 776 3HZ LYS E 61 -6.825 21.481 9.023 1.00 0.00 H
ATOM 777 N HIS E 62 -3.558 21.563 3.068 1.00 20.49 N
ATOM 778 CA HIS E 62 -4.287 22.274 2.049 1.00 32.78 C
ATOM 779 C HIS E 62 -5.327 23.145 2.753 1.00100.00 C
ATOM 780 O HIS E 62 -6.306 22.608 3.278 1.00 35.11 O
ATOM 781 CB HIS E 62 -4.983 21.244 1.177 1.00 59.32 C
ATOM 782 CG HIS E 62 -5.247 21.805 -0.151 1.00 18.49 C
ATOM 783 ND1 HIS E 62 -4.278 22.539 -0.812 1.00100.00 N
ATOM 784 CD2 HIS E 62 -6.365 21.750 -0.910 1.00 32.86 C
ATOM 785 CE1 HIS E 62 -4.809 22.908 -1.964 1.00 17.49 C
ATOM 786 NE2 HIS E 62 -6.060 22.458 -2.058 1.00 32.28 N
ATOM 787 H HIS E 62 -3.780 20.594 3.247 1.00 0.00 H
ATOM 788 HA HIS E 62 -3.592 22.855 1.443 1.00 0.00 H
ATOM 789 1HB HIS E 62 -4.356 20.356 1.091 1.00 0.00 H
ATOM 790 2HB HIS E 62 -5.917 20.940 1.648 1.00 0.00 H
ATOM 791 HD2 HIS E 62 -7.312 21.259 -0.685 1.00 0.00 H
ATOM 792 HE1 HIS E 62 -4.312 23.494 -2.736 1.00 0.00 H
ATOM 793 HE2 HIS E 62 -6.685 22.607 -2.838 1.00 0.00 H
ATOM 794 N LYS E 63 -5.101 24.469 2.779 1.00 24.56 N
ATOM 795 CA LYS E 63 -5.976 25.416 3.467 1.00 42.95 C
ATOM 796 C LYS E 63 -7.422 25.542 2.999 1.00 24.60 C
ATOM 797 O LYS E 63 -8.347 25.593 3.822 1.00 52.17 O
ATOM 798 CB LYS E 63 -5.332 26.714 3.940 1.00 71.17 C
ATOM 799 CG LYS E 63 -5.628 27.869 3.001 1.00 55.27 C
ATOM 800 CD LYS E 63 -4.427 28.721 2.579 1.00100.00 C
ATOM 801 CE LYS E 63 -3.076 28.330 3.175 1.00 30.39 C
ATOM 802 NZ LYS E 63 -2.231 29.488 3.459 1.00 73.53 N
ATOM 803 H LYS E 63 -4.284 24.815 2.296 1.00 0.00 H
ATOM 804 HA LYS E 63 -6.367 24.936 4.365 1.00 0.00 H
ATOM 805 1HB LYS E 63 -5.699 26.960 4.937 1.00 0.00 H
ATOM 806 2HB LYS E 63 -4.253 26.579 4.012 1.00 0.00 H
ATOM 807 1HG LYS E 63 -6.073 27.486 2.082 1.00 0.00 H
ATOM 808 2HG LYS E 63 -6.338 28.548 3.472 1.00 0.00 H
ATOM 809 1HD LYS E 63 -4.311 28.675 1.495 1.00 0.00 H
ATOM 810 2HD LYS E 63 -4.599 29.759 2.864 1.00 0.00 H
ATOM 811 1HE LYS E 63 -3.233 27.782 4.103 1.00 0.00 H
ATOM 812 2HE LYS E 63 -2.546 27.679 2.479 1.00 0.00 H
ATOM 813 1HZ LYS E 63 -1.353 29.177 3.850 1.00 0.00 H
ATOM 814 2HZ LYS E 63 -2.057 29.997 2.603 1.00 0.00 H
ATOM 815 3HZ LYS E 63 -2.698 30.092 4.120 1.00 0.00 H
ATOM 816 N GLU E 64 -7.616 25.600 1.698 1.00 31.05 N
ATOM 817 CA GLU E 64 -8.938 25.698 1.096 1.00 61.85 C
ATOM 818 C GLU E 64 -9.764 24.456 1.456 1.00 69.18 C
ATOM 819 O GLU E 64 -10.948 24.554 1.789 1.00 52.73 O
ATOM 820 CB GLU E 64 -8.842 25.944 -0.431 1.00 90.67 C
ATOM 821 CG GLU E 64 -7.567 25.349 -1.092 1.00100.00 C
ATOM 822 CD GLU E 64 -6.236 25.954 -0.671 1.00100.00 C
ATOM 823 OE1 GLU E 64 -5.816 27.035 -1.070 1.00100.00 O
ATOM 824 OE2 GLU E 64 -5.584 25.189 0.186 1.00 90.42 O
ATOM 825 H GLU E 64 -6.803 25.575 1.099 1.00 0.00 H
ATOM 826 HA GLU E 64 -9.462 26.542 1.546 1.00 0.00 H
ATOM 827 1HB GLU E 64 -9.711 25.510 -0.925 1.00 0.00 H
ATOM 828 2HB GLU E 64 -8.855 27.016 -0.628 1.00 0.00 H
ATOM 829 1HG GLU E 64 -7.517 24.284 -0.866 1.00 0.00 H
ATOM 830 2HG GLU E 64 -7.645 25.460 -2.173 1.00 0.00 H
ATOM 831 N SER E 65 -9.096 23.284 1.414 1.00 34.39 N
ATOM 832 CA SER E 65 -9.661 21.952 1.737 1.00 15.95 C
ATOM 833 C SER E 65 -9.592 21.514 3.227 1.00 27.46 C
ATOM 834 O SER E 65 -10.557 21.015 3.789 1.00 36.39 O
ATOM 835 CB SER E 65 -8.964 20.879 0.900 1.00 69.03 C
ATOM 836 OG SER E 65 -8.199 20.027 1.738 1.00 46.76 O
ATOM 837 H SER E 65 -8.128 23.353 1.134 1.00 0.00 H
ATOM 838 HA SER E 65 -10.724 21.958 1.492 1.00 0.00 H
ATOM 839 1HB SER E 65 -9.710 20.299 0.357 1.00 0.00 H
ATOM 840 2HB SER E 65 -8.320 21.355 0.162 1.00 0.00 H
ATOM 841 HG SER E 65 -8.322 20.355 2.632 1.00 0.00 H
ATOM 842 N GLY E 66 -8.432 21.656 3.877 1.00 25.32 N
ATOM 843 CA GLY E 66 -8.294 21.240 5.266 1.00 25.70 C
ATOM 844 C GLY E 66 -7.734 19.818 5.345 1.00 38.36 C
ATOM 845 O GLY E 66 -7.767 19.132 6.362 1.00 23.18 O
ATOM 846 H GLY E 66 -7.636 22.057 3.402 1.00 0.00 H
ATOM 847 1HA GLY E 66 -7.634 21.932 5.789 1.00 0.00 H
ATOM 848 2HA GLY E 66 -9.265 21.288 5.758 1.00 0.00 H
ATOM 849 N ASN E 67 -7.219 19.370 4.222 1.00 37.06 N
ATOM 850 CA ASN E 67 -6.657 18.056 4.121 1.00 42.98 C
ATOM 851 C ASN E 67 -5.171 18.104 4.319 1.00 38.14 C
ATOM 852 O ASN E 67 -4.483 19.089 4.003 1.00 31.48 O
ATOM 853 CB ASN E 67 -6.925 17.453 2.724 1.00 41.51 C
ATOM 854 CG ASN E 67 -8.341 16.938 2.570 1.00 54.12 C
ATOM 855 OD1 ASN E 67 -8.955 16.520 3.549 1.00 37.23 O
ATOM 856 ND2 ASN E 67 -8.871 16.954 1.352 1.00 30.12 N
ATOM 857 H ASN E 67 -7.220 19.969 3.409 1.00 0.00 H
ATOM 858 HA ASN E 67 -7.130 17.419 4.870 1.00 0.00 H
ATOM 859 1HB ASN E 67 -6.742 18.210 1.960 1.00 0.00 H
ATOM 860 2HB ASN E 67 -6.232 16.631 2.543 1.00 0.00 H
ATOM 861 1HD2 ASN E 67 -9.804 16.622 1.208 1.00 0.00 H
ATOM 862 2HD2 ASN E 67 -8.338 17.297 0.579 1.00 0.00 H
ATOM 863 N HIS E 68 -4.661 17.016 4.850 1.00 25.44 N
ATOM 864 CA HIS E 68 -3.237 16.961 5.011 1.00 25.79 C
ATOM 865 C HIS E 68 -2.715 16.141 3.859 1.00 20.77 C
ATOM 866 O HIS E 68 -3.452 15.333 3.304 1.00 35.20 O
ATOM 867 CB HIS E 68 -2.770 16.341 6.300 1.00 13.68 C
ATOM 868 CG HIS E 68 -3.211 17.059 7.504 1.00 46.12 C
ATOM 869 ND1 HIS E 68 -2.392 17.993 8.107 1.00 45.15 N
ATOM 870 CD2 HIS E 68 -4.370 16.956 8.208 1.00 38.02 C
ATOM 871 CE1 HIS E 68 -3.062 18.457 9.153 1.00 4.36 C
ATOM 872 NE2 HIS E 68 -4.257 17.858 9.231 1.00 32.68 N
ATOM 873 H HIS E 68 -5.220 16.229 5.145 1.00 0.00 H
ATOM 874 HA HIS E 68 -2.831 17.972 5.001 1.00 0.00 H
ATOM 875 1HB HIS E 68 -3.136 15.316 6.365 1.00 0.00 H
ATOM 876 2HB HIS E 68 -1.681 16.301 6.311 1.00 0.00 H
ATOM 877 HD2 HIS E 68 -5.227 16.313 8.004 1.00 0.00 H
ATOM 878 HE1 HIS E 68 -2.707 19.213 9.853 1.00 0.00 H
ATOM 879 HE2 HIS E 68 -4.964 18.039 9.929 1.00 0.00 H
ATOM 880 N TYR E 69 -1.456 16.370 3.514 1.00 23.18 N
ATOM 881 CA TYR E 69 -0.774 15.681 2.437 1.00 10.13 C
ATOM 882 C TYR E 69 0.711 15.579 2.749 1.00 24.72 C
ATOM 883 O TYR E 69 1.180 16.108 3.741 1.00 24.10 O
ATOM 884 CB TYR E 69 -0.950 16.421 1.098 1.00100.00 C
ATOM 885 CG TYR E 69 -2.369 16.470 0.581 1.00 43.84 C
ATOM 886 CD1 TYR E 69 -3.038 15.296 0.231 1.00 20.37 C
ATOM 887 CD2 TYR E 69 -3.036 17.692 0.444 1.00 40.74 C
ATOM 888 CE1 TYR E 69 -4.349 15.344 -0.247 1.00 54.87 C
ATOM 889 CE2 TYR E 69 -4.344 17.757 -0.040 1.00 17.63 C
ATOM 890 CZ TYR E 69 -4.999 16.574 -0.383 1.00 22.97 C
ATOM 891 OH TYR E 69 -6.285 16.625 -0.858 1.00 57.09 O
ATOM 892 H TYR E 69 -0.957 17.070 4.044 1.00 0.00 H
ATOM 893 HA TYR E 69 -1.206 14.685 2.335 1.00 0.00 H
ATOM 894 1HB TYR E 69 -0.601 17.449 1.202 1.00 0.00 H
ATOM 895 2HB TYR E 69 -0.337 15.942 0.335 1.00 0.00 H
ATOM 896 HD1 TYR E 69 -2.537 14.333 0.330 1.00 0.00 H
ATOM 897 HD2 TYR E 69 -2.534 18.620 0.717 1.00 0.00 H
ATOM 898 HE1 TYR E 69 -4.864 14.423 -0.518 1.00 0.00 H
ATOM 899 HE2 TYR E 69 -4.839 18.723 -0.146 1.00 0.00 H
ATOM 900 HH TYR E 69 -6.577 17.539 -0.890 1.00 0.00 H
ATOM 901 N ALA E 70 1.453 14.906 1.887 1.00 63.87 N
ATOM 902 CA ALA E 70 2.883 14.770 2.074 1.00 19.38 C
ATOM 903 C ALA E 70 3.591 15.537 0.984 1.00 32.32 C
ATOM 904 O ALA E 70 3.497 15.137 -0.156 1.00 20.98 O
ATOM 905 CB ALA E 70 3.300 13.315 1.951 1.00 25.42 C
ATOM 906 H ALA E 70 1.019 14.477 1.082 1.00 0.00 H
ATOM 907 HA ALA E 70 3.129 15.123 3.076 1.00 0.00 H
ATOM 908 1HB ALA E 70 4.377 13.232 2.094 1.00 0.00 H
ATOM 909 2HB ALA E 70 2.786 12.724 2.709 1.00 0.00 H
ATOM 910 3HB ALA E 70 3.036 12.944 0.962 1.00 0.00 H
ATOM 911 N MET E 71 4.296 16.627 1.295 1.00 34.27 N
ATOM 912 CA MET E 71 4.971 17.359 0.214 1.00 10.51 C
ATOM 913 C MET E 71 6.437 17.026 0.001 1.00 66.04 C
ATOM 914 O MET E 71 7.265 17.210 0.884 1.00 14.10 O
ATOM 915 CB MET E 71 4.819 18.880 0.325 1.00 27.01 C
ATOM 916 CG MET E 71 5.309 19.650 -0.898 1.00 15.78 C
ATOM 917 SD MET E 71 5.246 21.433 -0.548 1.00 37.02 S
ATOM 918 CE MET E 71 3.507 21.692 -0.939 1.00 25.74 C
ATOM 919 H MET E 71 4.380 16.963 2.244 1.00 0.00 H
ATOM 920 HA MET E 71 4.529 17.058 -0.736 1.00 0.00 H
ATOM 921 1HB MET E 71 3.771 19.130 0.481 1.00 0.00 H
ATOM 922 2HB MET E 71 5.374 19.239 1.193 1.00 0.00 H
ATOM 923 1HG MET E 71 6.329 19.348 -1.133 1.00 0.00 H
ATOM 924 2HG MET E 71 4.678 19.413 -1.754 1.00 0.00 H
ATOM 925 1HE MET E 71 3.253 22.741 -0.788 1.00 0.00 H
ATOM 926 2HE MET E 71 3.323 21.419 -1.979 1.00 0.00 H
ATOM 927 3HE MET E 71 2.891 21.072 -0.287 1.00 0.00 H
ATOM 928 N LYS E 72 6.763 16.558 -1.203 1.00 0.00 N
ATOM 929 CA LYS E 72 8.141 16.240 -1.519 1.00 0.00 C
ATOM 930 C LYS E 72 8.778 17.433 -2.258 1.00 0.00 C
ATOM 931 O LYS E 72 8.343 17.822 -3.350 1.00 0.00 O
ATOM 932 CB LYS E 72 8.223 14.966 -2.361 1.00 0.00 C
ATOM 933 CG LYS E 72 9.640 14.535 -2.714 1.00 0.00 C
ATOM 934 CD LYS E 72 10.319 13.852 -1.536 1.00 0.00 C
ATOM 935 CE LYS E 72 11.713 13.366 -1.905 1.00 0.00 C
ATOM 936 NZ LYS E 72 11.669 12.181 -2.805 1.00 0.00 N
ATOM 937 H LYS E 72 6.052 16.420 -1.907 1.00 0.00 H
ATOM 938 HA LYS E 72 8.723 16.270 -0.597 1.00 0.00 H
ATOM 939 1HB LYS E 72 7.746 14.144 -1.826 1.00 0.00 H
ATOM 940 2HB LYS E 72 7.675 15.110 -3.293 1.00 0.00 H
ATOM 941 1HG LYS E 72 9.611 13.843 -3.557 1.00 0.00 H
ATOM 942 2HG LYS E 72 10.225 15.407 -3.003 1.00 0.00 H
ATOM 943 1HD LYS E 72 10.396 14.552 -0.704 1.00 0.00 H
ATOM 944 2HD LYS E 72 9.720 12.999 -1.216 1.00 0.00 H
ATOM 945 1HE LYS E 72 12.256 14.166 -2.404 1.00 0.00 H
ATOM 946 2HE LYS E 72 12.256 13.097 -0.999 1.00 0.00 H
ATOM 947 1HZ LYS E 72 12.611 11.891 -3.025 1.00 0.00 H
ATOM 948 2HZ LYS E 72 11.183 11.425 -2.344 1.00 0.00 H
ATOM 949 3HZ LYS E 72 11.184 12.423 -3.657 1.00 0.00 H
ATOM 950 N ILE E 73 9.796 18.036 -1.605 1.00 13.87 N
ATOM 951 CA ILE E 73 10.500 19.167 -2.154 1.00 16.34 C
ATOM 952 C ILE E 73 11.843 18.759 -2.724 1.00 36.20 C
ATOM 953 O ILE E 73 12.604 18.077 -2.062 1.00 25.64 O
ATOM 954 CB ILE E 73 10.745 20.147 -1.045 1.00 10.90 C
ATOM 955 CG1 ILE E 73 9.466 20.240 -0.225 1.00 13.53 C
ATOM 956 CG2 ILE E 73 11.117 21.494 -1.628 1.00 45.65 C
ATOM 957 CD1 ILE E 73 9.538 21.094 1.013 1.00 22.75 C
ATOM 958 H ILE E 73 10.069 17.678 -0.701 1.00 0.00 H
ATOM 959 HA ILE E 73 9.875 19.625 -2.919 1.00 0.00 H
ATOM 960 HB ILE E 73 11.559 19.788 -0.416 1.00 0.00 H
ATOM 961 1HG1 ILE E 73 8.665 20.641 -0.845 1.00 0.00 H
ATOM 962 2HG1 ILE E 73 9.164 19.242 0.093 1.00 0.00 H
ATOM 963 1HG2 ILE E 73 11.294 22.204 -0.820 1.00 0.00 H
ATOM 964 2HG2 ILE E 73 12.021 21.394 -2.227 1.00 0.00 H
ATOM 965 3HG2 ILE E 73 10.303 21.856 -2.257 1.00 0.00 H
ATOM 966 1HD1 ILE E 73 8.571 21.086 1.517 1.00 0.00 H
ATOM 967 2HD1 ILE E 73 10.301 20.698 1.685 1.00 0.00 H
ATOM 968 3HD1 ILE E 73 9.793 22.116 0.736 1.00 0.00 H
ATOM 969 N LEU E 74 12.138 19.179 -3.948 1.00 0.00 N
ATOM 970 CA LEU E 74 13.413 18.868 -4.550 1.00 0.00 C
ATOM 971 C LEU E 74 14.082 20.186 -4.941 1.00 0.00 C
ATOM 972 O LEU E 74 13.493 20.978 -5.679 1.00 0.00 O
ATOM 973 CB LEU E 74 13.232 17.964 -5.776 1.00 0.00 C
ATOM 974 CG LEU E 74 12.592 16.597 -5.505 1.00 0.00 C
ATOM 975 CD1 LEU E 74 12.337 15.884 -6.827 1.00 0.00 C
ATOM 976 CD2 LEU E 74 13.507 15.776 -4.609 1.00 0.00 C
ATOM 977 H LEU E 74 11.467 19.723 -4.471 1.00 0.00 H
ATOM 978 HA LEU E 74 14.000 18.291 -3.837 1.00 0.00 H
ATOM 979 1HB LEU E 74 12.609 18.484 -6.502 1.00 0.00 H
ATOM 980 2HB LEU E 74 14.209 17.789 -6.226 1.00 0.00 H
ATOM 981 HG LEU E 74 11.630 16.737 -5.012 1.00 0.00 H
ATOM 982 1HD1 LEU E 74 11.882 14.912 -6.635 1.00 0.00 H
ATOM 983 2HD1 LEU E 74 11.665 16.484 -7.440 1.00 0.00 H
ATOM 984 3HD1 LEU E 74 13.281 15.744 -7.352 1.00 0.00 H
ATOM 985 1HD2 LEU E 74 13.051 14.804 -4.416 1.00 0.00 H
ATOM 986 2HD2 LEU E 74 14.468 15.634 -5.102 1.00 0.00 H
ATOM 987 3HD2 LEU E 74 13.657 16.300 -3.665 1.00 0.00 H
ATOM 988 N ASP E 75 15.327 20.402 -4.473 1.00 26.82 N
ATOM 989 CA ASP E 75 16.034 21.616 -4.834 1.00 25.35 C
ATOM 990 C ASP E 75 16.564 21.411 -6.199 1.00 17.08 C