REMARK ID 14032 MODEL 1 SSGCID - MygeA.18852.a 30S ribosomal protein S14 type Z MG_164 PFRMAT TS TARGET SSGCID - MygeA.18852.a 30S ribosomal protein S14 type Z MG_164 AUTHOR BAKER-ROSETTASERVER METHOD ROSETTA provides both ab initio and METHOD comparative models of protein domains. METHOD Comparative models are built from structures METHOD detected and aligned by HHSEARCH, SPARKS, and METHOD Raptor. Loop regions are assembled from fragments and METHOD optimized to fit the aligned template structures. METHOD De novo models are built using the Rosetta de METHOD novo protocol. The procedure is fully automated. MODEL 1 PARENT 3j9mAK_305 REMARK PARENT 3j9mAK_305 REMARK PARSRC alignment REMARK SCORE 0.81 ATOM 1 N MET A 1 -6.208 -14.802 -11.495 1.00 4.220 N ATOM 2 CA MET A 1 -5.947 -15.020 -10.076 1.00 3.750 C ATOM 3 C MET A 1 -6.950 -14.284 -9.207 1.00 2.790 C ATOM 4 O MET A 1 -7.152 -13.075 -9.350 1.00 2.680 O ATOM 5 CB MET A 1 -4.538 -14.567 -9.699 1.00 5.440 C ATOM 6 CG MET A 1 -4.148 -14.823 -8.213 1.00 5.440 C ATOM 7 SD MET A 1 -2.469 -14.295 -7.828 1.00 5.440 S ATOM 8 CE MET A 1 -2.689 -12.525 -7.721 1.00 5.440 C ATOM 9 1H MET A 1 -5.339 -14.618 -11.977 1.00 5.060 H ATOM 10 2H MET A 1 -6.643 -15.624 -11.890 1.00 5.060 H ATOM 11 3H MET A 1 -6.826 -14.010 -11.604 1.00 5.060 H ATOM 12 HA MET A 1 -6.045 -16.085 -9.865 1.00 4.500 H ATOM 13 1HB MET A 1 -3.811 -15.084 -10.325 1.00 6.530 H ATOM 14 2HB MET A 1 -4.445 -13.505 -9.904 1.00 6.530 H ATOM 15 1HG MET A 1 -4.823 -14.281 -7.550 1.00 6.530 H ATOM 16 2HG MET A 1 -4.232 -15.886 -7.986 1.00 6.530 H ATOM 17 1HE MET A 1 -1.741 -12.059 -7.522 1.00 6.530 H ATOM 18 2HE MET A 1 -3.069 -12.133 -8.656 1.00 6.530 H ATOM 19 3HE MET A 1 -3.383 -12.291 -6.918 1.00 6.530 H ATOM 20 N ALA A 2 -7.552 -14.992 -8.258 1.00 2.520 N ATOM 21 CA ALA A 2 -8.518 -14.374 -7.349 1.00 1.890 C ATOM 22 C ALA A 2 -7.771 -13.581 -6.283 1.00 1.320 C ATOM 23 O ALA A 2 -7.681 -13.995 -5.121 1.00 1.570 O ATOM 24 CB ALA A 2 -9.397 -15.431 -6.699 1.00 2.900 C ATOM 25 H ALA A 2 -7.352 -15.979 -8.164 1.00 3.020 H ATOM 26 HA ALA A 2 -9.142 -13.686 -7.919 1.00 2.270 H ATOM 27 1HB ALA A 2 -10.113 -14.948 -6.034 1.00 3.480 H ATOM 28 2HB ALA A 2 -9.933 -15.982 -7.470 1.00 3.480 H ATOM 29 3HB ALA A 2 -8.777 -16.117 -6.125 1.00 3.480 H ATOM 30 N LYS A 3 -7.222 -12.451 -6.709 1.00 0.910 N ATOM 31 CA LYS A 3 -6.386 -11.609 -5.876 1.00 0.890 C ATOM 32 C LYS A 3 -7.052 -11.154 -4.595 1.00 0.830 C ATOM 33 O LYS A 3 -6.394 -11.101 -3.559 1.00 0.820 O ATOM 34 CB LYS A 3 -5.915 -10.377 -6.652 1.00 1.250 C ATOM 35 CG LYS A 3 -4.978 -9.452 -5.855 1.00 1.250 C ATOM 36 CD LYS A 3 -4.492 -8.265 -6.696 1.00 1.250 C ATOM 37 CE LYS A 3 -3.597 -7.327 -5.877 1.00 1.250 C ATOM 38 NZ LYS A 3 -3.215 -6.098 -6.641 1.00 1.250 N ATOM 39 H LYS A 3 -7.351 -12.234 -7.700 1.00 1.090 H ATOM 40 HA LYS A 3 -5.506 -12.190 -5.598 1.00 1.070 H ATOM 41 1HB LYS A 3 -5.393 -10.697 -7.556 1.00 1.500 H ATOM 42 2HB LYS A 3 -6.779 -9.791 -6.963 1.00 1.500 H ATOM 43 1HG LYS A 3 -5.499 -9.059 -4.980 1.00 1.500 H ATOM 44 2HG LYS A 3 -4.129 -10.028 -5.511 1.00 1.500 H ATOM 45 1HD LYS A 3 -3.916 -8.638 -7.549 1.00 1.500 H ATOM 46 2HD LYS A 3 -5.349 -7.707 -7.071 1.00 1.500 H ATOM 47 1HE LYS A 3 -4.122 -7.033 -4.971 1.00 1.500 H ATOM 48 2HE LYS A 3 -2.688 -7.859 -5.601 1.00 1.500 H ATOM 49 1HZ LYS A 3 -2.624 -5.512 -6.057 1.00 1.500 H ATOM 50 2HZ LYS A 3 -2.716 -6.352 -7.487 1.00 1.500 H ATOM 51 3HZ LYS A 3 -4.047 -5.585 -6.891 1.00 1.500 H ATOM 52 N LYS A 4 -8.324 -10.756 -4.651 1.00 0.980 N ATOM 53 CA LYS A 4 -8.963 -10.251 -3.440 1.00 1.140 C ATOM 54 C LYS A 4 -9.032 -11.319 -2.371 1.00 1.090 C ATOM 55 O LYS A 4 -8.669 -11.077 -1.220 1.00 1.060 O ATOM 56 CB LYS A 4 -10.366 -9.717 -3.718 1.00 1.530 C ATOM 57 CG LYS A 4 -11.067 -9.148 -2.473 1.00 1.530 C ATOM 58 CD LYS A 4 -12.435 -8.567 -2.807 1.00 1.530 C ATOM 59 CE LYS A 4 -13.131 -8.041 -1.554 1.00 1.530 C ATOM 60 NZ LYS A 4 -14.475 -7.468 -1.859 1.00 1.530 N ATOM 61 H LYS A 4 -8.824 -10.817 -5.527 1.00 1.180 H ATOM 62 HA LYS A 4 -8.357 -9.433 -3.049 1.00 1.370 H ATOM 63 1HB LYS A 4 -10.313 -8.929 -4.469 1.00 1.840 H ATOM 64 2HB LYS A 4 -10.989 -10.515 -4.120 1.00 1.840 H ATOM 65 1HG LYS A 4 -11.198 -9.938 -1.730 1.00 1.840 H ATOM 66 2HG LYS A 4 -10.443 -8.369 -2.035 1.00 1.840 H ATOM 67 1HD LYS A 4 -12.322 -7.750 -3.522 1.00 1.840 H ATOM 68 2HD LYS A 4 -13.056 -9.340 -3.259 1.00 1.840 H ATOM 69 1HE LYS A 4 -13.248 -8.858 -0.843 1.00 1.840 H ATOM 70 2HE LYS A 4 -12.512 -7.266 -1.101 1.00 1.840 H ATOM 71 1HZ LYS A 4 -14.900 -7.132 -1.005 1.00 1.840 H ATOM 72 2HZ LYS A 4 -14.377 -6.700 -2.509 1.00 1.840 H ATOM 73 3HZ LYS A 4 -15.063 -8.180 -2.268 1.00 1.840 H ATOM 74 N SER A 5 -9.498 -12.504 -2.757 1.00 1.180 N ATOM 75 CA SER A 5 -9.644 -13.603 -1.825 1.00 1.260 C ATOM 76 C SER A 5 -8.299 -13.982 -1.242 1.00 0.980 C ATOM 77 O SER A 5 -8.181 -14.218 -0.034 1.00 0.950 O ATOM 78 CB SER A 5 -10.228 -14.810 -2.541 1.00 1.730 C ATOM 79 OG SER A 5 -11.538 -14.565 -2.985 1.00 1.730 O ATOM 80 H SER A 5 -9.789 -12.630 -3.712 1.00 1.420 H ATOM 81 HA SER A 5 -10.306 -13.294 -1.016 1.00 1.510 H ATOM 82 1HB SER A 5 -9.594 -15.063 -3.392 1.00 2.080 H ATOM 83 2HB SER A 5 -10.223 -15.664 -1.867 1.00 2.080 H ATOM 84 HG SER A 5 -11.841 -15.389 -3.376 1.00 2.080 H ATOM 85 N LEU A 6 -7.266 -14.004 -2.086 1.00 0.830 N ATOM 86 CA LEU A 6 -5.945 -14.353 -1.614 1.00 0.680 C ATOM 87 C LEU A 6 -5.426 -13.309 -0.641 1.00 0.450 C ATOM 88 O LEU A 6 -4.894 -13.672 0.408 1.00 0.470 O ATOM 89 CB LEU A 6 -5.003 -14.558 -2.807 1.00 1.010 C ATOM 90 CG LEU A 6 -3.504 -14.894 -2.511 1.00 1.010 C ATOM 91 CD1 LEU A 6 -3.366 -16.177 -1.666 1.00 1.010 C ATOM 92 CD2 LEU A 6 -2.797 -15.072 -3.865 1.00 1.010 C ATOM 93 H LEU A 6 -7.410 -13.814 -3.084 1.00 1.000 H ATOM 94 HA LEU A 6 -6.026 -15.297 -1.085 1.00 0.820 H ATOM 95 1HB LEU A 6 -5.409 -15.353 -3.428 1.00 1.210 H ATOM 96 2HB LEU A 6 -5.016 -13.640 -3.398 1.00 1.210 H ATOM 97 HG LEU A 6 -3.046 -14.067 -1.964 1.00 1.210 H ATOM 98 1HD1 LEU A 6 -2.306 -16.380 -1.491 1.00 1.210 H ATOM 99 2HD1 LEU A 6 -3.861 -16.051 -0.704 1.00 1.210 H ATOM 100 3HD1 LEU A 6 -3.813 -17.016 -2.195 1.00 1.210 H ATOM 101 1HD2 LEU A 6 -1.735 -15.278 -3.710 1.00 1.210 H ATOM 102 2HD2 LEU A 6 -3.251 -15.896 -4.415 1.00 1.210 H ATOM 103 3HD2 LEU A 6 -2.909 -14.160 -4.443 1.00 1.210 H ATOM 104 N LYS A 7 -5.575 -12.020 -0.963 1.00 0.490 N ATOM 105 CA LYS A 7 -5.111 -10.970 -0.071 1.00 0.650 C ATOM 106 C LYS A 7 -5.770 -11.102 1.295 1.00 0.690 C ATOM 107 O LYS A 7 -5.099 -11.009 2.332 1.00 0.770 O ATOM 108 CB LYS A 7 -5.406 -9.591 -0.670 1.00 0.850 C ATOM 109 CG LYS A 7 -4.925 -8.396 0.166 1.00 0.850 C ATOM 110 CD LYS A 7 -5.212 -7.072 -0.551 1.00 0.850 C ATOM 111 CE LYS A 7 -4.786 -5.873 0.290 1.00 0.850 C ATOM 112 NZ LYS A 7 -5.069 -4.578 -0.395 1.00 0.850 N ATOM 113 H LYS A 7 -6.000 -11.758 -1.858 1.00 0.590 H ATOM 114 HA LYS A 7 -4.035 -11.076 0.058 1.00 0.780 H ATOM 115 1HB LYS A 7 -4.951 -9.525 -1.659 1.00 1.020 H ATOM 116 2HB LYS A 7 -6.485 -9.491 -0.811 1.00 1.020 H ATOM 117 1HG LYS A 7 -5.442 -8.395 1.129 1.00 1.020 H ATOM 118 2HG LYS A 7 -3.855 -8.488 0.349 1.00 1.020 H ATOM 119 1HD LYS A 7 -4.675 -7.051 -1.502 1.00 1.020 H ATOM 120 2HD LYS A 7 -6.280 -7.002 -0.757 1.00 1.020 H ATOM 121 1HE LYS A 7 -5.323 -5.896 1.238 1.00 1.020 H ATOM 122 2HE LYS A 7 -3.716 -5.940 0.488 1.00 1.020 H ATOM 123 1HZ LYS A 7 -4.772 -3.813 0.196 1.00 1.020 H ATOM 124 2HZ LYS A 7 -4.567 -4.539 -1.270 1.00 1.020 H ATOM 125 3HZ LYS A 7 -6.060 -4.498 -0.573 1.00 1.020 H ATOM 126 N VAL A 8 -7.081 -11.340 1.304 1.00 0.780 N ATOM 127 CA VAL A 8 -7.782 -11.463 2.560 1.00 0.930 C ATOM 128 C VAL A 8 -7.273 -12.646 3.352 1.00 0.800 C ATOM 129 O VAL A 8 -7.016 -12.510 4.544 1.00 0.830 O ATOM 130 CB VAL A 8 -9.304 -11.587 2.335 1.00 1.240 C ATOM 131 CG1 VAL A 8 -10.025 -11.938 3.660 1.00 1.240 C ATOM 132 CG2 VAL A 8 -9.837 -10.257 1.787 1.00 1.240 C ATOM 133 H VAL A 8 -7.593 -11.398 0.416 1.00 0.940 H ATOM 134 HA VAL A 8 -7.599 -10.558 3.138 1.00 1.120 H ATOM 135 HB VAL A 8 -9.496 -12.387 1.615 1.00 1.490 H ATOM 136 1HG1 VAL A 8 -11.094 -12.018 3.475 1.00 1.490 H ATOM 137 2HG1 VAL A 8 -9.660 -12.885 4.045 1.00 1.490 H ATOM 138 3HG1 VAL A 8 -9.840 -11.153 4.394 1.00 1.490 H ATOM 139 1HG2 VAL A 8 -10.908 -10.336 1.608 1.00 1.490 H ATOM 140 2HG2 VAL A 8 -9.645 -9.466 2.510 1.00 1.490 H ATOM 141 3HG2 VAL A 8 -9.337 -10.015 0.857 1.00 1.490 H ATOM 142 N LYS A 9 -7.123 -13.810 2.715 1.00 0.730 N ATOM 143 CA LYS A 9 -6.638 -14.980 3.432 1.00 0.740 C ATOM 144 C LYS A 9 -5.247 -14.757 4.004 1.00 0.600 C ATOM 145 O LYS A 9 -4.970 -15.128 5.142 1.00 0.640 O ATOM 146 CB LYS A 9 -6.630 -16.204 2.523 1.00 1.030 C ATOM 147 CG LYS A 9 -8.011 -16.745 2.184 1.00 1.030 C ATOM 148 CD LYS A 9 -7.919 -17.936 1.237 1.00 1.030 C ATOM 149 CE LYS A 9 -9.299 -18.474 0.879 1.00 1.030 C ATOM 150 NZ LYS A 9 -9.221 -19.633 -0.062 1.00 1.030 N ATOM 151 H LYS A 9 -7.362 -13.883 1.721 1.00 0.880 H ATOM 152 HA LYS A 9 -7.314 -15.172 4.259 1.00 0.890 H ATOM 153 1HB LYS A 9 -6.134 -15.942 1.583 1.00 1.240 H ATOM 154 2HB LYS A 9 -6.052 -17.001 2.988 1.00 1.240 H ATOM 155 1HG LYS A 9 -8.506 -17.055 3.103 1.00 1.240 H ATOM 156 2HG LYS A 9 -8.606 -15.960 1.726 1.00 1.240 H ATOM 157 1HD LYS A 9 -7.413 -17.623 0.320 1.00 1.240 H ATOM 158 2HD LYS A 9 -7.337 -18.729 1.702 1.00 1.240 H ATOM 159 1HE LYS A 9 -9.806 -18.790 1.789 1.00 1.240 H ATOM 160 2HE LYS A 9 -9.879 -17.677 0.410 1.00 1.240 H ATOM 161 1HZ LYS A 9 -10.154 -19.959 -0.275 1.00 1.240 H ATOM 162 2HZ LYS A 9 -8.763 -19.347 -0.916 1.00 1.240 H ATOM 163 3HZ LYS A 9 -8.695 -20.382 0.366 1.00 1.240 H ATOM 164 N GLN A 10 -4.381 -14.099 3.237 1.00 0.540 N ATOM 165 CA GLN A 10 -3.012 -13.830 3.653 1.00 0.620 C ATOM 166 C GLN A 10 -2.924 -12.967 4.902 1.00 0.690 C ATOM 167 O GLN A 10 -2.002 -13.125 5.704 1.00 0.840 O ATOM 168 CB GLN A 10 -2.241 -13.178 2.507 1.00 0.840 C ATOM 169 CG GLN A 10 -1.900 -14.127 1.348 1.00 0.840 C ATOM 170 CD GLN A 10 -0.897 -15.152 1.764 1.00 0.840 C ATOM 171 OE1 GLN A 10 -1.095 -16.357 1.587 1.00 0.840 O ATOM 172 NE2 GLN A 10 0.178 -14.669 2.357 1.00 0.840 N ATOM 173 H GLN A 10 -4.668 -13.826 2.292 1.00 0.650 H ATOM 174 HA GLN A 10 -2.542 -14.785 3.884 1.00 0.740 H ATOM 175 1HB GLN A 10 -2.848 -12.374 2.093 1.00 1.000 H ATOM 176 2HB GLN A 10 -1.337 -12.726 2.897 1.00 1.000 H ATOM 177 1HG GLN A 10 -2.795 -14.664 1.078 1.00 1.000 H ATOM 178 2HG GLN A 10 -1.531 -13.574 0.493 1.00 1.000 H ATOM 179 1HE2 GLN A 10 0.914 -15.267 2.719 1.00 1.000 H ATOM 180 2HE2 GLN A 10 0.281 -13.694 2.500 1.00 1.000 H ATOM 181 N SER A 11 -3.886 -12.072 5.087 1.00 0.740 N ATOM 182 CA SER A 11 -3.906 -11.200 6.250 1.00 0.970 C ATOM 183 C SER A 11 -4.529 -11.851 7.488 1.00 0.980 C ATOM 184 O SER A 11 -4.554 -11.241 8.563 1.00 1.170 O ATOM 185 CB SER A 11 -4.661 -9.919 5.933 1.00 1.270 C ATOM 186 OG SER A 11 -3.995 -9.146 4.963 1.00 1.270 O ATOM 187 H SER A 11 -4.596 -11.937 4.357 1.00 0.890 H ATOM 188 HA SER A 11 -2.876 -10.940 6.490 1.00 1.160 H ATOM 189 1HB SER A 11 -5.657 -10.183 5.565 1.00 1.520 H ATOM 190 2HB SER A 11 -4.790 -9.338 6.842 1.00 1.520 H ATOM 191 HG SER A 11 -4.550 -8.379 4.817 1.00 1.520 H ATOM 192 N ARG A 12 -5.080 -13.056 7.352 1.00 0.870 N ATOM 193 CA ARG A 12 -5.724 -13.677 8.483 1.00 0.990 C ATOM 194 C ARG A 12 -4.684 -14.260 9.410 1.00 1.060 C ATOM 195 O ARG A 12 -3.602 -14.644 8.966 1.00 1.080 O ATOM 196 CB ARG A 12 -6.675 -14.786 8.057 1.00 1.340 C ATOM 197 CG ARG A 12 -7.899 -14.324 7.315 1.00 1.340 C ATOM 198 CD ARG A 12 -8.759 -15.448 6.895 1.00 1.340 C ATOM 199 NE ARG A 12 -9.890 -14.978 6.111 1.00 1.340 N ATOM 200 CZ ARG A 12 -10.787 -15.764 5.480 1.00 1.340 C ATOM 201 NH1 ARG A 12 -10.687 -17.078 5.539 1.00 1.340 N ATOM 202 NH2 ARG A 12 -11.777 -15.208 4.799 1.00 1.340 N ATOM 203 H ARG A 12 -5.016 -13.565 6.465 1.00 1.040 H ATOM 204 HA ARG A 12 -6.311 -12.913 8.970 1.00 1.190 H ATOM 205 1HB ARG A 12 -6.142 -15.478 7.407 1.00 1.610 H ATOM 206 2HB ARG A 12 -6.999 -15.352 8.930 1.00 1.610 H ATOM 207 1HG ARG A 12 -8.481 -13.660 7.949 1.00 1.610 H ATOM 208 2HG ARG A 12 -7.591 -13.797 6.439 1.00 1.610 H ATOM 209 1HD ARG A 12 -8.175 -16.139 6.288 1.00 1.610 H ATOM 210 2HD ARG A 12 -9.137 -15.961 7.778 1.00 1.610 H ATOM 211 HE ARG A 12 -10.014 -13.975 6.038 1.00 1.610 H ATOM 212 1HH1 ARG A 12 -9.938 -17.510 6.060 1.00 1.610 H ATOM 213 2HH1 ARG A 12 -11.365 -17.660 5.066 1.00 1.610 H ATOM 214 1HH2 ARG A 12 -11.856 -14.201 4.754 1.00 1.610 H ATOM 215 2HH2 ARG A 12 -12.455 -15.787 4.325 1.00 1.610 H ATOM 216 N PRO A 13 -4.950 -14.309 10.713 1.00 1.280 N ATOM 217 CA PRO A 13 -4.138 -15.014 11.634 1.00 1.440 C ATOM 218 C PRO A 13 -4.077 -16.425 11.118 1.00 1.450 C ATOM 219 O PRO A 13 -5.098 -16.971 10.683 1.00 1.460 O ATOM 220 CB PRO A 13 -4.924 -14.907 12.946 1.00 2.160 C ATOM 221 CG PRO A 13 -5.717 -13.627 12.797 1.00 2.160 C ATOM 222 CD PRO A 13 -6.082 -13.571 11.324 1.00 2.160 C ATOM 223 HA PRO A 13 -3.140 -14.555 11.691 1.00 1.730 H ATOM 224 1HB PRO A 13 -5.559 -15.799 13.075 1.00 2.590 H ATOM 225 2HB PRO A 13 -4.230 -14.884 13.799 1.00 2.590 H ATOM 226 1HG PRO A 13 -6.601 -13.650 13.454 1.00 2.590 H ATOM 227 2HG PRO A 13 -5.110 -12.764 13.113 1.00 2.590 H ATOM 228 1HD PRO A 13 -7.040 -14.075 11.128 1.00 2.590 H ATOM 229 2HD PRO A 13 -6.081 -12.507 11.032 1.00 2.590 H ATOM 230 N ASN A 14 -2.906 -17.012 11.199 1.00 1.830 N ATOM 231 CA ASN A 14 -2.702 -18.370 10.761 1.00 2.020 C ATOM 232 C ASN A 14 -2.939 -19.311 11.917 1.00 1.880 C ATOM 233 O ASN A 14 -2.241 -19.238 12.926 1.00 2.130 O ATOM 234 CB ASN A 14 -1.304 -18.554 10.199 1.00 2.750 C ATOM 235 CG ASN A 14 -1.080 -17.796 8.925 1.00 2.750 C ATOM 236 OD1 ASN A 14 -1.832 -17.960 7.957 1.00 2.750 O ATOM 237 ND2 ASN A 14 -0.065 -16.965 8.906 1.00 2.750 N ATOM 238 H ASN A 14 -2.125 -16.492 11.569 1.00 2.200 H ATOM 239 HA ASN A 14 -3.430 -18.606 9.984 1.00 2.420 H ATOM 240 1HB ASN A 14 -0.567 -18.238 10.936 1.00 3.300 H ATOM 241 2HB ASN A 14 -1.134 -19.609 10.003 1.00 3.300 H ATOM 242 1HD2 ASN A 14 0.134 -16.424 8.079 1.00 3.300 H ATOM 243 2HD2 ASN A 14 0.519 -16.862 9.710 1.00 3.300 H ATOM 244 N LYS A 15 -3.941 -20.178 11.792 1.00 2.170 N ATOM 245 CA LYS A 15 -4.249 -21.129 12.857 1.00 2.690 C ATOM 246 C LYS A 15 -3.031 -22.013 13.141 1.00 2.470 C ATOM 247 O LYS A 15 -2.771 -22.377 14.290 1.00 2.820 O ATOM 248 CB LYS A 15 -5.471 -21.977 12.506 1.00 3.560 C ATOM 249 CG LYS A 15 -5.914 -22.923 13.621 1.00 3.560 C ATOM 250 CD LYS A 15 -7.216 -23.638 13.266 1.00 3.560 C ATOM 251 CE LYS A 15 -7.643 -24.597 14.372 1.00 3.560 C ATOM 252 NZ LYS A 15 -8.932 -25.287 14.051 1.00 3.560 N ATOM 253 H LYS A 15 -4.499 -20.161 10.948 1.00 2.600 H ATOM 254 HA LYS A 15 -4.470 -20.569 13.767 1.00 3.230 H ATOM 255 1HB LYS A 15 -6.307 -21.325 12.259 1.00 4.270 H ATOM 256 2HB LYS A 15 -5.252 -22.583 11.627 1.00 4.270 H ATOM 257 1HG LYS A 15 -5.134 -23.668 13.800 1.00 4.270 H ATOM 258 2HG LYS A 15 -6.054 -22.355 14.539 1.00 4.270 H ATOM 259 1HD LYS A 15 -8.005 -22.900 13.116 1.00 4.270 H ATOM 260 2HD LYS A 15 -7.087 -24.193 12.341 1.00 4.270 H ATOM 261 1HE LYS A 15 -6.867 -25.345 14.511 1.00 4.270 H ATOM 262 2HE LYS A 15 -7.764 -24.039 15.299 1.00 4.270 H ATOM 263 1HZ LYS A 15 -9.178 -25.910 14.808 1.00 4.270 H ATOM 264 2HZ LYS A 15 -9.665 -24.599 13.932 1.00 4.270 H ATOM 265 3HZ LYS A 15 -8.831 -25.819 13.199 1.00 4.270 H ATOM 266 N PHE A 16 -2.308 -22.380 12.072 1.00 2.230 N ATOM 267 CA PHE A 16 -1.115 -23.212 12.169 1.00 2.120 C ATOM 268 C PHE A 16 0.027 -22.533 11.402 1.00 1.570 C ATOM 269 O PHE A 16 -0.213 -21.920 10.357 1.00 1.920 O ATOM 270 CB PHE A 16 -1.357 -24.584 11.548 1.00 3.010 C ATOM 271 CG PHE A 16 -2.471 -25.368 12.142 1.00 3.010 C ATOM 272 CD1 PHE A 16 -3.719 -25.361 11.539 1.00 3.010 C ATOM 273 CD2 PHE A 16 -2.294 -26.112 13.290 1.00 3.010 C ATOM 274 CE1 PHE A 16 -4.755 -26.090 12.060 1.00 3.010 C ATOM 275 CE2 PHE A 16 -3.336 -26.839 13.821 1.00 3.010 C ATOM 276 CZ PHE A 16 -4.566 -26.831 13.202 1.00 3.010 C ATOM 277 H PHE A 16 -2.598 -22.055 11.164 1.00 2.680 H ATOM 278 HA PHE A 16 -0.831 -23.315 13.217 1.00 2.540 H ATOM 279 1HB PHE A 16 -1.569 -24.456 10.494 1.00 3.610 H ATOM 280 2HB PHE A 16 -0.450 -25.178 11.632 1.00 3.610 H ATOM 281 HD1 PHE A 16 -3.872 -24.774 10.639 1.00 3.610 H ATOM 282 HD2 PHE A 16 -1.321 -26.125 13.781 1.00 3.610 H ATOM 283 HE1 PHE A 16 -5.726 -26.082 11.569 1.00 3.610 H ATOM 284 HE2 PHE A 16 -3.187 -27.425 14.727 1.00 3.610 H ATOM 285 HZ PHE A 16 -5.385 -27.411 13.620 1.00 3.610 H ATOM 286 N SER A 17 1.271 -22.723 11.852 1.00 1.210 N ATOM 287 CA SER A 17 2.457 -22.123 11.229 1.00 1.290 C ATOM 288 C SER A 17 2.769 -22.558 9.809 1.00 1.100 C ATOM 289 O SER A 17 3.430 -21.833 9.060 1.00 1.390 O ATOM 290 CB SER A 17 3.659 -22.431 12.093 1.00 1.770 C ATOM 291 OG SER A 17 3.920 -23.809 12.095 1.00 1.770 O ATOM 292 H SER A 17 1.412 -23.265 12.694 1.00 1.450 H ATOM 293 HA SER A 17 2.307 -21.042 11.221 1.00 1.550 H ATOM 294 1HB SER A 17 4.527 -21.894 11.713 1.00 2.130 H ATOM 295 2HB SER A 17 3.478 -22.088 13.110 1.00 2.130 H ATOM 296 HG SER A 17 4.709 -23.929 12.635 1.00 2.130 H ATOM 297 N VAL A 18 2.251 -23.702 9.427 1.00 1.050 N ATOM 298 CA VAL A 18 2.492 -24.281 8.119 1.00 1.340 C ATOM 299 C VAL A 18 1.883 -23.476 6.982 1.00 1.130 C ATOM 300 O VAL A 18 2.255 -23.661 5.833 1.00 1.560 O ATOM 301 CB VAL A 18 1.995 -25.744 8.087 1.00 1.760 C ATOM 302 CG1 VAL A 18 2.760 -26.555 9.130 1.00 1.760 C ATOM 303 CG2 VAL A 18 0.493 -25.811 8.361 1.00 1.760 C ATOM 304 H VAL A 18 1.708 -24.192 10.116 1.00 1.260 H ATOM 305 HA VAL A 18 3.571 -24.305 7.966 1.00 1.610 H ATOM 306 HB VAL A 18 2.209 -26.173 7.107 1.00 2.110 H ATOM 307 1HG1 VAL A 18 2.432 -27.595 9.098 1.00 2.110 H ATOM 308 2HG1 VAL A 18 3.826 -26.505 8.910 1.00 2.110 H ATOM 309 3HG1 VAL A 18 2.581 -26.152 10.124 1.00 2.110 H ATOM 310 1HG2 VAL A 18 0.164 -26.849 8.333 1.00 2.110 H ATOM 311 2HG2 VAL A 18 0.284 -25.397 9.326 1.00 2.110 H ATOM 312 3HG2 VAL A 18 -0.030 -25.261 7.611 1.00 2.110 H ATOM 313 N ARG A 19 0.930 -22.601 7.281 1.00 0.870 N ATOM 314 CA ARG A 19 0.299 -21.808 6.241 1.00 1.090 C ATOM 315 C ARG A 19 0.824 -20.388 6.189 1.00 0.830 C ATOM 316 O ARG A 19 0.236 -19.525 5.528 1.00 0.800 O ATOM 317 CB ARG A 19 -1.214 -21.778 6.406 1.00 1.440 C ATOM 318 CG ARG A 19 -1.913 -23.103 6.132 1.00 1.440 C ATOM 319 CD ARG A 19 -3.346 -23.084 6.543 1.00 1.440 C ATOM 320 NE ARG A 19 -4.040 -24.341 6.207 1.00 1.440 N ATOM 321 CZ ARG A 19 -3.961 -25.506 6.906 1.00 1.440 C ATOM 322 NH1 ARG A 19 -3.219 -25.586 7.985 1.00 1.440 N ATOM 323 NH2 ARG A 19 -4.639 -26.564 6.492 1.00 1.440 N ATOM 324 H ARG A 19 0.653 -22.461 8.261 1.00 1.040 H ATOM 325 HA ARG A 19 0.516 -22.282 5.290 1.00 1.310 H ATOM 326 1HB ARG A 19 -1.454 -21.476 7.429 1.00 1.730 H ATOM 327 2HB ARG A 19 -1.640 -21.033 5.736 1.00 1.730 H ATOM 328 1HG ARG A 19 -1.864 -23.319 5.066 1.00 1.730 H ATOM 329 2HG ARG A 19 -1.414 -23.876 6.668 1.00 1.730 H ATOM 330 1HD ARG A 19 -3.423 -22.917 7.618 1.00 1.730 H ATOM 331 2HD ARG A 19 -3.851 -22.270 6.019 1.00 1.730 H ATOM 332 HE ARG A 19 -4.629 -24.334 5.382 1.00 1.730 H ATOM 333 1HH1 ARG A 19 -2.706 -24.779 8.289 1.00 1.730 H ATOM 334 2HH1 ARG A 19 -3.162 -26.455 8.504 1.00 1.730 H ATOM 335 1HH2 ARG A 19 -5.211 -26.505 5.660 1.00 1.730 H ATOM 336 2HH2 ARG A 19 -4.587 -27.434 7.003 1.00 1.730 H ATOM 337 N ASP A 20 1.934 -20.112 6.865 1.00 0.830 N ATOM 338 CA ASP A 20 2.448 -18.754 6.872 1.00 0.780 C ATOM 339 C ASP A 20 3.191 -18.445 5.576 1.00 0.750 C ATOM 340 O ASP A 20 4.421 -18.448 5.514 1.00 1.220 O ATOM 341 CB ASP A 20 3.365 -18.531 8.083 1.00 1.110 C ATOM 342 CG ASP A 20 3.743 -17.052 8.309 1.00 1.110 C ATOM 343 OD1 ASP A 20 3.093 -16.198 7.741 1.00 1.110 O ATOM 344 OD2 ASP A 20 4.656 -16.789 9.071 1.00 1.110 O ATOM 345 H ASP A 20 2.416 -20.836 7.409 1.00 1.000 H ATOM 346 HA ASP A 20 1.607 -18.067 6.946 1.00 0.940 H ATOM 347 1HB ASP A 20 2.870 -18.912 8.979 1.00 1.330 H ATOM 348 2HB ASP A 20 4.278 -19.114 7.953 1.00 1.330 H ATOM 349 N TYR A 21 2.421 -18.210 4.528 1.00 0.600 N ATOM 350 CA TYR A 21 2.952 -17.930 3.208 1.00 0.820 C ATOM 351 C TYR A 21 3.177 -16.443 3.025 1.00 0.750 C ATOM 352 O TYR A 21 2.444 -15.622 3.571 1.00 0.880 O ATOM 353 CB TYR A 21 2.007 -18.439 2.120 1.00 1.060 C ATOM 354 CG TYR A 21 1.928 -19.934 2.046 1.00 1.060 C ATOM 355 CD1 TYR A 21 0.845 -20.598 2.590 1.00 1.060 C ATOM 356 CD2 TYR A 21 2.948 -20.648 1.444 1.00 1.060 C ATOM 357 CE1 TYR A 21 0.778 -21.969 2.531 1.00 1.060 C ATOM 358 CE2 TYR A 21 2.882 -22.023 1.388 1.00 1.060 C ATOM 359 CZ TYR A 21 1.801 -22.682 1.930 1.00 1.060 C ATOM 360 OH TYR A 21 1.737 -24.055 1.877 1.00 1.060 O ATOM 361 H TYR A 21 1.415 -18.282 4.691 1.00 0.720 H ATOM 362 HA TYR A 21 3.914 -18.429 3.107 1.00 0.980 H ATOM 363 1HB TYR A 21 1.003 -18.052 2.305 1.00 1.270 H ATOM 364 2HB TYR A 21 2.329 -18.058 1.148 1.00 1.270 H ATOM 365 HD1 TYR A 21 0.042 -20.036 3.066 1.00 1.270 H ATOM 366 HD2 TYR A 21 3.804 -20.125 1.017 1.00 1.270 H ATOM 367 HE1 TYR A 21 -0.076 -22.491 2.959 1.00 1.270 H ATOM 368 HE2 TYR A 21 3.686 -22.590 0.917 1.00 1.270 H ATOM 369 HH TYR A 21 0.921 -24.353 2.283 1.00 1.270 H ATOM 370 N THR A 22 4.195 -16.110 2.254 1.00 0.820 N ATOM 371 CA THR A 22 4.525 -14.742 1.895 1.00 0.850 C ATOM 372 C THR A 22 3.740 -14.370 0.654 1.00 0.920 C ATOM 373 O THR A 22 3.481 -15.232 -0.179 1.00 1.510 O ATOM 374 CB THR A 22 6.052 -14.597 1.660 1.00 1.180 C ATOM 375 OG1 THR A 22 6.743 -14.900 2.876 1.00 1.180 O ATOM 376 CG2 THR A 22 6.424 -13.187 1.228 1.00 1.180 C ATOM 377 H THR A 22 4.757 -16.852 1.867 1.00 0.980 H ATOM 378 HA THR A 22 4.228 -14.077 2.706 1.00 1.020 H ATOM 379 HB THR A 22 6.366 -15.298 0.886 1.00 1.410 H ATOM 380 HG1 THR A 22 6.610 -15.823 3.099 1.00 1.410 H ATOM 381 1HG2 THR A 22 7.502 -13.129 1.079 1.00 1.410 H ATOM 382 2HG2 THR A 22 5.933 -12.947 0.309 1.00 1.410 H ATOM 383 3HG2 THR A 22 6.126 -12.476 1.996 1.00 1.410 H ATOM 384 N ARG A 23 3.346 -13.109 0.542 1.00 0.780 N ATOM 385 CA ARG A 23 2.697 -12.637 -0.669 1.00 0.820 C ATOM 386 C ARG A 23 3.295 -11.324 -1.103 1.00 0.760 C ATOM 387 O ARG A 23 3.744 -10.518 -0.289 1.00 0.840 O ATOM 388 CB ARG A 23 1.196 -12.455 -0.479 1.00 1.130 C ATOM 389 CG ARG A 23 0.770 -11.401 0.586 1.00 1.130 C ATOM 390 CD ARG A 23 0.516 -10.014 0.023 1.00 1.130 C ATOM 391 NE ARG A 23 -0.075 -9.142 1.029 1.00 1.130 N ATOM 392 CZ ARG A 23 0.620 -8.439 1.956 1.00 1.130 C ATOM 393 NH1 ARG A 23 1.941 -8.505 2.010 1.00 1.130 N ATOM 394 NH2 ARG A 23 -0.035 -7.681 2.822 1.00 1.130 N ATOM 395 H ARG A 23 3.562 -12.463 1.288 1.00 0.940 H ATOM 396 HA ARG A 23 2.858 -13.361 -1.465 1.00 0.980 H ATOM 397 1HB ARG A 23 0.754 -12.157 -1.434 1.00 1.360 H ATOM 398 2HB ARG A 23 0.762 -13.411 -0.211 1.00 1.360 H ATOM 399 1HG ARG A 23 -0.142 -11.717 1.056 1.00 1.360 H ATOM 400 2HG ARG A 23 1.548 -11.325 1.341 1.00 1.360 H ATOM 401 1HD ARG A 23 1.417 -9.542 -0.327 1.00 1.360 H ATOM 402 2HD ARG A 23 -0.182 -10.090 -0.811 1.00 1.360 H ATOM 403 HE ARG A 23 -1.082 -9.055 1.034 1.00 1.360 H ATOM 404 1HH1 ARG A 23 2.462 -9.082 1.347 1.00 1.360 H ATOM 405 2HH1 ARG A 23 2.444 -7.981 2.713 1.00 1.360 H ATOM 406 1HH2 ARG A 23 -1.045 -7.632 2.789 1.00 1.360 H ATOM 407 2HH2 ARG A 23 0.469 -7.156 3.521 1.00 1.360 H ATOM 408 N CYS A 24 3.214 -11.117 -2.385 1.00 0.680 N ATOM 409 CA CYS A 24 3.604 -9.942 -3.130 1.00 0.610 C ATOM 410 C CYS A 24 2.763 -8.702 -2.832 1.00 0.600 C ATOM 411 O CYS A 24 1.577 -8.639 -3.164 1.00 0.670 O ATOM 412 CB CYS A 24 3.465 -10.314 -4.579 1.00 0.880 C ATOM 413 SG CYS A 24 3.792 -9.091 -5.723 1.00 0.880 S ATOM 414 H CYS A 24 2.854 -11.899 -2.927 1.00 0.820 H ATOM 415 HA CYS A 24 4.648 -9.727 -2.901 1.00 0.730 H ATOM 416 1HB CYS A 24 4.117 -11.154 -4.794 1.00 1.060 H ATOM 417 2HB CYS A 24 2.459 -10.656 -4.740 1.00 1.060 H ATOM 418 N LEU A 25 3.419 -7.642 -2.374 1.00 0.560 N ATOM 419 CA LEU A 25 2.739 -6.390 -2.025 1.00 0.590 C ATOM 420 C LEU A 25 1.989 -5.708 -3.173 1.00 0.630 C ATOM 421 O LEU A 25 0.957 -5.075 -2.945 1.00 0.740 O ATOM 422 CB LEU A 25 3.774 -5.384 -1.493 1.00 0.810 C ATOM 423 CG LEU A 25 4.400 -5.673 -0.115 1.00 0.810 C ATOM 424 CD1 LEU A 25 5.588 -4.743 0.089 1.00 0.810 C ATOM 425 CD2 LEU A 25 3.364 -5.438 0.983 1.00 0.810 C ATOM 426 H LEU A 25 4.412 -7.763 -2.147 1.00 0.670 H ATOM 427 HA LEU A 25 2.011 -6.618 -1.253 1.00 0.710 H ATOM 428 1HB LEU A 25 4.584 -5.323 -2.198 1.00 0.980 H ATOM 429 2HB LEU A 25 3.300 -4.407 -1.444 1.00 0.980 H ATOM 430 HG LEU A 25 4.748 -6.702 -0.073 1.00 0.980 H ATOM 431 1HD1 LEU A 25 6.044 -4.938 1.058 1.00 0.980 H ATOM 432 2HD1 LEU A 25 6.330 -4.920 -0.697 1.00 0.980 H ATOM 433 3HD1 LEU A 25 5.258 -3.707 0.048 1.00 0.980 H ATOM 434 1HD2 LEU A 25 3.817 -5.636 1.953 1.00 0.980 H ATOM 435 2HD2 LEU A 25 3.022 -4.403 0.947 1.00 0.980 H ATOM 436 3HD2 LEU A 25 2.521 -6.093 0.845 1.00 0.980 H ATOM 437 N ARG A 26 2.509 -5.791 -4.394 1.00 0.590 N ATOM 438 CA ARG A 26 1.877 -5.097 -5.516 1.00 0.660 C ATOM 439 C ARG A 26 1.068 -5.977 -6.459 1.00 0.750 C ATOM 440 O ARG A 26 0.099 -5.533 -7.076 1.00 1.070 O ATOM 441 CB ARG A 26 2.935 -4.407 -6.345 1.00 0.900 C ATOM 442 CG ARG A 26 3.623 -3.271 -5.653 1.00 0.900 C ATOM 443 CD ARG A 26 4.681 -2.694 -6.493 1.00 0.900 C ATOM 444 NE ARG A 26 4.165 -2.047 -7.702 1.00 0.900 N ATOM 445 CZ ARG A 26 3.711 -0.773 -7.780 1.00 0.900 C ATOM 446 NH1 ARG A 26 3.696 0.007 -6.714 1.00 0.900 N ATOM 447 NH2 ARG A 26 3.280 -0.306 -8.941 1.00 0.900 N ATOM 448 H ARG A 26 3.359 -6.319 -4.534 1.00 0.710 H ATOM 449 HA ARG A 26 1.209 -4.339 -5.108 1.00 0.790 H ATOM 450 1HB ARG A 26 3.696 -5.135 -6.632 1.00 1.080 H ATOM 451 2HB ARG A 26 2.485 -4.027 -7.260 1.00 1.080 H ATOM 452 1HG ARG A 26 2.893 -2.500 -5.417 1.00 1.080 H ATOM 453 2HG ARG A 26 4.079 -3.634 -4.731 1.00 1.080 H ATOM 454 1HD ARG A 26 5.243 -1.967 -5.916 1.00 1.080 H ATOM 455 2HD ARG A 26 5.344 -3.501 -6.807 1.00 1.080 H ATOM 456 HE ARG A 26 4.160 -2.594 -8.555 1.00 1.080 H ATOM 457 1HH1 ARG A 26 4.023 -0.336 -5.825 1.00 1.080 H ATOM 458 2HH1 ARG A 26 3.357 0.957 -6.787 1.00 1.080 H ATOM 459 1HH2 ARG A 26 3.291 -0.900 -9.762 1.00 1.080 H ATOM 460 2HH2 ARG A 26 2.942 0.643 -9.013 1.00 1.080 H ATOM 461 N CYS A 27 1.478 -7.205 -6.614 1.00 0.660 N ATOM 462 CA CYS A 27 0.852 -8.078 -7.575 1.00 0.740 C ATOM 463 C CYS A 27 -0.101 -9.111 -6.976 1.00 0.800 C ATOM 464 O CYS A 27 -0.927 -9.665 -7.696 1.00 0.900 O ATOM 465 CB CYS A 27 1.933 -8.801 -8.311 1.00 1.000 C ATOM 466 SG CYS A 27 2.760 -9.978 -7.311 1.00 1.000 S ATOM 467 H CYS A 27 2.262 -7.528 -6.080 1.00 0.790 H ATOM 468 HA CYS A 27 0.296 -7.465 -8.283 1.00 0.890 H ATOM 469 1HB CYS A 27 1.512 -9.318 -9.170 1.00 1.200 H ATOM 470 2HB CYS A 27 2.668 -8.090 -8.679 1.00 1.200 H ATOM 471 N GLY A 28 0.009 -9.393 -5.671 1.00 0.770 N ATOM 472 CA GLY A 28 -0.839 -10.364 -4.989 1.00 0.840 C ATOM 473 C GLY A 28 -0.415 -11.826 -5.135 1.00 0.880 C ATOM 474 O GLY A 28 -1.032 -12.703 -4.545 1.00 1.000 O ATOM 475 H GLY A 28 0.701 -8.930 -5.078 1.00 0.920 H ATOM 476 1HA GLY A 28 -0.861 -10.108 -3.929 1.00 1.010 H ATOM 477 2HA GLY A 28 -1.855 -10.257 -5.352 1.00 1.010 H ATOM 478 N ARG A 29 0.627 -12.090 -5.900 1.00 0.820 N ATOM 479 CA ARG A 29 1.106 -13.440 -6.145 1.00 0.870 C ATOM 480 C ARG A 29 1.863 -13.978 -4.936 1.00 0.870 C ATOM 481 O ARG A 29 2.502 -13.228 -4.197 1.00 0.830 O ATOM 482 CB ARG A 29 2.038 -13.441 -7.348 1.00 1.200 C ATOM 483 CG ARG A 29 1.390 -13.006 -8.678 1.00 1.200 C ATOM 484 CD ARG A 29 2.405 -12.915 -9.780 1.00 1.200 C ATOM 485 NE ARG A 29 1.826 -12.397 -11.026 1.00 1.200 N ATOM 486 CZ ARG A 29 1.233 -13.131 -11.996 1.00 1.200 C ATOM 487 NH1 ARG A 29 1.136 -14.442 -11.893 1.00 1.200 N ATOM 488 NH2 ARG A 29 0.745 -12.519 -13.065 1.00 1.200 N ATOM 489 H ARG A 29 1.074 -11.316 -6.371 1.00 0.980 H ATOM 490 HA ARG A 29 0.250 -14.083 -6.346 1.00 1.040 H ATOM 491 1HB ARG A 29 2.901 -12.818 -7.149 1.00 1.440 H ATOM 492 2HB ARG A 29 2.412 -14.451 -7.501 1.00 1.440 H ATOM 493 1HG ARG A 29 0.633 -13.734 -8.962 1.00 1.440 H ATOM 494 2HG ARG A 29 0.913 -12.032 -8.563 1.00 1.440 H ATOM 495 1HD ARG A 29 3.199 -12.230 -9.471 1.00 1.440 H ATOM 496 2HD ARG A 29 2.840 -13.892 -9.970 1.00 1.440 H ATOM 497 HE ARG A 29 1.866 -11.396 -11.168 1.00 1.440 H ATOM 498 1HH1 ARG A 29 1.502 -14.918 -11.084 1.00 1.440 H ATOM 499 2HH1 ARG A 29 0.691 -14.976 -12.627 1.00 1.440 H ATOM 500 1HH2 ARG A 29 0.809 -11.513 -13.149 1.00 1.440 H ATOM 501 2HH2 ARG A 29 0.301 -13.054 -13.797 1.00 1.440 H ATOM 502 N ALA A 30 1.807 -15.295 -4.727 1.00 0.980 N ATOM 503 CA ALA A 30 2.577 -15.908 -3.636 1.00 1.050 C ATOM 504 C ALA A 30 3.773 -16.700 -4.166 1.00 0.990 C ATOM 505 O ALA A 30 4.448 -17.409 -3.422 1.00 1.250 O ATOM 506 CB ALA A 30 1.677 -16.796 -2.794 1.00 1.440 C ATOM 507 H ALA A 30 1.233 -15.875 -5.325 1.00 1.180 H ATOM 508 HA ALA A 30 2.963 -15.116 -3.000 1.00 1.260 H ATOM 509 1HB ALA A 30 2.258 -17.212 -1.966 1.00 1.730 H ATOM 510 2HB ALA A 30 0.854 -16.201 -2.394 1.00 1.730 H ATOM 511 3HB ALA A 30 1.282 -17.603 -3.405 1.00 1.730 H ATOM 512 N ARG A 31 4.008 -16.604 -5.461 1.00 0.900 N ATOM 513 CA ARG A 31 5.100 -17.302 -6.111 1.00 0.910 C ATOM 514 C ARG A 31 6.208 -16.323 -6.431 1.00 0.950 C ATOM 515 O ARG A 31 5.938 -15.192 -6.832 1.00 1.760 O ATOM 516 CB ARG A 31 4.625 -17.973 -7.392 1.00 1.270 C ATOM 517 CG ARG A 31 5.687 -18.778 -8.141 1.00 1.270 C ATOM 518 CD ARG A 31 5.115 -19.512 -9.287 1.00 1.270 C ATOM 519 NE ARG A 31 6.137 -20.271 -10.000 1.00 1.270 N ATOM 520 CZ ARG A 31 5.929 -21.005 -11.117 1.00 1.270 C ATOM 521 NH1 ARG A 31 4.728 -21.080 -11.657 1.00 1.270 N ATOM 522 NH2 ARG A 31 6.943 -21.652 -11.671 1.00 1.270 N ATOM 523 H ARG A 31 3.415 -15.998 -6.003 1.00 1.080 H ATOM 524 HA ARG A 31 5.487 -18.065 -5.436 1.00 1.090 H ATOM 525 1HB ARG A 31 3.800 -18.643 -7.163 1.00 1.520 H ATOM 526 2HB ARG A 31 4.249 -17.213 -8.076 1.00 1.520 H ATOM 527 1HG ARG A 31 6.446 -18.108 -8.540 1.00 1.520 H ATOM 528 2HG ARG A 31 6.150 -19.498 -7.467 1.00 1.520 H ATOM 529 1HD ARG A 31 4.355 -20.207 -8.929 1.00 1.520 H ATOM 530 2HD ARG A 31 4.669 -18.799 -9.978 1.00 1.520 H ATOM 531 HE ARG A 31 7.078 -20.248 -9.626 1.00 1.520 H ATOM 532 1HH1 ARG A 31 3.951 -20.591 -11.241 1.00 1.520 H ATOM 533 2HH1 ARG A 31 4.582 -21.631 -12.492 1.00 1.520 H ATOM 534 1HH2 ARG A 31 7.865 -21.597 -11.259 1.00 1.520 H ATOM 535 2HH2 ARG A 31 6.800 -22.203 -12.505 1.00 1.520 H ATOM 536 N ALA A 32 7.453 -16.764 -6.291 1.00 0.830 N ATOM 537 CA ALA A 32 8.619 -15.956 -6.653 1.00 0.780 C ATOM 538 C ALA A 32 8.663 -14.593 -5.973 1.00 0.670 C ATOM 539 O ALA A 32 8.921 -13.585 -6.639 1.00 0.690 O ATOM 540 CB ALA A 32 8.648 -15.746 -8.160 1.00 1.110 C ATOM 541 H ALA A 32 7.594 -17.697 -5.932 1.00 1.000 H ATOM 542 HA ALA A 32 9.510 -16.508 -6.351 1.00 0.940 H ATOM 543 1HB ALA A 32 9.531 -15.183 -8.422 1.00 1.330 H ATOM 544 2HB ALA A 32 8.668 -16.710 -8.662 1.00 1.330 H ATOM 545 3HB ALA A 32 7.770 -15.192 -8.481 1.00 1.330 H ATOM 546 N VAL A 33 8.428 -14.559 -4.656 1.00 0.690 N ATOM 547 CA VAL A 33 8.460 -13.306 -3.905 1.00 0.630 C ATOM 548 C VAL A 33 9.810 -13.137 -3.224 1.00 0.630 C ATOM 549 O VAL A 33 10.307 -14.047 -2.558 1.00 0.700 O ATOM 550 CB VAL A 33 7.266 -13.210 -2.930 1.00 0.910 C ATOM 551 CG1 VAL A 33 7.311 -11.870 -2.145 1.00 0.910 C ATOM 552 CG2 VAL A 33 5.965 -13.319 -3.741 1.00 0.910 C ATOM 553 H VAL A 33 8.228 -15.427 -4.179 1.00 0.830 H ATOM 554 HA VAL A 33 8.370 -12.483 -4.575 1.00 0.760 H ATOM 555 HB VAL A 33 7.314 -14.023 -2.207 1.00 1.090 H ATOM 556 1HG1 VAL A 33 6.464 -11.803 -1.483 1.00 1.090 H ATOM 557 2HG1 VAL A 33 8.230 -11.798 -1.563 1.00 1.090 H ATOM 558 3HG1 VAL A 33 7.266 -11.048 -2.839 1.00 1.090 H ATOM 559 1HG2 VAL A 33 5.106 -13.262 -3.077 1.00 1.090 H ATOM 560 2HG2 VAL A 33 5.927 -12.510 -4.458 1.00 1.090 H ATOM 561 3HG2 VAL A 33 5.937 -14.266 -4.273 1.00 1.090 H ATOM 562 N LEU A 34 10.413 -11.971 -3.438 1.00 0.570 N ATOM 563 CA LEU A 34 11.729 -11.650 -2.922 1.00 0.580 C ATOM 564 C LEU A 34 11.616 -11.102 -1.507 1.00 0.590 C ATOM 565 O LEU A 34 11.026 -10.039 -1.280 1.00 0.540 O ATOM 566 CB LEU A 34 12.362 -10.586 -3.831 1.00 0.810 C ATOM 567 CG LEU A 34 12.522 -10.952 -5.343 1.00 0.810 C ATOM 568 CD1 LEU A 34 12.980 -9.704 -6.111 1.00 0.810 C ATOM 569 CD2 LEU A 34 13.535 -12.089 -5.510 1.00 0.810 C ATOM 570 H LEU A 34 9.922 -11.269 -3.996 1.00 0.680 H ATOM 571 HA LEU A 34 12.333 -12.554 -2.897 1.00 0.700 H ATOM 572 1HB LEU A 34 11.734 -9.695 -3.788 1.00 0.970 H ATOM 573 2HB LEU A 34 13.347 -10.339 -3.442 1.00 0.970 H ATOM 574 HG LEU A 34 11.551 -11.261 -5.747 1.00 0.970 H ATOM 575 1HD1 LEU A 34 13.074 -9.934 -7.170 1.00 0.970 H ATOM 576 2HD1 LEU A 34 12.239 -8.920 -5.978 1.00 0.970 H ATOM 577 3HD1 LEU A 34 13.940 -9.364 -5.735 1.00 0.970 H ATOM 578 1HD2 LEU A 34 13.639 -12.331 -6.563 1.00 0.970 H ATOM 579 2HD2 LEU A 34 14.504 -11.780 -5.115 1.00 0.970 H ATOM 580 3HD2 LEU A 34 13.191 -12.973 -4.978 1.00 0.970 H ATOM 581 N SER A 35 12.246 -11.796 -0.559 1.00 0.670 N ATOM 582 CA SER A 35 12.192 -11.458 0.868 1.00 0.700 C ATOM 583 C SER A 35 12.835 -10.117 1.204 1.00 0.690 C ATOM 584 O SER A 35 12.559 -9.519 2.243 1.00 0.720 O ATOM 585 CB SER A 35 12.862 -12.555 1.668 1.00 0.970 C ATOM 586 OG SER A 35 14.234 -12.594 1.402 1.00 0.970 O ATOM 587 H SER A 35 12.736 -12.643 -0.823 1.00 0.800 H ATOM 588 HA SER A 35 11.142 -11.411 1.161 1.00 0.840 H ATOM 589 1HB SER A 35 12.698 -12.381 2.731 1.00 1.160 H ATOM 590 2HB SER A 35 12.411 -13.514 1.418 1.00 1.160 H ATOM 591 HG SER A 35 14.586 -13.319 1.929 1.00 1.160 H ATOM 592 N HIS A 36 13.662 -9.631 0.292 1.00 0.650 N ATOM 593 CA HIS A 36 14.363 -8.367 0.440 1.00 0.660 C ATOM 594 C HIS A 36 13.487 -7.173 0.088 1.00 0.580 C ATOM 595 O HIS A 36 13.778 -6.044 0.493 1.00 0.590 O ATOM 596 CB HIS A 36 15.575 -8.332 -0.494 1.00 0.920 C ATOM 597 CG HIS A 36 16.651 -9.299 -0.159 1.00 0.920 C ATOM 598 ND1 HIS A 36 17.451 -9.176 0.958 1.00 0.920 N ATOM 599 CD2 HIS A 36 17.065 -10.414 -0.801 1.00 0.920 C ATOM 600 CE1 HIS A 36 18.314 -10.178 0.987 1.00 0.920 C ATOM 601 NE2 HIS A 36 18.101 -10.942 -0.069 1.00 0.920 N ATOM 602 H HIS A 36 13.827 -10.196 -0.523 1.00 0.780 H ATOM 603 HA HIS A 36 14.701 -8.253 1.469 1.00 0.790 H ATOM 604 1HB HIS A 36 15.244 -8.553 -1.500 1.00 1.100 H ATOM 605 2HB HIS A 36 15.998 -7.327 -0.505 1.00 1.100 H ATOM 606 HD2 HIS A 36 16.656 -10.819 -1.727 1.00 1.100 H ATOM 607 HE1 HIS A 36 19.072 -10.344 1.752 1.00 1.100 H ATOM 608 HE2 HIS A 36 18.614 -11.780 -0.304 1.00 1.100 H ATOM 609 N PHE A 37 12.447 -7.398 -0.724 1.00 0.520 N ATOM 610 CA PHE A 37 11.645 -6.282 -1.194 1.00 0.470 C ATOM 611 C PHE A 37 10.151 -6.406 -0.856 1.00 0.440 C ATOM 612 O PHE A 37 9.430 -5.408 -0.851 1.00 0.460 O ATOM 613 CB PHE A 37 11.858 -6.142 -2.698 1.00 0.680 C ATOM 614 CG PHE A 37 13.300 -5.991 -3.061 1.00 0.680 C ATOM 615 CD1 PHE A 37 13.965 -7.048 -3.644 1.00 0.680 C ATOM 616 CD2 PHE A 37 14.003 -4.831 -2.804 1.00 0.680 C ATOM 617 CE1 PHE A 37 15.298 -6.961 -3.971 1.00 0.680 C ATOM 618 CE2 PHE A 37 15.343 -4.737 -3.126 1.00 0.680 C ATOM 619 CZ PHE A 37 15.988 -5.803 -3.712 1.00 0.680 C ATOM 620 H PHE A 37 12.198 -8.344 -1.007 1.00 0.620 H ATOM 621 HA PHE A 37 12.010 -5.375 -0.714 1.00 0.560 H ATOM 622 1HB PHE A 37 11.483 -7.029 -3.196 1.00 0.810 H ATOM 623 2HB PHE A 37 11.315 -5.276 -3.071 1.00 0.810 H ATOM 624 HD1 PHE A 37 13.421 -7.955 -3.843 1.00 0.810 H ATOM 625 HD2 PHE A 37 13.495 -3.986 -2.334 1.00 0.810 H ATOM 626 HE1 PHE A 37 15.803 -7.808 -4.437 1.00 0.810 H ATOM 627 HE2 PHE A 37 15.893 -3.815 -2.916 1.00 0.810 H ATOM 628 HZ PHE A 37 17.044 -5.727 -3.968 1.00 0.810 H ATOM 629 N GLY A 38 9.670 -7.630 -0.602 1.00 0.450 N ATOM 630 CA GLY A 38 8.250 -7.864 -0.341 1.00 0.470 C ATOM 631 C GLY A 38 7.423 -8.004 -1.616 1.00 0.460 C ATOM 632 O GLY A 38 6.192 -8.061 -1.559 1.00 0.490 O ATOM 633 H GLY A 38 10.287 -8.439 -0.617 1.00 0.540 H ATOM 634 1HA GLY A 38 8.147 -8.771 0.255 1.00 0.560 H ATOM 635 2HA GLY A 38 7.855 -7.046 0.259 1.00 0.560 H ATOM 636 N VAL A 39 8.098 -8.046 -2.757 1.00 0.460 N ATOM 637 CA VAL A 39 7.441 -8.149 -4.049 1.00 0.490 C ATOM 638 C VAL A 39 7.967 -9.301 -4.894 1.00 0.440 C ATOM 639 O VAL A 39 9.075 -9.800 -4.689 1.00 0.480 O ATOM 640 CB VAL A 39 7.587 -6.822 -4.833 1.00 0.670 C ATOM 641 CG1 VAL A 39 6.920 -5.683 -4.080 1.00 0.670 C ATOM 642 CG2 VAL A 39 9.048 -6.525 -5.074 1.00 0.670 C ATOM 643 H VAL A 39 9.105 -7.993 -2.700 1.00 0.550 H ATOM 644 HA VAL A 39 6.378 -8.320 -3.883 1.00 0.590 H ATOM 645 HB VAL A 39 7.106 -6.914 -5.755 1.00 0.810 H ATOM 646 1HG1 VAL A 39 7.008 -4.764 -4.654 1.00 0.810 H ATOM 647 2HG1 VAL A 39 5.875 -5.930 -3.948 1.00 0.810 H ATOM 648 3HG1 VAL A 39 7.392 -5.547 -3.107 1.00 0.810 H ATOM 649 1HG2 VAL A 39 9.148 -5.607 -5.640 1.00 0.810 H ATOM 650 2HG2 VAL A 39 9.523 -6.417 -4.132 1.00 0.810 H ATOM 651 3HG2 VAL A 39 9.496 -7.341 -5.624 1.00 0.810 H ATOM 652 N CYS A 40 7.162 -9.685 -5.859 1.00 0.450 N ATOM 653 CA CYS A 40 7.465 -10.734 -6.815 1.00 0.480 C ATOM 654 C CYS A 40 8.524 -10.298 -7.797 1.00 0.460 C ATOM 655 O CYS A 40 8.704 -9.106 -8.031 1.00 0.420 O ATOM 656 CB CYS A 40 6.216 -11.116 -7.589 1.00 0.660 C ATOM 657 SG CYS A 40 5.661 -9.865 -8.806 1.00 0.660 S ATOM 658 H CYS A 40 6.272 -9.208 -5.946 1.00 0.540 H ATOM 659 HA CYS A 40 7.815 -11.598 -6.286 1.00 0.580 H ATOM 660 1HB CYS A 40 6.400 -12.049 -8.123 1.00 0.790 H ATOM 661 2HB CYS A 40 5.406 -11.306 -6.896 1.00 0.790 H ATOM 662 N ARG A 41 9.162 -11.257 -8.454 1.00 0.510 N ATOM 663 CA ARG A 41 10.141 -10.893 -9.465 1.00 0.510 C ATOM 664 C ARG A 41 9.554 -10.045 -10.607 1.00 0.510 C ATOM 665 O ARG A 41 10.219 -9.139 -11.107 1.00 0.480 O ATOM 666 CB ARG A 41 10.847 -12.116 -10.037 1.00 0.710 C ATOM 667 CG ARG A 41 11.844 -12.779 -9.074 1.00 0.710 C ATOM 668 CD ARG A 41 12.772 -13.742 -9.775 1.00 0.710 C ATOM 669 NE ARG A 41 12.103 -14.929 -10.328 1.00 0.710 N ATOM 670 CZ ARG A 41 11.903 -16.101 -9.675 1.00 0.710 C ATOM 671 NH1 ARG A 41 12.317 -16.267 -8.432 1.00 0.710 N ATOM 672 NH2 ARG A 41 11.287 -17.094 -10.296 1.00 0.710 N ATOM 673 H ARG A 41 9.003 -12.230 -8.165 1.00 0.610 H ATOM 674 HA ARG A 41 10.909 -10.304 -8.967 1.00 0.610 H ATOM 675 1HB ARG A 41 10.107 -12.864 -10.313 1.00 0.860 H ATOM 676 2HB ARG A 41 11.386 -11.835 -10.936 1.00 0.860 H ATOM 677 1HG ARG A 41 12.449 -12.002 -8.616 1.00 0.860 H ATOM 678 2HG ARG A 41 11.299 -13.316 -8.296 1.00 0.860 H ATOM 679 1HD ARG A 41 13.252 -13.218 -10.602 1.00 0.860 H ATOM 680 2HD ARG A 41 13.541 -14.068 -9.080 1.00 0.860 H ATOM 681 HE ARG A 41 11.767 -14.865 -11.279 1.00 0.860 H ATOM 682 1HH1 ARG A 41 12.794 -15.522 -7.948 1.00 0.860 H ATOM 683 2HH1 ARG A 41 12.165 -17.149 -7.963 1.00 0.860 H ATOM 684 1HH2 ARG A 41 10.969 -16.975 -11.250 1.00 0.860 H ATOM 685 2HH2 ARG A 41 11.137 -17.972 -9.824 1.00 0.860 H ATOM 686 N LEU A 42 8.329 -10.326 -11.045 1.00 0.570 N ATOM 687 CA LEU A 42 7.765 -9.545 -12.154 1.00 0.610 C ATOM 688 C LEU A 42 7.609 -8.054 -11.818 1.00 0.550 C ATOM 689 O LEU A 42 8.086 -7.177 -12.545 1.00 0.580 O ATOM 690 CB LEU A 42 6.405 -10.145 -12.554 1.00 0.840 C ATOM 691 CG LEU A 42 5.583 -9.425 -13.648 1.00 0.840 C ATOM 692 CD1 LEU A 42 6.356 -9.402 -14.971 1.00 0.840 C ATOM 693 CD2 LEU A 42 4.242 -10.157 -13.795 1.00 0.840 C ATOM 694 H LEU A 42 7.828 -11.101 -10.629 1.00 0.680 H ATOM 695 HA LEU A 42 8.448 -9.628 -12.991 1.00 0.730 H ATOM 696 1HB LEU A 42 6.577 -11.163 -12.894 1.00 1.010 H ATOM 697 2HB LEU A 42 5.779 -10.195 -11.676 1.00 1.010 H ATOM 698 HG LEU A 42 5.394 -8.388 -13.352 1.00 1.010 H ATOM 699 1HD1 LEU A 42 5.755 -8.893 -15.726 1.00 1.010 H ATOM 700 2HD1 LEU A 42 7.295 -8.866 -14.848 1.00 1.010 H ATOM 701 3HD1 LEU A 42 6.557 -10.421 -15.295 1.00 1.010 H ATOM 702 1HD2 LEU A 42 3.637 -9.656 -14.554 1.00 1.010 H ATOM 703 2HD2 LEU A 42 4.414 -11.193 -14.094 1.00 1.010 H ATOM 704 3HD2 LEU A 42 3.713 -10.140 -12.841 1.00 1.010 H ATOM 705 N CYS A 43 6.951 -7.786 -10.722 1.00 0.510 N ATOM 706 CA CYS A 43 6.710 -6.464 -10.228 1.00 0.500 C ATOM 707 C CYS A 43 7.991 -5.826 -9.691 1.00 0.420 C ATOM 708 O CYS A 43 8.148 -4.608 -9.782 1.00 0.460 O ATOM 709 CB CYS A 43 5.561 -6.566 -9.254 1.00 0.700 C ATOM 710 SG CYS A 43 5.828 -7.731 -7.958 1.00 0.700 S ATOM 711 H CYS A 43 6.592 -8.561 -10.206 1.00 0.610 H ATOM 712 HA CYS A 43 6.356 -5.855 -11.061 1.00 0.600 H ATOM 713 1HB CYS A 43 5.382 -5.594 -8.801 1.00 0.840 H ATOM 714 2HB CYS A 43 4.658 -6.854 -9.789 1.00 0.840 H ATOM 715 N PHE A 44 8.938 -6.641 -9.209 1.00 0.340 N ATOM 716 CA PHE A 44 10.236 -6.144 -8.809 1.00 0.280 C ATOM 717 C PHE A 44 10.880 -5.511 -10.007 1.00 0.310 C ATOM 718 O PHE A 44 11.377 -4.394 -9.917 1.00 0.320 O ATOM 719 CB PHE A 44 11.164 -7.229 -8.306 1.00 0.420 C ATOM 720 CG PHE A 44 12.531 -6.722 -8.068 1.00 0.420 C ATOM 721 CD1 PHE A 44 12.837 -6.006 -6.947 1.00 0.420 C ATOM 722 CD2 PHE A 44 13.531 -6.955 -9.001 1.00 0.420 C ATOM 723 CE1 PHE A 44 14.105 -5.528 -6.765 1.00 0.420 C ATOM 724 CE2 PHE A 44 14.793 -6.477 -8.807 1.00 0.420 C ATOM 725 CZ PHE A 44 15.075 -5.763 -7.683 1.00 0.420 C ATOM 726 H PHE A 44 8.750 -7.635 -9.084 1.00 0.410 H ATOM 727 HA PHE A 44 10.108 -5.389 -8.035 1.00 0.340 H ATOM 728 1HB PHE A 44 10.782 -7.664 -7.404 1.00 0.500 H ATOM 729 2HB PHE A 44 11.223 -8.009 -9.038 1.00 0.500 H ATOM 730 HD1 PHE A 44 12.065 -5.812 -6.203 1.00 0.500 H ATOM 731 HD2 PHE A 44 13.299 -7.525 -9.901 1.00 0.500 H ATOM 732 HE1 PHE A 44 14.341 -4.957 -5.876 1.00 0.500 H ATOM 733 HE2 PHE A 44 15.571 -6.663 -9.547 1.00 0.500 H ATOM 734 HZ PHE A 44 16.077 -5.381 -7.520 1.00 0.500 H ATOM 735 N ARG A 45 10.903 -6.240 -11.135 1.00 0.370 N ATOM 736 CA ARG A 45 11.507 -5.711 -12.340 1.00 0.440 C ATOM 737 C ARG A 45 10.831 -4.426 -12.791 1.00 0.490 C ATOM 738 O ARG A 45 11.523 -3.457 -13.106 1.00 0.500 O ATOM 739 CB ARG A 45 11.476 -6.722 -13.473 1.00 0.590 C ATOM 740 CG ARG A 45 12.447 -7.882 -13.333 1.00 0.590 C ATOM 741 CD ARG A 45 12.584 -8.649 -14.611 1.00 0.590 C ATOM 742 NE ARG A 45 11.326 -9.300 -15.027 1.00 0.590 N ATOM 743 CZ ARG A 45 10.903 -10.531 -14.641 1.00 0.590 C ATOM 744 NH1 ARG A 45 11.619 -11.263 -13.814 1.00 0.590 N ATOM 745 NH2 ARG A 45 9.758 -11.003 -15.110 1.00 0.590 N ATOM 746 H ARG A 45 10.515 -7.189 -11.132 1.00 0.440 H ATOM 747 HA ARG A 45 12.550 -5.498 -12.123 1.00 0.530 H ATOM 748 1HB ARG A 45 10.475 -7.149 -13.537 1.00 0.710 H ATOM 749 2HB ARG A 45 11.676 -6.226 -14.405 1.00 0.710 H ATOM 750 1HG ARG A 45 13.428 -7.493 -13.062 1.00 0.710 H ATOM 751 2HG ARG A 45 12.106 -8.557 -12.559 1.00 0.710 H ATOM 752 1HD ARG A 45 12.882 -7.957 -15.403 1.00 0.710 H ATOM 753 2HD ARG A 45 13.353 -9.409 -14.504 1.00 0.710 H ATOM 754 HE ARG A 45 10.738 -8.788 -15.672 1.00 0.710 H ATOM 755 1HH1 ARG A 45 12.492 -10.912 -13.454 1.00 0.710 H ATOM 756 2HH1 ARG A 45 11.299 -12.179 -13.543 1.00 0.710 H ATOM 757 1HH2 ARG A 45 9.206 -10.445 -15.747 1.00 0.710 H ATOM 758 2HH2 ARG A 45 9.437 -11.919 -14.837 1.00 0.710 H ATOM 759 N GLU A 46 9.497 -4.349 -12.736 1.00 0.540 N ATOM 760 CA GLU A 46 8.856 -3.102 -13.147 1.00 0.640 C ATOM 761 C GLU A 46 9.322 -1.936 -12.265 1.00 0.610 C ATOM 762 O GLU A 46 9.637 -0.849 -12.770 1.00 0.680 O ATOM 763 CB GLU A 46 7.331 -3.211 -13.035 1.00 0.860 C ATOM 764 CG GLU A 46 6.654 -4.134 -14.041 1.00 0.860 C ATOM 765 CD GLU A 46 5.162 -4.252 -13.794 1.00 0.860 C ATOM 766 OE1 GLU A 46 4.713 -3.772 -12.776 1.00 0.860 O ATOM 767 OE2 GLU A 46 4.480 -4.813 -14.617 1.00 0.860 O ATOM 768 H GLU A 46 8.945 -5.177 -12.484 1.00 0.650 H ATOM 769 HA GLU A 46 9.130 -2.891 -14.180 1.00 0.770 H ATOM 770 1HB GLU A 46 7.076 -3.569 -12.038 1.00 1.030 H ATOM 771 2HB GLU A 46 6.892 -2.221 -13.144 1.00 1.030 H ATOM 772 1HG GLU A 46 6.821 -3.751 -15.046 1.00 1.030 H ATOM 773 2HG GLU A 46 7.109 -5.123 -13.976 1.00 1.030 H ATOM 774 N LEU A 47 9.411 -2.177 -10.952 1.00 0.540 N ATOM 775 CA LEU A 47 9.876 -1.163 -10.021 1.00 0.570 C ATOM 776 C LEU A 47 11.340 -0.822 -10.271 1.00 0.530 C ATOM 777 O LEU A 47 11.751 0.349 -10.197 1.00 0.610 O ATOM 778 CB LEU A 47 9.715 -1.679 -8.589 1.00 0.790 C ATOM 779 CG LEU A 47 8.297 -1.831 -8.018 1.00 0.790 C ATOM 780 CD1 LEU A 47 8.400 -2.601 -6.700 1.00 0.790 C ATOM 781 CD2 LEU A 47 7.682 -0.459 -7.776 1.00 0.790 C ATOM 782 H LEU A 47 9.097 -3.087 -10.594 1.00 0.650 H ATOM 783 HA LEU A 47 9.284 -0.266 -10.168 1.00 0.680 H ATOM 784 1HB LEU A 47 10.175 -2.660 -8.544 1.00 0.940 H ATOM 785 2HB LEU A 47 10.248 -1.041 -7.942 1.00 0.940 H ATOM 786 HG LEU A 47 7.673 -2.392 -8.710 1.00 0.940 H ATOM 787 1HD1 LEU A 47 7.441 -2.733 -6.264 1.00 0.940 H ATOM 788 2HD1 LEU A 47 8.837 -3.576 -6.899 1.00 0.940 H ATOM 789 3HD1 LEU A 47 9.028 -2.048 -6.006 1.00 0.940 H ATOM 790 1HD2 LEU A 47 6.694 -0.574 -7.361 1.00 0.940 H ATOM 791 2HD2 LEU A 47 8.299 0.090 -7.074 1.00 0.940 H ATOM 792 3HD2 LEU A 47 7.608 0.094 -8.707 1.00 0.940 H ATOM 793 N ALA A 48 12.144 -1.848 -10.549 1.00 0.430 N ATOM 794 CA ALA A 48 13.559 -1.676 -10.790 1.00 0.420 C ATOM 795 C ALA A 48 13.803 -0.792 -11.999 1.00 0.490 C ATOM 796 O ALA A 48 14.620 0.128 -11.931 1.00 0.550 O ATOM 797 CB ALA A 48 14.210 -3.028 -11.008 1.00 0.590 C ATOM 798 H ALA A 48 11.757 -2.791 -10.546 1.00 0.520 H ATOM 799 HA ALA A 48 14.000 -1.199 -9.915 1.00 0.500 H ATOM 800 1HB ALA A 48 15.273 -2.896 -11.172 1.00 0.710 H ATOM 801 2HB ALA A 48 14.040 -3.657 -10.132 1.00 0.710 H ATOM 802 3HB ALA A 48 13.772 -3.496 -11.877 1.00 0.710 H ATOM 803 N TYR A 49 13.021 -0.995 -13.065 1.00 0.530 N ATOM 804 CA TYR A 49 13.176 -0.200 -14.274 1.00 0.650 C ATOM 805 C TYR A 49 12.698 1.221 -14.025 1.00 0.730 C ATOM 806 O TYR A 49 13.301 2.178 -14.514 1.00 0.800 O ATOM 807 CB TYR A 49 12.428 -0.830 -15.453 1.00 0.860 C ATOM 808 CG TYR A 49 13.044 -2.142 -15.959 1.00 0.860 C ATOM 809 CD1 TYR A 49 12.272 -3.296 -15.999 1.00 0.860 C ATOM 810 CD2 TYR A 49 14.382 -2.195 -16.363 1.00 0.860 C ATOM 811 CE1 TYR A 49 12.817 -4.482 -16.436 1.00 0.860 C ATOM 812 CE2 TYR A 49 14.924 -3.391 -16.796 1.00 0.860 C ATOM 813 CZ TYR A 49 14.142 -4.530 -16.831 1.00 0.860 C ATOM 814 OH TYR A 49 14.676 -5.725 -17.259 1.00 0.860 O ATOM 815 H TYR A 49 12.371 -1.787 -13.056 1.00 0.640 H ATOM 816 HA TYR A 49 14.234 -0.147 -14.516 1.00 0.780 H ATOM 817 1HB TYR A 49 11.397 -1.035 -15.148 1.00 1.030 H ATOM 818 2HB TYR A 49 12.392 -0.125 -16.280 1.00 1.030 H ATOM 819 HD1 TYR A 49 11.229 -3.264 -15.684 1.00 1.030 H ATOM 820 HD2 TYR A 49 15.003 -1.301 -16.336 1.00 1.030 H ATOM 821 HE1 TYR A 49 12.207 -5.380 -16.469 1.00 1.030 H ATOM 822 HE2 TYR A 49 15.967 -3.436 -17.108 1.00 1.030 H ATOM 823 HH TYR A 49 15.602 -5.604 -17.480 1.00 1.030 H ATOM 824 N ALA A 50 11.620 1.357 -13.243 1.00 0.740 N ATOM 825 CA ALA A 50 11.080 2.651 -12.854 1.00 0.850 C ATOM 826 C ALA A 50 12.103 3.451 -12.045 1.00 0.840 C ATOM 827 O ALA A 50 12.114 4.684 -12.086 1.00 0.910 O ATOM 828 CB ALA A 50 9.808 2.474 -12.039 1.00 1.150 C ATOM 829 H ALA A 50 11.128 0.519 -12.921 1.00 0.890 H ATOM 830 HA ALA A 50 10.851 3.207 -13.761 1.00 1.020 H ATOM 831 1HB ALA A 50 9.405 3.451 -11.778 1.00 1.380 H ATOM 832 2HB ALA A 50 9.078 1.920 -12.626 1.00 1.380 H ATOM 833 3HB ALA A 50 10.030 1.925 -11.138 1.00 1.380 H ATOM 834 N GLY A 51 12.943 2.745 -11.272 1.00 0.780 N ATOM 835 CA GLY A 51 13.930 3.374 -10.410 1.00 0.790 C ATOM 836 C GLY A 51 13.328 3.566 -9.029 1.00 0.840 C ATOM 837 O GLY A 51 13.842 4.321 -8.203 1.00 0.920 O ATOM 838 H GLY A 51 12.871 1.724 -11.240 1.00 0.940 H ATOM 839 1HA GLY A 51 14.814 2.737 -10.350 1.00 0.950 H ATOM 840 2HA GLY A 51 14.235 4.331 -10.829 1.00 0.950 H ATOM 841 N ALA A 52 12.188 2.905 -8.820 1.00 0.830 N ATOM 842 CA ALA A 52 11.409 2.928 -7.597 1.00 0.880 C ATOM 843 C ALA A 52 12.137 2.350 -6.380 1.00 0.860 C ATOM 844 O ALA A 52 11.838 2.741 -5.252 1.00 0.980 O ATOM 845 CB ALA A 52 10.119 2.178 -7.819 1.00 1.210 C ATOM 846 H ALA A 52 11.871 2.282 -9.564 1.00 1.000 H ATOM 847 HA ALA A 52 11.175 3.969 -7.378 1.00 1.060 H ATOM 848 1HB ALA A 52 9.509 2.232 -6.920 1.00 1.450 H ATOM 849 2HB ALA A 52 9.579 2.617 -8.656 1.00 1.450 H ATOM 850 3HB ALA A 52 10.355 1.163 -8.038 1.00 1.450 H ATOM 851 N ILE A 53 13.036 1.379 -6.581 1.00 0.740 N ATOM 852 CA ILE A 53 13.707 0.745 -5.454 1.00 0.750 C ATOM 853 C ILE A 53 15.162 1.219 -5.331 1.00 0.780 C ATOM 854 O ILE A 53 15.968 0.948 -6.230 1.00 0.720 O ATOM 855 CB ILE A 53 13.726 -0.780 -5.622 1.00 1.050 C ATOM 856 CG1 ILE A 53 12.299 -1.307 -5.744 1.00 1.050 C ATOM 857 CG2 ILE A 53 14.415 -1.407 -4.404 1.00 1.050 C ATOM 858 CD1 ILE A 53 12.208 -2.753 -6.191 1.00 1.050 C ATOM 859 H ILE A 53 13.257 1.072 -7.518 1.00 0.890 H ATOM 860 HA ILE A 53 13.138 0.955 -4.562 1.00 0.900 H ATOM 861 HB ILE A 53 14.265 -1.042 -6.531 1.00 1.260 H ATOM 862 1HG1 ILE A 53 11.802 -1.208 -4.782 1.00 1.260 H ATOM 863 2HG1 ILE A 53 11.779 -0.696 -6.450 1.00 1.260 H ATOM 864 1HG2 ILE A 53 14.447 -2.469 -4.513 1.00 1.260 H ATOM 865 2HG2 ILE A 53 15.432 -1.040 -4.307 1.00 1.260 H ATOM 866 3HG2 ILE A 53 13.863 -1.151 -3.501 1.00 1.260 H ATOM 867 1HD1 ILE A 53 11.178 -3.053 -6.266 1.00 1.260 H ATOM 868 2HD1 ILE A 53 12.685 -2.862 -7.172 1.00 1.260 H ATOM 869 3HD1 ILE A 53 12.693 -3.390 -5.477 1.00 1.260 H ATOM 870 N PRO A 54 15.541 1.914 -4.246 1.00 0.890 N ATOM 871 CA PRO A 54 16.871 2.431 -4.026 1.00 0.950 C ATOM 872 C PRO A 54 17.891 1.317 -4.085 1.00 0.920 C ATOM 873 O PRO A 54 17.646 0.219 -3.587 1.00 0.910 O ATOM 874 CB PRO A 54 16.779 3.007 -2.607 1.00 1.420 C ATOM 875 CG PRO A 54 15.326 3.353 -2.430 1.00 1.420 C ATOM 876 CD PRO A 54 14.576 2.276 -3.182 1.00 1.420 C ATOM 877 HA PRO A 54 17.090 3.212 -4.770 1.00 1.140 H ATOM 878 1HB PRO A 54 17.134 2.262 -1.876 1.00 1.710 H ATOM 879 2HB PRO A 54 17.439 3.882 -2.514 1.00 1.710 H ATOM 880 1HG PRO A 54 15.069 3.378 -1.360 1.00 1.710 H ATOM 881 2HG PRO A 54 15.124 4.360 -2.827 1.00 1.710 H ATOM 882 1HD PRO A 54 14.351 1.413 -2.537 1.00 1.710 H ATOM 883 2HD PRO A 54 13.677 2.756 -3.593 1.00 1.710 H ATOM 884 N GLY A 55 19.036 1.602 -4.682 1.00 0.940 N ATOM 885 CA GLY A 55 20.110 0.625 -4.765 1.00 0.970 C ATOM 886 C GLY A 55 20.008 -0.347 -5.939 1.00 0.840 C ATOM 887 O GLY A 55 20.988 -1.024 -6.258 1.00 0.870 O ATOM 888 H GLY A 55 19.172 2.519 -5.082 1.00 1.130 H ATOM 889 1HA GLY A 55 21.061 1.154 -4.824 1.00 1.160 H ATOM 890 2HA GLY A 55 20.136 0.055 -3.837 1.00 1.160 H ATOM 891 N VAL A 56 18.843 -0.455 -6.580 1.00 0.710 N ATOM 892 CA VAL A 56 18.730 -1.424 -7.655 1.00 0.590 C ATOM 893 C VAL A 56 19.180 -0.835 -8.985 1.00 0.630 C ATOM 894 O VAL A 56 18.603 0.121 -9.493 1.00 1.120 O ATOM 895 CB VAL A 56 17.281 -1.946 -7.731 1.00 0.870 C ATOM 896 CG1 VAL A 56 17.102 -2.906 -8.886 1.00 0.870 C ATOM 897 CG2 VAL A 56 16.949 -2.652 -6.420 1.00 0.870 C ATOM 898 H VAL A 56 18.030 0.127 -6.338 1.00 0.850 H ATOM 899 HA VAL A 56 19.376 -2.269 -7.422 1.00 0.710 H ATOM 900 HB VAL A 56 16.600 -1.102 -7.877 1.00 1.050 H ATOM 901 1HG1 VAL A 56 16.077 -3.245 -8.889 1.00 1.050 H ATOM 902 2HG1 VAL A 56 17.324 -2.404 -9.828 1.00 1.050 H ATOM 903 3HG1 VAL A 56 17.769 -3.759 -8.764 1.00 1.050 H ATOM 904 1HG2 VAL A 56 15.926 -3.011 -6.449 1.00 1.050 H ATOM 905 2HG2 VAL A 56 17.625 -3.491 -6.276 1.00 1.050 H ATOM 906 3HG2 VAL A 56 17.069 -1.952 -5.598 1.00 1.050 H ATOM 907 N LYS A 57 20.182 -1.457 -9.588 1.00 0.620 N ATOM 908 CA LYS A 57 20.733 -0.979 -10.848 1.00 0.610 C ATOM 909 C LYS A 57 20.719 -2.078 -11.892 1.00 0.860 C ATOM 910 O LYS A 57 20.908 -3.250 -11.571 1.00 1.200 O ATOM 911 CB LYS A 57 22.173 -0.491 -10.652 1.00 0.860 C ATOM 912 CG LYS A 57 22.364 0.657 -9.637 1.00 0.860 C ATOM 913 CD LYS A 57 21.772 1.977 -10.135 1.00 0.860 C ATOM 914 CE LYS A 57 22.060 3.117 -9.170 1.00 0.860 C ATOM 915 NZ LYS A 57 21.452 4.407 -9.629 1.00 0.860 N ATOM 916 H LYS A 57 20.600 -2.257 -9.132 1.00 0.740 H ATOM 917 HA LYS A 57 20.114 -0.165 -11.222 1.00 0.730 H ATOM 918 1HB LYS A 57 22.789 -1.326 -10.319 1.00 1.030 H ATOM 919 2HB LYS A 57 22.574 -0.163 -11.613 1.00 1.030 H ATOM 920 1HG LYS A 57 21.886 0.388 -8.692 1.00 1.030 H ATOM 921 2HG LYS A 57 23.428 0.795 -9.452 1.00 1.030 H ATOM 922 1HD LYS A 57 22.183 2.222 -11.114 1.00 1.030 H ATOM 923 2HD LYS A 57 20.690 1.879 -10.225 1.00 1.030 H ATOM 924 1HE LYS A 57 21.651 2.862 -8.192 1.00 1.030 H ATOM 925 2HE LYS A 57 23.138 3.248 -9.080 1.00 1.030 H ATOM 926 1HZ LYS A 57 21.663 5.137 -8.962 1.00 1.030 H ATOM 927 2HZ LYS A 57 21.832 4.659 -10.531 1.00 1.030 H ATOM 928 3HZ LYS A 57 20.449 4.300 -9.705 1.00 1.030 H ATOM 929 N LYS A 58 20.513 -1.686 -13.147 1.00 1.230 N ATOM 930 CA LYS A 58 20.507 -2.596 -14.298 1.00 1.740 C ATOM 931 C LYS A 58 21.924 -3.020 -14.653 1.00 1.480 C ATOM 932 O LYS A 58 22.813 -2.177 -14.757 1.00 1.450 O ATOM 933 CB LYS A 58 19.840 -1.909 -15.496 1.00 2.230 C ATOM 934 CG LYS A 58 19.684 -2.768 -16.750 1.00 2.230 C ATOM 935 CD LYS A 58 18.957 -1.994 -17.859 1.00 2.230 C ATOM 936 CE LYS A 58 18.831 -2.825 -19.131 1.00 2.230 C ATOM 937 NZ LYS A 58 18.163 -2.066 -20.233 1.00 2.230 N ATOM 938 H LYS A 58 20.359 -0.702 -13.314 1.00 1.480 H ATOM 939 HA LYS A 58 19.942 -3.490 -14.035 1.00 2.090 H ATOM 940 1HB LYS A 58 18.848 -1.565 -15.206 1.00 2.680 H ATOM 941 2HB LYS A 58 20.422 -1.031 -15.773 1.00 2.680 H ATOM 942 1HG LYS A 58 20.673 -3.064 -17.117 1.00 2.680 H ATOM 943 2HG LYS A 58 19.121 -3.669 -16.509 1.00 2.680 H ATOM 944 1HD LYS A 58 17.959 -1.711 -17.517 1.00 2.680 H ATOM 945 2HD LYS A 58 19.516 -1.086 -18.086 1.00 2.680 H ATOM 946 1HE LYS A 58 19.827 -3.124 -19.459 1.00 2.680 H ATOM 947 2HE LYS A 58 18.248 -3.720 -18.914 1.00 2.680 H ATOM 948 1HZ LYS A 58 18.100 -2.650 -21.056 1.00 2.680 H ATOM 949 2HZ LYS A 58 17.234 -1.791 -19.946 1.00 2.680 H ATOM 950 3HZ LYS A 58 18.703 -1.240 -20.450 1.00 2.680 H ATOM 951 N ALA A 59 22.141 -4.323 -14.821 1.00 1.480 N ATOM 952 CA ALA A 59 23.462 -4.832 -15.177 1.00 1.510 C ATOM 953 C ALA A 59 23.899 -4.311 -16.539 1.00 1.720 C ATOM 954 O ALA A 59 23.094 -4.256 -17.470 1.00 2.250 O ATOM 955 CB ALA A 59 23.457 -6.349 -15.186 1.00 2.100 C ATOM 956 H ALA A 59 21.372 -4.965 -14.702 1.00 1.780 H ATOM 957 HA ALA A 59 24.175 -4.476 -14.434 1.00 1.810 H ATOM 958 1HB ALA A 59 24.455 -6.713 -15.431 1.00 2.520 H ATOM 959 2HB ALA A 59 23.168 -6.716 -14.201 1.00 2.520 H ATOM 960 3HB ALA A 59 22.748 -6.705 -15.931 1.00 2.520 H ATOM 961 N SER A 60 25.189 -4.018 -16.676 1.00 1.950 N ATOM 962 CA SER A 60 25.741 -3.547 -17.938 1.00 2.420 C ATOM 963 C SER A 60 27.240 -3.801 -17.996 1.00 3.020 C ATOM 964 O SER A 60 27.854 -4.164 -16.986 1.00 3.240 O ATOM 965 CB SER A 60 25.469 -2.066 -18.108 1.00 3.200 C ATOM 966 OG SER A 60 26.212 -1.314 -17.191 1.00 3.200 O ATOM 967 H SER A 60 25.802 -4.082 -15.878 1.00 2.340 H ATOM 968 HA SER A 60 25.266 -4.093 -18.753 1.00 2.900 H ATOM 969 1HB SER A 60 25.718 -1.760 -19.121 1.00 3.840 H ATOM 970 2HB SER A 60 24.404 -1.875 -17.959 1.00 3.840 H ATOM 971 HG SER A 60 25.922 -0.406 -17.300 1.00 3.840 H ATOM 972 N TRP A 61 27.818 -3.616 -19.181 1.00 3.560 N ATOM 973 CA TRP A 61 29.249 -3.779 -19.393 1.00 4.350 C ATOM 974 C TRP A 61 29.666 -3.066 -20.675 1.00 4.910 C ATOM 975 O TRP A 61 30.330 -2.030 -20.618 1.00 5.410 O ATOM 976 OXT TRP A 61 29.051 -3.330 -21.708 1.00 6.520 O ATOM 977 CB TRP A 61 29.600 -5.269 -19.477 1.00 5.400 C ATOM 978 CG TRP A 61 31.066 -5.557 -19.567 1.00 5.400 C ATOM 979 CD1 TRP A 61 31.912 -5.730 -18.516 1.00 5.400 C ATOM 980 CD2 TRP A 61 31.871 -5.727 -20.760 1.00 5.400 C ATOM 981 NE1 TRP A 61 33.179 -5.991 -18.966 1.00 5.400 N ATOM 982 CE2 TRP A 61 33.172 -5.993 -20.337 1.00 5.400 C ATOM 983 CE3 TRP A 61 31.593 -5.676 -22.131 1.00 5.400 C ATOM 984 CZ2 TRP A 61 34.204 -6.210 -21.234 1.00 5.400 C ATOM 985 CZ3 TRP A 61 32.626 -5.893 -23.031 1.00 5.400 C ATOM 986 CH2 TRP A 61 33.898 -6.153 -22.593 1.00 5.400 C ATOM 987 H TRP A 61 27.244 -3.333 -19.962 1.00 4.270 H ATOM 988 HA TRP A 61 29.784 -3.332 -18.555 1.00 5.220 H ATOM 989 1HB TRP A 61 29.216 -5.781 -18.595 1.00 6.480 H ATOM 990 2HB TRP A 61 29.115 -5.707 -20.344 1.00 6.480 H ATOM 991 HD1 TRP A 61 31.619 -5.669 -17.468 1.00 6.480 H ATOM 992 HE1 TRP A 61 33.989 -6.157 -18.383 1.00 6.480 H ATOM 993 HE3 TRP A 61 30.581 -5.464 -22.482 1.00 6.480 H ATOM 994 HZ2 TRP A 61 35.222 -6.419 -20.906 1.00 6.480 H ATOM 995 HZ3 TRP A 61 32.399 -5.849 -24.095 1.00 6.480 H ATOM 996 HH2 TRP A 61 34.688 -6.318 -23.325 1.00 6.480 H TER 997 ENDMDL REMARK ID 14032 MODEL 2 SSGCID - MygeA.18852.a 30S ribosomal protein S14 type Z MG_164 PFRMAT TS TARGET SSGCID - MygeA.18852.a 30S ribosomal protein S14 type Z MG_164 AUTHOR BAKER-ROSETTASERVER METHOD ROSETTA provides both ab initio and METHOD comparative models of protein domains. METHOD Comparative models are built from structures METHOD detected and aligned by HHSEARCH, SPARKS, and METHOD Raptor. Loop regions are assembled from fragments and METHOD optimized to fit the aligned template structures. METHOD De novo models are built using the Rosetta de METHOD novo protocol. The procedure is fully automated. MODEL 2 PARENT 3j9mAK_305 REMARK PARENT 3j9mAK_305 REMARK PARSRC alignment REMARK SCORE 0.81 ATOM 1 N MET A 1 -7.072 -15.866 -11.417 1.00 4.720 N ATOM 2 CA MET A 1 -7.517 -14.529 -11.799 1.00 4.540 C ATOM 3 C MET A 1 -8.083 -13.753 -10.619 1.00 3.630 C ATOM 4 O MET A 1 -7.807 -12.561 -10.456 1.00 3.410 O ATOM 5 CB MET A 1 -8.566 -14.607 -12.911 1.00 6.430 C ATOM 6 CG MET A 1 -8.050 -15.125 -14.267 1.00 6.430 C ATOM 7 SD MET A 1 -6.678 -14.147 -14.945 1.00 6.430 S ATOM 8 CE MET A 1 -7.464 -12.587 -15.363 1.00 6.430 C ATOM 9 1H MET A 1 -6.214 -16.078 -11.907 1.00 5.660 H ATOM 10 2H MET A 1 -6.900 -15.900 -10.421 1.00 5.660 H ATOM 11 3H MET A 1 -7.772 -16.549 -11.665 1.00 5.660 H ATOM 12 HA MET A 1 -6.655 -13.974 -12.166 1.00 5.450 H ATOM 13 1HB MET A 1 -9.369 -15.272 -12.598 1.00 7.710 H ATOM 14 2HB MET A 1 -9.012 -13.626 -13.059 1.00 7.710 H ATOM 15 1HG MET A 1 -7.721 -16.158 -14.173 1.00 7.710 H ATOM 16 2HG MET A 1 -8.869 -15.103 -14.990 1.00 7.710 H ATOM 17 1HE MET A 1 -6.722 -11.914 -15.795 1.00 7.710 H ATOM 18 2HE MET A 1 -8.259 -12.762 -16.089 1.00 7.710 H ATOM 19 3HE MET A 1 -7.881 -12.128 -14.469 1.00 7.710 H ATOM 20 N ALA A 2 -8.845 -14.425 -9.750 1.00 3.480 N ATOM 21 CA ALA A 2 -9.451 -13.749 -8.604 1.00 2.880 C ATOM 22 C ALA A 2 -8.444 -13.545 -7.487 1.00 1.940 C ATOM 23 O ALA A 2 -8.600 -14.081 -6.384 1.00 2.520 O ATOM 24 CB ALA A 2 -10.629 -14.551 -8.078 1.00 4.270 C ATOM 25 H ALA A 2 -9.049 -15.403 -9.886 1.00 4.180 H ATOM 26 HA ALA A 2 -9.801 -12.770 -8.932 1.00 3.460 H ATOM 27 1HB ALA A 2 -11.085 -14.022 -7.241 1.00 5.130 H ATOM 28 2HB ALA A 2 -11.367 -14.677 -8.870 1.00 5.130 H ATOM 29 3HB ALA A 2 -10.286 -15.528 -7.744 1.00 5.130 H ATOM 30 N LYS A 3 -7.444 -12.707 -7.753 1.00 0.980 N ATOM 31 CA LYS A 3 -6.430 -12.434 -6.768 1.00 0.940 C ATOM 32 C LYS A 3 -7.093 -11.893 -5.531 1.00 0.760 C ATOM 33 O LYS A 3 -6.658 -12.179 -4.424 1.00 0.740 O ATOM 34 CB LYS A 3 -5.378 -11.453 -7.265 1.00 1.330 C ATOM 35 CG LYS A 3 -4.431 -12.001 -8.308 1.00 1.330 C ATOM 36 CD LYS A 3 -3.412 -10.937 -8.693 1.00 1.330 C ATOM 37 CE LYS A 3 -2.389 -11.446 -9.690 1.00 1.330 C ATOM 38 NZ LYS A 3 -1.398 -10.390 -10.026 1.00 1.330 N ATOM 39 H LYS A 3 -7.414 -12.296 -8.687 1.00 1.180 H ATOM 40 HA LYS A 3 -5.935 -13.365 -6.505 1.00 1.130 H ATOM 41 1HB LYS A 3 -5.870 -10.576 -7.683 1.00 1.600 H ATOM 42 2HB LYS A 3 -4.778 -11.121 -6.420 1.00 1.600 H ATOM 43 1HG LYS A 3 -3.912 -12.873 -7.906 1.00 1.600 H ATOM 44 2HG LYS A 3 -4.996 -12.306 -9.190 1.00 1.600 H ATOM 45 1HD LYS A 3 -3.929 -10.083 -9.129 1.00 1.600 H ATOM 46 2HD LYS A 3 -2.881 -10.601 -7.800 1.00 1.600 H ATOM 47 1HE LYS A 3 -1.862 -12.297 -9.258 1.00 1.600 H ATOM 48 2HE LYS A 3 -2.894 -11.764 -10.601 1.00 1.600 H ATOM 49 1HZ LYS A 3 -0.723 -10.751 -10.679 1.00 1.600 H ATOM 50 2HZ LYS A 3 -1.866 -9.595 -10.429 1.00 1.600 H ATOM 51 3HZ LYS A 3 -0.913 -10.100 -9.141 1.00 1.600 H ATOM 52 N LYS A 4 -8.164 -11.114 -5.682 1.00 0.790 N ATOM 53 CA LYS A 4 -8.825 -10.580 -4.508 1.00 0.780 C ATOM 54 C LYS A 4 -9.202 -11.675 -3.521 1.00 0.760 C ATOM 55 O LYS A 4 -9.070 -11.475 -2.314 1.00 0.720 O ATOM 56 CB LYS A 4 -10.076 -9.789 -4.878 1.00 1.100 C ATOM 57 CG LYS A 4 -10.791 -9.171 -3.664 1.00 1.100 C ATOM 58 CD LYS A 4 -11.990 -8.329 -4.077 1.00 1.100 C ATOM 59 CE LYS A 4 -12.711 -7.768 -2.856 1.00 1.100 C ATOM 60 NZ LYS A 4 -13.892 -6.939 -3.236 1.00 1.100 N ATOM 61 H LYS A 4 -8.496 -10.880 -6.608 1.00 0.950 H ATOM 62 HA LYS A 4 -8.130 -9.907 -4.005 1.00 0.940 H ATOM 63 1HB LYS A 4 -9.813 -8.987 -5.565 1.00 1.320 H ATOM 64 2HB LYS A 4 -10.783 -10.445 -5.387 1.00 1.320 H ATOM 65 1HG LYS A 4 -11.144 -9.964 -3.001 1.00 1.320 H ATOM 66 2HG LYS A 4 -10.088 -8.551 -3.109 1.00 1.320 H ATOM 67 1HD LYS A 4 -11.658 -7.503 -4.707 1.00 1.320 H ATOM 68 2HD LYS A 4 -12.685 -8.944 -4.648 1.00 1.320 H ATOM 69 1HE LYS A 4 -13.046 -8.595 -2.230 1.00 1.320 H ATOM 70 2HE LYS A 4 -12.016 -7.153 -2.284 1.00 1.320 H ATOM 71 1HZ LYS A 4 -14.340 -6.587 -2.400 1.00 1.320 H ATOM 72 2HZ LYS A 4 -13.591 -6.161 -3.807 1.00 1.320 H ATOM 73 3HZ LYS A 4 -14.549 -7.502 -3.756 1.00 1.320 H ATOM 74 N SER A 5 -9.700 -12.819 -4.008 1.00 0.860 N ATOM 75 CA SER A 5 -10.122 -13.879 -3.111 1.00 0.900 C ATOM 76 C SER A 5 -8.915 -14.431 -2.383 1.00 0.790 C ATOM 77 O SER A 5 -8.970 -14.700 -1.179 1.00 0.810 O ATOM 78 CB SER A 5 -10.819 -14.983 -3.889 1.00 1.240 C ATOM 79 OG SER A 5 -12.039 -14.537 -4.433 1.00 1.240 O ATOM 80 H SER A 5 -9.731 -12.992 -5.010 1.00 1.030 H ATOM 81 HA SER A 5 -10.814 -13.464 -2.378 1.00 1.080 H ATOM 82 1HB SER A 5 -10.165 -15.322 -4.693 1.00 1.490 H ATOM 83 2HB SER A 5 -10.997 -15.832 -3.234 1.00 1.490 H ATOM 84 HG SER A 5 -12.370 -15.263 -4.969 1.00 1.490 H ATOM 85 N LEU A 6 -7.810 -14.576 -3.113 1.00 0.740 N ATOM 86 CA LEU A 6 -6.593 -15.103 -2.512 1.00 0.710 C ATOM 87 C LEU A 6 -6.034 -14.148 -1.455 1.00 0.560 C ATOM 88 O LEU A 6 -5.598 -14.591 -0.385 1.00 0.590 O ATOM 89 CB LEU A 6 -5.541 -15.331 -3.602 1.00 1.010 C ATOM 90 CG LEU A 6 -5.856 -16.438 -4.650 1.00 1.010 C ATOM 91 CD1 LEU A 6 -4.801 -16.381 -5.744 1.00 1.010 C ATOM 92 CD2 LEU A 6 -5.883 -17.824 -3.991 1.00 1.010 C ATOM 93 H LEU A 6 -7.866 -14.355 -4.115 1.00 0.890 H ATOM 94 HA LEU A 6 -6.828 -16.037 -2.016 1.00 0.850 H ATOM 95 1HB LEU A 6 -5.399 -14.397 -4.138 1.00 1.210 H ATOM 96 2HB LEU A 6 -4.604 -15.583 -3.120 1.00 1.210 H ATOM 97 HG LEU A 6 -6.827 -16.235 -5.109 1.00 1.210 H ATOM 98 1HD1 LEU A 6 -5.022 -17.136 -6.498 1.00 1.210 H ATOM 99 2HD1 LEU A 6 -4.803 -15.400 -6.209 1.00 1.210 H ATOM 100 3HD1 LEU A 6 -3.826 -16.573 -5.321 1.00 1.210 H ATOM 101 1HD2 LEU A 6 -6.100 -18.575 -4.752 1.00 1.210 H ATOM 102 2HD2 LEU A 6 -4.921 -18.035 -3.542 1.00 1.210 H ATOM 103 3HD2 LEU A 6 -6.651 -17.869 -3.228 1.00 1.210 H ATOM 104 N LYS A 7 -6.076 -12.839 -1.735 1.00 0.490 N ATOM 105 CA LYS A 7 -5.581 -11.835 -0.797 1.00 0.480 C ATOM 106 C LYS A 7 -6.421 -11.858 0.479 1.00 0.500 C ATOM 107 O LYS A 7 -5.884 -11.776 1.595 1.00 0.560 O ATOM 108 CB LYS A 7 -5.603 -10.435 -1.431 1.00 0.680 C ATOM 109 CG LYS A 7 -4.552 -10.186 -2.561 1.00 0.680 C ATOM 110 CD LYS A 7 -4.705 -8.765 -3.155 1.00 0.680 C ATOM 111 CE LYS A 7 -3.740 -8.505 -4.331 1.00 0.680 C ATOM 112 NZ LYS A 7 -3.937 -7.132 -4.932 1.00 0.680 N ATOM 113 H LYS A 7 -6.428 -12.551 -2.652 1.00 0.590 H ATOM 114 HA LYS A 7 -4.554 -12.084 -0.530 1.00 0.580 H ATOM 115 1HB LYS A 7 -6.591 -10.262 -1.863 1.00 0.810 H ATOM 116 2HB LYS A 7 -5.451 -9.686 -0.657 1.00 0.810 H ATOM 117 1HG LYS A 7 -3.546 -10.298 -2.150 1.00 0.810 H ATOM 118 2HG LYS A 7 -4.684 -10.925 -3.350 1.00 0.810 H ATOM 119 1HD LYS A 7 -5.730 -8.639 -3.510 1.00 0.810 H ATOM 120 2HD LYS A 7 -4.516 -8.026 -2.377 1.00 0.810 H ATOM 121 1HE LYS A 7 -2.711 -8.593 -3.985 1.00 0.810 H ATOM 122 2HE LYS A 7 -3.918 -9.252 -5.102 1.00 0.810 H ATOM 123 1HZ LYS A 7 -3.298 -7.000 -5.716 1.00 0.810 H ATOM 124 2HZ LYS A 7 -4.885 -7.042 -5.266 1.00 0.810 H ATOM 125 3HZ LYS A 7 -3.760 -6.423 -4.231 1.00 0.810 H ATOM 126 N VAL A 8 -7.741 -11.985 0.318 1.00 0.550 N ATOM 127 CA VAL A 8 -8.621 -12.040 1.466 1.00 0.610 C ATOM 128 C VAL A 8 -8.351 -13.277 2.294 1.00 0.570 C ATOM 129 O VAL A 8 -8.262 -13.179 3.512 1.00 0.590 O ATOM 130 CB VAL A 8 -10.105 -11.984 1.046 1.00 0.830 C ATOM 131 CG1 VAL A 8 -11.024 -12.271 2.256 1.00 0.830 C ATOM 132 CG2 VAL A 8 -10.417 -10.584 0.496 1.00 0.830 C ATOM 133 H VAL A 8 -8.127 -12.001 -0.632 1.00 0.660 H ATOM 134 HA VAL A 8 -8.421 -11.165 2.083 1.00 0.730 H ATOM 135 HB VAL A 8 -10.290 -12.738 0.277 1.00 1.000 H ATOM 136 1HG1 VAL A 8 -12.062 -12.221 1.934 1.00 1.000 H ATOM 137 2HG1 VAL A 8 -10.825 -13.262 2.654 1.00 1.000 H ATOM 138 3HG1 VAL A 8 -10.847 -11.526 3.033 1.00 1.000 H ATOM 139 1HG2 VAL A 8 -11.459 -10.537 0.184 1.00 1.000 H ATOM 140 2HG2 VAL A 8 -10.234 -9.844 1.273 1.00 1.000 H ATOM 141 3HG2 VAL A 8 -9.784 -10.366 -0.347 1.00 1.000 H ATOM 142 N LYS A 9 -8.234 -14.447 1.660 1.00 0.570 N ATOM 143 CA LYS A 9 -7.980 -15.667 2.414 1.00 0.600 C ATOM 144 C LYS A 9 -6.660 -15.601 3.174 1.00 0.600 C ATOM 145 O LYS A 9 -6.595 -15.982 4.340 1.00 0.630 O ATOM 146 CB LYS A 9 -7.987 -16.880 1.488 1.00 0.830 C ATOM 147 CG LYS A 9 -9.365 -17.262 0.960 1.00 0.830 C ATOM 148 CD LYS A 9 -9.280 -18.449 0.004 1.00 0.830 C ATOM 149 CE LYS A 9 -10.652 -18.827 -0.544 1.00 0.830 C ATOM 150 NZ LYS A 9 -10.577 -19.977 -1.495 1.00 0.830 N ATOM 151 H LYS A 9 -8.343 -14.488 0.642 1.00 0.680 H ATOM 152 HA LYS A 9 -8.778 -15.785 3.141 1.00 0.720 H ATOM 153 1HB LYS A 9 -7.349 -16.670 0.624 1.00 0.990 H ATOM 154 2HB LYS A 9 -7.565 -17.738 2.007 1.00 0.990 H ATOM 155 1HG LYS A 9 -10.007 -17.525 1.802 1.00 0.990 H ATOM 156 2HG LYS A 9 -9.808 -16.413 0.449 1.00 0.990 H ATOM 157 1HD LYS A 9 -8.626 -18.187 -0.832 1.00 0.990 H ATOM 158 2HD LYS A 9 -8.855 -19.307 0.522 1.00 0.990 H ATOM 159 1HE LYS A 9 -11.305 -19.095 0.284 1.00 0.990 H ATOM 160 2HE LYS A 9 -11.075 -17.966 -1.064 1.00 0.990 H ATOM 161 1HZ LYS A 9 -11.504 -20.194 -1.836 1.00 0.990 H ATOM 162 2HZ LYS A 9 -9.982 -19.734 -2.275 1.00 0.990 H ATOM 163 3HZ LYS A 9 -10.197 -20.784 -1.021 1.00 0.990 H ATOM 164 N GLN A 10 -5.614 -15.062 2.538 1.00 0.640 N ATOM 165 CA GLN A 10 -4.295 -14.939 3.155 1.00 0.770 C ATOM 166 C GLN A 10 -4.349 -14.045 4.389 1.00 0.780 C ATOM 167 O GLN A 10 -3.614 -14.262 5.354 1.00 0.960 O ATOM 168 CB GLN A 10 -3.270 -14.430 2.131 1.00 1.030 C ATOM 169 CG GLN A 10 -1.772 -14.464 2.582 1.00 1.030 C ATOM 170 CD GLN A 10 -1.315 -13.222 3.329 1.00 1.030 C ATOM 171 OE1 GLN A 10 -1.908 -12.146 3.197 1.00 1.030 O ATOM 172 NE2 GLN A 10 -0.229 -13.353 4.092 1.00 1.030 N ATOM 173 H GLN A 10 -5.719 -14.771 1.561 1.00 0.770 H ATOM 174 HA GLN A 10 -3.979 -15.928 3.480 1.00 0.920 H ATOM 175 1HB GLN A 10 -3.359 -15.027 1.225 1.00 1.230 H ATOM 176 2HB GLN A 10 -3.524 -13.404 1.857 1.00 1.230 H ATOM 177 1HG GLN A 10 -1.630 -15.316 3.253 1.00 1.230 H ATOM 178 2HG GLN A 10 -1.140 -14.584 1.719 1.00 1.230 H ATOM 179 1HE2 GLN A 10 0.123 -12.568 4.601 1.00 1.230 H ATOM 180 2HE2 GLN A 10 0.256 -14.260 4.155 1.00 1.230 H ATOM 181 N SER A 11 -5.241 -13.059 4.373 1.00 0.720 N ATOM 182 CA SER A 11 -5.393 -12.124 5.468 1.00 0.840 C ATOM 183 C SER A 11 -6.210 -12.687 6.651 1.00 0.810 C ATOM 184 O SER A 11 -6.335 -12.014 7.679 1.00 0.930 O ATOM 185 CB SER A 11 -6.069 -10.865 4.954 1.00 1.130 C ATOM 186 OG SER A 11 -5.271 -10.205 4.001 1.00 1.130 O ATOM 187 H SER A 11 -5.792 -12.888 3.527 1.00 0.860 H ATOM 188 HA SER A 11 -4.397 -11.868 5.827 1.00 1.010 H ATOM 189 1HB SER A 11 -7.029 -11.125 4.510 1.00 1.350 H ATOM 190 2HB SER A 11 -6.266 -10.198 5.790 1.00 1.350 H ATOM 191 HG SER A 11 -5.309 -10.755 3.189 1.00 1.350 H ATOM 192 N ARG A 12 -6.808 -13.886 6.508 1.00 0.710 N ATOM 193 CA ARG A 12 -7.619 -14.473 7.579 1.00 0.770 C ATOM 194 C ARG A 12 -6.750 -15.231 8.625 1.00 1.150 C ATOM 195 O ARG A 12 -5.981 -16.144 8.286 1.00 1.770 O ATOM 196 CB ARG A 12 -8.659 -15.434 7.021 1.00 1.050 C ATOM 197 CG ARG A 12 -9.745 -14.776 6.201 1.00 1.050 C ATOM 198 CD ARG A 12 -10.703 -15.752 5.644 1.00 1.050 C ATOM 199 NE ARG A 12 -11.701 -15.096 4.813 1.00 1.050 N ATOM 200 CZ ARG A 12 -12.659 -15.722 4.098 1.00 1.050 C ATOM 201 NH1 ARG A 12 -12.752 -17.038 4.112 1.00 1.050 N ATOM 202 NH2 ARG A 12 -13.512 -15.008 3.382 1.00 1.050 N ATOM 203 H ARG A 12 -6.667 -14.425 5.647 1.00 0.850 H ATOM 204 HA ARG A 12 -8.162 -13.655 8.028 1.00 0.920 H ATOM 205 1HB ARG A 12 -8.165 -16.167 6.385 1.00 1.260 H ATOM 206 2HB ARG A 12 -9.134 -15.974 7.837 1.00 1.260 H ATOM 207 1HG ARG A 12 -10.292 -14.071 6.822 1.00 1.260 H ATOM 208 2HG ARG A 12 -9.293 -14.249 5.382 1.00 1.260 H ATOM 209 1HD ARG A 12 -10.162 -16.474 5.033 1.00 1.260 H ATOM 210 2HD ARG A 12 -11.212 -16.265 6.458 1.00 1.260 H ATOM 211 HE ARG A 12 -11.671 -14.083 4.771 1.00 1.260 H ATOM 212 1HH1 ARG A 12 -12.109 -17.589 4.659 1.00 1.260 H ATOM 213 2HH1 ARG A 12 -13.475 -17.500 3.577 1.00 1.260 H ATOM 214 1HH2 ARG A 12 -13.445 -13.999 3.372 1.00 1.260 H ATOM 215 2HH2 ARG A 12 -14.234 -15.467 2.845 1.00 1.260 H ATOM 216 N PRO A 13 -6.899 -14.942 9.940 1.00 1.570 N ATOM 217 CA PRO A 13 -6.119 -15.492 11.052 1.00 2.130 C ATOM 218 C PRO A 13 -6.517 -16.902 11.477 1.00 1.750 C ATOM 219 O PRO A 13 -7.038 -17.115 12.579 1.00 1.620 O ATOM 220 CB PRO A 13 -6.419 -14.493 12.175 1.00 3.190 C ATOM 221 CG PRO A 13 -7.830 -14.032 11.897 1.00 3.190 C ATOM 222 CD PRO A 13 -7.929 -13.967 10.376 1.00 3.190 C ATOM 223 HA PRO A 13 -5.053 -15.464 10.784 1.00 2.560 H ATOM 224 1HB PRO A 13 -6.308 -14.975 13.157 1.00 3.830 H ATOM 225 2HB PRO A 13 -5.691 -13.668 12.142 1.00 3.830 H ATOM 226 1HG PRO A 13 -8.549 -14.740 12.343 1.00 3.830 H ATOM 227 2HG PRO A 13 -8.010 -13.057 12.376 1.00 3.830 H ATOM 228 1HD PRO A 13 -8.937 -14.279 10.060 1.00 3.830 H ATOM 229 2HD PRO A 13 -7.667 -12.943 10.044 1.00 3.830 H ATOM 230 N ASN A 14 -6.287 -17.879 10.620 1.00 2.230 N ATOM 231 CA ASN A 14 -6.711 -19.206 11.030 1.00 2.390 C ATOM 232 C ASN A 14 -5.671 -19.802 11.970 1.00 1.990 C ATOM 233 O ASN A 14 -4.666 -20.381 11.556 1.00 2.250 O ATOM 234 CB ASN A 14 -6.951 -20.112 9.841 1.00 3.280 C ATOM 235 CG ASN A 14 -7.544 -21.465 10.242 1.00 3.280 C ATOM 236 OD1 ASN A 14 -7.466 -21.920 11.401 1.00 3.280 O ATOM 237 ND2 ASN A 14 -8.148 -22.124 9.278 1.00 3.280 N ATOM 238 H ASN A 14 -5.873 -17.662 9.709 1.00 2.680 H ATOM 239 HA ASN A 14 -7.646 -19.121 11.585 1.00 2.870 H ATOM 240 1HB ASN A 14 -7.632 -19.620 9.144 1.00 3.940 H ATOM 241 2HB ASN A 14 -6.012 -20.277 9.317 1.00 3.940 H ATOM 242 1HD2 ASN A 14 -8.561 -23.019 9.462 1.00 3.940 H ATOM 243 2HD2 ASN A 14 -8.196 -21.734 8.357 1.00 3.940 H ATOM 244 N LYS A 15 -5.986 -19.734 13.254 1.00 2.060 N ATOM 245 CA LYS A 15 -5.103 -20.171 14.337 1.00 2.320 C ATOM 246 C LYS A 15 -4.999 -21.687 14.453 1.00 2.270 C ATOM 247 O LYS A 15 -4.236 -22.198 15.273 1.00 2.910 O ATOM 248 CB LYS A 15 -5.534 -19.562 15.675 1.00 3.140 C ATOM 249 CG LYS A 15 -6.839 -20.085 16.279 1.00 3.140 C ATOM 250 CD LYS A 15 -7.162 -19.314 17.568 1.00 3.140 C ATOM 251 CE LYS A 15 -8.426 -19.811 18.244 1.00 3.140 C ATOM 252 NZ LYS A 15 -8.758 -19.008 19.462 1.00 3.140 N ATOM 253 H LYS A 15 -6.834 -19.207 13.458 1.00 2.470 H ATOM 254 HA LYS A 15 -4.102 -19.799 14.117 1.00 2.780 H ATOM 255 1HB LYS A 15 -4.746 -19.724 16.410 1.00 3.770 H ATOM 256 2HB LYS A 15 -5.642 -18.483 15.551 1.00 3.770 H ATOM 257 1HG LYS A 15 -7.654 -19.971 15.565 1.00 3.770 H ATOM 258 2HG LYS A 15 -6.734 -21.147 16.517 1.00 3.770 H ATOM 259 1HD LYS A 15 -6.329 -19.419 18.263 1.00 3.770 H ATOM 260 2HD LYS A 15 -7.284 -18.257 17.332 1.00 3.770 H ATOM 261 1HE LYS A 15 -9.256 -19.755 17.543 1.00 3.770 H ATOM 262 2HE LYS A 15 -8.282 -20.845 18.542 1.00 3.770 H ATOM 263 1HZ LYS A 15 -9.601 -19.370 19.887 1.00 3.770 H ATOM 264 2HZ LYS A 15 -7.997 -19.066 20.125 1.00 3.770 H ATOM 265 3HZ LYS A 15 -8.904 -18.041 19.203 1.00 3.770 H ATOM 266 N PHE A 16 -5.813 -22.402 13.682 1.00 1.800 N ATOM 267 CA PHE A 16 -5.807 -23.852 13.701 1.00 1.910 C ATOM 268 C PHE A 16 -5.165 -24.413 12.436 1.00 1.760 C ATOM 269 O PHE A 16 -5.192 -25.626 12.211 1.00 1.950 O ATOM 270 CB PHE A 16 -7.230 -24.387 13.786 1.00 2.630 C ATOM 271 CG PHE A 16 -7.973 -23.954 14.995 1.00 2.630 C ATOM 272 CD1 PHE A 16 -8.932 -22.962 14.896 1.00 2.630 C ATOM 273 CD2 PHE A 16 -7.730 -24.529 16.229 1.00 2.630 C ATOM 274 CE1 PHE A 16 -9.639 -22.561 16.003 1.00 2.630 C ATOM 275 CE2 PHE A 16 -8.435 -24.128 17.339 1.00 2.630 C ATOM 276 CZ PHE A 16 -9.392 -23.146 17.225 1.00 2.630 C ATOM 277 H PHE A 16 -6.430 -21.929 13.024 1.00 2.160 H ATOM 278 HA PHE A 16 -5.234 -24.192 14.563 1.00 2.290 H ATOM 279 1HB PHE A 16 -7.787 -24.066 12.909 1.00 3.160 H ATOM 280 2HB PHE A 16 -7.207 -25.475 13.774 1.00 3.160 H ATOM 281 HD1 PHE A 16 -9.128 -22.504 13.925 1.00 3.160 H ATOM 282 HD2 PHE A 16 -6.973 -25.311 16.316 1.00 3.160 H ATOM 283 HE1 PHE A 16 -10.397 -21.784 15.913 1.00 3.160 H ATOM 284 HE2 PHE A 16 -8.239 -24.590 18.308 1.00 3.160 H ATOM 285 HZ PHE A 16 -9.955 -22.834 18.102 1.00 3.160 H ATOM 286 N SER A 17 -4.616 -23.536 11.599 1.00 1.830 N ATOM 287 CA SER A 17 -3.998 -23.949 10.353 1.00 1.810 C ATOM 288 C SER A 17 -2.527 -24.255 10.520 1.00 1.700 C ATOM 289 O SER A 17 -1.844 -23.685 11.370 1.00 2.220 O ATOM 290 CB SER A 17 -4.135 -22.894 9.293 1.00 2.540 C ATOM 291 OG SER A 17 -3.453 -23.287 8.130 1.00 2.540 O ATOM 292 H SER A 17 -4.617 -22.535 11.822 1.00 2.200 H ATOM 293 HA SER A 17 -4.498 -24.854 10.009 1.00 2.170 H ATOM 294 1HB SER A 17 -5.180 -22.733 9.068 1.00 3.050 H ATOM 295 2HB SER A 17 -3.726 -21.953 9.661 1.00 3.050 H ATOM 296 HG SER A 17 -3.447 -22.494 7.570 1.00 3.050 H ATOM 297 N VAL A 18 -2.026 -25.148 9.678 1.00 1.760 N ATOM 298 CA VAL A 18 -0.603 -25.459 9.676 1.00 2.130 C ATOM 299 C VAL A 18 0.046 -24.891 8.423 1.00 1.950 C ATOM 300 O VAL A 18 1.223 -25.122 8.145 1.00 2.720 O ATOM 301 CB VAL A 18 -0.380 -26.980 9.757 1.00 2.830 C ATOM 302 CG1 VAL A 18 -0.984 -27.503 11.055 1.00 2.830 C ATOM 303 CG2 VAL A 18 -1.008 -27.676 8.540 1.00 2.830 C ATOM 304 H VAL A 18 -2.654 -25.586 9.021 1.00 2.110 H ATOM 305 HA VAL A 18 -0.138 -24.996 10.546 1.00 2.560 H ATOM 306 HB VAL A 18 0.690 -27.184 9.782 1.00 3.400 H ATOM 307 1HG1 VAL A 18 -0.813 -28.576 11.133 1.00 3.400 H ATOM 308 2HG1 VAL A 18 -0.516 -26.997 11.899 1.00 3.400 H ATOM 309 3HG1 VAL A 18 -2.057 -27.306 11.069 1.00 3.400 H ATOM 310 1HG2 VAL A 18 -0.834 -28.749 8.612 1.00 3.400 H ATOM 311 2HG2 VAL A 18 -2.076 -27.489 8.514 1.00 3.400 H ATOM 312 3HG2 VAL A 18 -0.551 -27.302 7.622 1.00 3.400 H ATOM 313 N ARG A 19 -0.758 -24.185 7.646 1.00 1.730 N ATOM 314 CA ARG A 19 -0.305 -23.560 6.428 1.00 2.130 C ATOM 315 C ARG A 19 -0.003 -22.110 6.747 1.00 1.890 C ATOM 316 O ARG A 19 -0.619 -21.532 7.642 1.00 2.420 O ATOM 317 CB ARG A 19 -1.356 -23.658 5.351 1.00 2.820 C ATOM 318 CG ARG A 19 -1.743 -25.073 4.938 1.00 2.820 C ATOM 319 CD ARG A 19 -2.763 -25.059 3.848 1.00 2.820 C ATOM 320 NE ARG A 19 -4.047 -24.530 4.306 1.00 2.820 N ATOM 321 CZ ARG A 19 -5.034 -24.047 3.511 1.00 2.820 C ATOM 322 NH1 ARG A 19 -4.897 -23.996 2.198 1.00 2.820 N ATOM 323 NH2 ARG A 19 -6.158 -23.616 4.065 1.00 2.820 N ATOM 324 H ARG A 19 -1.712 -24.034 7.957 1.00 2.080 H ATOM 325 HA ARG A 19 0.606 -24.050 6.085 1.00 2.560 H ATOM 326 1HB ARG A 19 -2.247 -23.111 5.640 1.00 3.390 H ATOM 327 2HB ARG A 19 -0.958 -23.197 4.482 1.00 3.390 H ATOM 328 1HG ARG A 19 -0.859 -25.598 4.579 1.00 3.390 H ATOM 329 2HG ARG A 19 -2.158 -25.602 5.795 1.00 3.390 H ATOM 330 1HD ARG A 19 -2.409 -24.446 3.040 1.00 3.390 H ATOM 331 2HD ARG A 19 -2.919 -26.076 3.491 1.00 3.390 H ATOM 332 HE ARG A 19 -4.223 -24.547 5.302 1.00 3.390 H ATOM 333 1HH1 ARG A 19 -4.052 -24.312 1.749 1.00 3.390 H ATOM 334 2HH1 ARG A 19 -5.646 -23.630 1.628 1.00 3.390 H ATOM 335 1HH2 ARG A 19 -6.274 -23.651 5.069 1.00 3.390 H ATOM 336 2HH2 ARG A 19 -6.903 -23.254 3.486 1.00 3.390 H ATOM 337 N ASP A 20 0.913 -21.497 6.029 1.00 1.480 N ATOM 338 CA ASP A 20 1.154 -20.092 6.295 1.00 1.480 C ATOM 339 C ASP A 20 1.836 -19.407 5.160 1.00 1.040 C ATOM 340 O ASP A 20 3.019 -19.186 5.370 1.00 1.330 O ATOM 341 CB ASP A 20 1.945 -19.827 7.583 1.00 2.070 C ATOM 342 CG ASP A 20 1.962 -18.277 7.946 1.00 2.070 C ATOM 343 OD1 ASP A 20 1.500 -17.464 7.131 1.00 2.070 O ATOM 344 OD2 ASP A 20 2.424 -17.939 9.024 1.00 2.070 O ATOM 345 H ASP A 20 1.422 -21.984 5.305 1.00 1.780 H ATOM 346 HA ASP A 20 0.186 -19.606 6.419 1.00 1.780 H ATOM 347 1HB ASP A 20 1.496 -20.370 8.413 1.00 2.490 H ATOM 348 2HB ASP A 20 2.969 -20.183 7.475 1.00 2.490 H ATOM 349 N TYR A 21 1.084 -18.480 4.627 1.00 0.930 N ATOM 350 CA TYR A 21 1.500 -18.086 3.299 1.00 0.820 C ATOM 351 C TYR A 21 1.907 -16.644 3.318 1.00 0.630 C ATOM 352 O TYR A 21 1.258 -15.816 3.954 1.00 1.080 O ATOM 353 CB TYR A 21 0.400 -18.280 2.257 1.00 1.190 C ATOM 354 CG TYR A 21 0.053 -19.696 2.008 1.00 1.190 C ATOM 355 CD1 TYR A 21 -1.022 -20.277 2.646 1.00 1.190 C ATOM 356 CD2 TYR A 21 0.832 -20.431 1.137 1.00 1.190 C ATOM 357 CE1 TYR A 21 -1.322 -21.589 2.400 1.00 1.190 C ATOM 358 CE2 TYR A 21 0.541 -21.746 0.899 1.00 1.190 C ATOM 359 CZ TYR A 21 -0.529 -22.330 1.524 1.00 1.190 C ATOM 360 OH TYR A 21 -0.810 -23.655 1.283 1.00 1.190 O ATOM 361 H TYR A 21 1.058 -17.703 5.298 1.00 1.120 H ATOM 362 HA TYR A 21 2.369 -18.677 3.010 1.00 0.980 H ATOM 363 1HB TYR A 21 -0.501 -17.759 2.585 1.00 1.430 H ATOM 364 2HB TYR A 21 0.710 -17.829 1.312 1.00 1.430 H ATOM 365 HD1 TYR A 21 -1.632 -19.694 3.336 1.00 1.430 H ATOM 366 HD2 TYR A 21 1.683 -19.963 0.641 1.00 1.430 H ATOM 367 HE1 TYR A 21 -2.175 -22.045 2.894 1.00 1.430 H ATOM 368 HE2 TYR A 21 1.159 -22.328 0.214 1.00 1.430 H ATOM 369 HH TYR A 21 -0.203 -23.995 0.620 1.00 1.430 H ATOM 370 N THR A 22 2.941 -16.325 2.572 1.00 0.740 N ATOM 371 CA THR A 22 3.362 -14.953 2.453 1.00 0.890 C ATOM 372 C THR A 22 3.051 -14.523 1.059 1.00 0.790 C ATOM 373 O THR A 22 3.406 -15.204 0.110 1.00 1.280 O ATOM 374 CB THR A 22 4.870 -14.775 2.739 1.00 1.190 C ATOM 375 OG1 THR A 22 5.153 -15.177 4.083 1.00 1.190 O ATOM 376 CG2 THR A 22 5.277 -13.318 2.557 1.00 1.190 C ATOM 377 H THR A 22 3.443 -17.046 2.071 1.00 0.890 H ATOM 378 HA THR A 22 2.795 -14.331 3.144 1.00 1.070 H ATOM 379 HB THR A 22 5.446 -15.395 2.052 1.00 1.420 H ATOM 380 HG1 THR A 22 5.006 -16.123 4.171 1.00 1.420 H ATOM 381 1HG2 THR A 22 6.341 -13.209 2.761 1.00 1.420 H ATOM 382 2HG2 THR A 22 5.077 -13.010 1.544 1.00 1.420 H ATOM 383 3HG2 THR A 22 4.710 -12.693 3.244 1.00 1.420 H ATOM 384 N ARG A 23 2.362 -13.421 0.933 1.00 0.790 N ATOM 385 CA ARG A 23 2.056 -12.908 -0.372 1.00 0.700 C ATOM 386 C ARG A 23 2.487 -11.488 -0.470 1.00 0.630 C ATOM 387 O ARG A 23 2.540 -10.751 0.509 1.00 0.700 O ATOM 388 CB ARG A 23 0.583 -13.024 -0.750 1.00 1.020 C ATOM 389 CG ARG A 23 0.104 -14.427 -1.019 1.00 1.020 C ATOM 390 CD ARG A 23 -1.341 -14.466 -1.387 1.00 1.020 C ATOM 391 NE ARG A 23 -1.792 -15.835 -1.612 1.00 1.020 N ATOM 392 CZ ARG A 23 -1.807 -16.488 -2.805 1.00 1.020 C ATOM 393 NH1 ARG A 23 -1.433 -15.908 -3.946 1.00 1.020 N ATOM 394 NH2 ARG A 23 -2.211 -17.749 -2.830 1.00 1.020 N ATOM 395 H ARG A 23 2.089 -12.909 1.762 1.00 0.950 H ATOM 396 HA ARG A 23 2.622 -13.474 -1.107 1.00 0.840 H ATOM 397 1HB ARG A 23 -0.031 -12.606 0.046 1.00 1.220 H ATOM 398 2HB ARG A 23 0.397 -12.437 -1.655 1.00 1.220 H ATOM 399 1HG ARG A 23 0.669 -14.821 -1.855 1.00 1.220 H ATOM 400 2HG ARG A 23 0.271 -15.055 -0.147 1.00 1.220 H ATOM 401 1HD ARG A 23 -1.941 -14.035 -0.587 1.00 1.220 H ATOM 402 2HD ARG A 23 -1.500 -13.890 -2.297 1.00 1.220 H ATOM 403 HE ARG A 23 -2.094 -16.361 -0.800 1.00 1.220 H ATOM 404 1HH1 ARG A 23 -1.125 -14.922 -3.999 1.00 1.220 H ATOM 405 2HH1 ARG A 23 -1.467 -16.435 -4.805 1.00 1.220 H ATOM 406 1HH2 ARG A 23 -2.500 -18.204 -1.974 1.00 1.220 H ATOM 407 2HH2 ARG A 23 -2.233 -18.259 -3.701 1.00 1.220 H ATOM 408 N CYS A 24 2.761 -11.142 -1.684 1.00 0.580 N ATOM 409 CA CYS A 24 3.137 -9.838 -2.163 1.00 0.540 C ATOM 410 C CYS A 24 2.060 -8.780 -1.928 1.00 0.550 C ATOM 411 O CYS A 24 0.985 -8.809 -2.532 1.00 0.590 O ATOM 412 CB CYS A 24 3.396 -10.001 -3.638 1.00 0.770 C ATOM 413 SG CYS A 24 3.798 -8.591 -4.519 1.00 0.770 S ATOM 414 H CYS A 24 2.713 -11.893 -2.365 1.00 0.700 H ATOM 415 HA CYS A 24 4.053 -9.537 -1.655 1.00 0.650 H ATOM 416 1HB CYS A 24 4.197 -10.722 -3.779 1.00 0.930 H ATOM 417 2HB CYS A 24 2.517 -10.425 -4.079 1.00 0.930 H ATOM 418 N LEU A 25 2.418 -7.746 -1.176 1.00 0.550 N ATOM 419 CA LEU A 25 1.486 -6.666 -0.844 1.00 0.610 C ATOM 420 C LEU A 25 0.948 -5.917 -2.060 1.00 0.630 C ATOM 421 O LEU A 25 -0.195 -5.459 -2.057 1.00 0.730 O ATOM 422 CB LEU A 25 2.188 -5.639 0.061 1.00 0.830 C ATOM 423 CG LEU A 25 2.540 -6.080 1.504 1.00 0.830 C ATOM 424 CD1 LEU A 25 3.451 -5.027 2.121 1.00 0.830 C ATOM 425 CD2 LEU A 25 1.268 -6.231 2.342 1.00 0.830 C ATOM 426 H LEU A 25 3.336 -7.787 -0.723 1.00 0.660 H ATOM 427 HA LEU A 25 0.639 -7.105 -0.325 1.00 0.730 H ATOM 428 1HB LEU A 25 3.111 -5.345 -0.414 1.00 1.000 H ATOM 429 2HB LEU A 25 1.553 -4.757 0.129 1.00 1.000 H ATOM 430 HG LEU A 25 3.069 -7.028 1.483 1.00 1.000 H ATOM 431 1HD1 LEU A 25 3.719 -5.326 3.134 1.00 1.000 H ATOM 432 2HD1 LEU A 25 4.364 -4.936 1.522 1.00 1.000 H ATOM 433 3HD1 LEU A 25 2.940 -4.068 2.151 1.00 1.000 H ATOM 434 1HD2 LEU A 25 1.541 -6.531 3.353 1.00 1.000 H ATOM 435 2HD2 LEU A 25 0.735 -5.280 2.376 1.00 1.000 H ATOM 436 3HD2 LEU A 25 0.622 -6.990 1.912 1.00 1.000 H ATOM 437 N ARG A 26 1.776 -5.758 -3.088 1.00 0.560 N ATOM 438 CA ARG A 26 1.384 -5.002 -4.269 1.00 0.630 C ATOM 439 C ARG A 26 0.792 -5.840 -5.394 1.00 0.680 C ATOM 440 O ARG A 26 -0.097 -5.396 -6.115 1.00 1.020 O ATOM 441 CB ARG A 26 2.605 -4.310 -4.856 1.00 0.850 C ATOM 442 CG ARG A 26 3.307 -3.298 -3.974 1.00 0.850 C ATOM 443 CD ARG A 26 2.516 -2.077 -3.711 1.00 0.850 C ATOM 444 NE ARG A 26 3.284 -1.112 -2.924 1.00 0.850 N ATOM 445 CZ ARG A 26 2.829 0.085 -2.495 1.00 0.850 C ATOM 446 NH1 ARG A 26 1.602 0.474 -2.781 1.00 0.850 N ATOM 447 NH2 ARG A 26 3.620 0.873 -1.782 1.00 0.850 N ATOM 448 H ARG A 26 2.707 -6.148 -3.035 1.00 0.670 H ATOM 449 HA ARG A 26 0.643 -4.264 -3.972 1.00 0.760 H ATOM 450 1HB ARG A 26 3.344 -5.069 -5.122 1.00 1.020 H ATOM 451 2HB ARG A 26 2.321 -3.805 -5.777 1.00 1.020 H ATOM 452 1HG ARG A 26 3.544 -3.749 -3.018 1.00 1.020 H ATOM 453 2HG ARG A 26 4.217 -3.005 -4.476 1.00 1.020 H ATOM 454 1HD ARG A 26 2.239 -1.612 -4.657 1.00 1.020 H ATOM 455 2HD ARG A 26 1.622 -2.336 -3.148 1.00 1.020 H ATOM 456 HE ARG A 26 4.232 -1.365 -2.675 1.00 1.020 H ATOM 457 1HH1 ARG A 26 0.992 -0.119 -3.323 1.00 1.020 H ATOM 458 2HH1 ARG A 26 1.267 1.370 -2.456 1.00 1.020 H ATOM 459 1HH2 ARG A 26 4.560 0.582 -1.553 1.00 1.020 H ATOM 460 2HH2 ARG A 26 3.283 1.769 -1.458 1.00 1.020 H ATOM 461 N CYS A 27 1.333 -7.014 -5.586 1.00 0.620 N ATOM 462 CA CYS A 27 1.009 -7.834 -6.728 1.00 0.680 C ATOM 463 C CYS A 27 0.195 -9.117 -6.498 1.00 0.650 C ATOM 464 O CYS A 27 -0.260 -9.732 -7.473 1.00 0.740 O ATOM 465 CB CYS A 27 2.315 -8.202 -7.369 1.00 0.930 C ATOM 466 SG CYS A 27 3.262 -9.343 -6.412 1.00 0.930 S ATOM 467 H CYS A 27 2.037 -7.324 -4.943 1.00 0.740 H ATOM 468 HA CYS A 27 0.451 -7.209 -7.424 1.00 0.820 H ATOM 469 1HB CYS A 27 2.138 -8.645 -8.346 1.00 1.110 H ATOM 470 2HB CYS A 27 2.918 -7.305 -7.517 1.00 1.110 H ATOM 471 N GLY A 28 0.036 -9.575 -5.248 1.00 0.590 N ATOM 472 CA GLY A 28 -0.716 -10.801 -4.954 1.00 0.630 C ATOM 473 C GLY A 28 0.026 -12.135 -5.153 1.00 0.650 C ATOM 474 O GLY A 28 -0.560 -13.202 -4.935 1.00 0.800 O ATOM 475 H GLY A 28 0.384 -9.059 -4.434 1.00 0.710 H ATOM 476 1HA GLY A 28 -1.050 -10.745 -3.917 1.00 0.760 H ATOM 477 2HA GLY A 28 -1.620 -10.809 -5.559 1.00 0.760 H ATOM 478 N ARG A 29 1.285 -12.080 -5.582 1.00 0.600 N ATOM 479 CA ARG A 29 2.100 -13.262 -5.845 1.00 0.650 C ATOM 480 C ARG A 29 2.536 -13.952 -4.558 1.00 0.630 C ATOM 481 O ARG A 29 2.838 -13.315 -3.548 1.00 0.640 O ATOM 482 CB ARG A 29 3.335 -12.898 -6.662 1.00 0.890 C ATOM 483 CG ARG A 29 3.047 -12.416 -8.100 1.00 0.890 C ATOM 484 CD ARG A 29 4.303 -12.000 -8.816 1.00 0.890 C ATOM 485 NE ARG A 29 4.022 -11.460 -10.154 1.00 0.890 N ATOM 486 CZ ARG A 29 3.934 -12.177 -11.301 1.00 0.890 C ATOM 487 NH1 ARG A 29 4.116 -13.484 -11.300 1.00 0.890 N ATOM 488 NH2 ARG A 29 3.658 -11.557 -12.439 1.00 0.890 N ATOM 489 H ARG A 29 1.676 -11.161 -5.749 1.00 0.720 H ATOM 490 HA ARG A 29 1.502 -13.964 -6.427 1.00 0.780 H ATOM 491 1HB ARG A 29 3.908 -12.139 -6.144 1.00 1.070 H ATOM 492 2HB ARG A 29 3.979 -13.773 -6.745 1.00 1.070 H ATOM 493 1HG ARG A 29 2.594 -13.230 -8.660 1.00 1.070 H ATOM 494 2HG ARG A 29 2.355 -11.576 -8.084 1.00 1.070 H ATOM 495 1HD ARG A 29 4.797 -11.223 -8.240 1.00 1.070 H ATOM 496 2HD ARG A 29 4.978 -12.846 -8.910 1.00 1.070 H ATOM 497 HE ARG A 29 3.877 -10.461 -10.223 1.00 1.070 H ATOM 498 1HH1 ARG A 29 4.325 -13.969 -10.442 1.00 1.070 H ATOM 499 2HH1 ARG A 29 4.046 -14.006 -12.162 1.00 1.070 H ATOM 500 1HH2 ARG A 29 3.500 -10.558 -12.451 1.00 1.070 H ATOM 501 2HH2 ARG A 29 3.590 -12.082 -13.299 1.00 1.070 H ATOM 502 N ALA A 30 2.584 -15.284 -4.590 1.00 0.710 N ATOM 503 CA ALA A 30 3.042 -16.058 -3.430 1.00 0.800 C ATOM 504 C ALA A 30 4.486 -16.543 -3.575 1.00 0.740 C ATOM 505 O ALA A 30 4.973 -17.319 -2.751 1.00 0.970 O ATOM 506 CB ALA A 30 2.131 -17.252 -3.199 1.00 1.080 C ATOM 507 H ALA A 30 2.300 -15.770 -5.432 1.00 0.850 H ATOM 508 HA ALA A 30 2.999 -15.414 -2.553 1.00 0.960 H ATOM 509 1HB ALA A 30 2.463 -17.788 -2.311 1.00 1.300 H ATOM 510 2HB ALA A 30 1.118 -16.910 -3.051 1.00 1.300 H ATOM 511 3HB ALA A 30 2.170 -17.912 -4.061 1.00 1.300 H ATOM 512 N ARG A 31 5.162 -16.123 -4.632 1.00 0.600 N ATOM 513 CA ARG A 31 6.511 -16.599 -4.881 1.00 0.620 C ATOM 514 C ARG A 31 7.455 -15.439 -5.088 1.00 0.680 C ATOM 515 O ARG A 31 7.064 -14.389 -5.588 1.00 1.170 O ATOM 516 CB ARG A 31 6.522 -17.516 -6.097 1.00 0.860 C ATOM 517 CG ARG A 31 5.672 -18.791 -5.930 1.00 0.860 C ATOM 518 CD ARG A 31 6.258 -19.758 -4.958 1.00 0.860 C ATOM 519 NE ARG A 31 5.453 -20.953 -4.854 1.00 0.860 N ATOM 520 CZ ARG A 31 4.424 -21.124 -3.985 1.00 0.860 C ATOM 521 NH1 ARG A 31 4.080 -20.176 -3.119 1.00 0.860 N ATOM 522 NH2 ARG A 31 3.751 -22.267 -4.000 1.00 0.860 N ATOM 523 H ARG A 31 4.729 -15.468 -5.262 1.00 0.720 H ATOM 524 HA ARG A 31 6.861 -17.149 -4.012 1.00 0.740 H ATOM 525 1HB ARG A 31 6.147 -16.975 -6.963 1.00 1.030 H ATOM 526 2HB ARG A 31 7.544 -17.820 -6.318 1.00 1.030 H ATOM 527 1HG ARG A 31 4.671 -18.533 -5.599 1.00 1.030 H ATOM 528 2HG ARG A 31 5.605 -19.295 -6.893 1.00 1.030 H ATOM 529 1HD ARG A 31 7.249 -20.050 -5.303 1.00 1.030 H ATOM 530 2HD ARG A 31 6.342 -19.321 -3.973 1.00 1.030 H ATOM 531 HE ARG A 31 5.666 -21.714 -5.486 1.00 1.030 H ATOM 532 1HH1 ARG A 31 4.584 -19.273 -3.066 1.00 1.030 H ATOM 533 2HH1 ARG A 31 3.314 -20.334 -2.484 1.00 1.030 H ATOM 534 1HH2 ARG A 31 4.006 -22.995 -4.654 1.00 1.030 H ATOM 535 2HH2 ARG A 31 2.985 -22.414 -3.361 1.00 1.030 H ATOM 536 N ALA A 32 8.713 -15.645 -4.704 1.00 0.620 N ATOM 537 CA ALA A 32 9.768 -14.639 -4.817 1.00 0.660 C ATOM 538 C ALA A 32 9.444 -13.384 -4.022 1.00 0.610 C ATOM 539 O ALA A 32 9.704 -12.276 -4.494 1.00 0.640 O ATOM 540 CB ALA A 32 10.000 -14.254 -6.275 1.00 0.910 C ATOM 541 H ALA A 32 8.948 -16.543 -4.308 1.00 0.740 H ATOM 542 HA ALA A 32 10.683 -15.068 -4.410 1.00 0.790 H ATOM 543 1HB ALA A 32 10.802 -13.532 -6.330 1.00 1.090 H ATOM 544 2HB ALA A 32 10.269 -15.141 -6.844 1.00 1.090 H ATOM 545 3HB ALA A 32 9.108 -13.814 -6.704 1.00 1.090 H ATOM 546 N VAL A 33 8.890 -13.557 -2.815 1.00 0.600 N ATOM 547 CA VAL A 33 8.548 -12.432 -1.946 1.00 0.590 C ATOM 548 C VAL A 33 9.624 -12.205 -0.906 1.00 0.610 C ATOM 549 O VAL A 33 10.058 -13.129 -0.215 1.00 0.700 O ATOM 550 CB VAL A 33 7.135 -12.605 -1.352 1.00 0.830 C ATOM 551 CG1 VAL A 33 6.779 -11.429 -0.406 1.00 0.830 C ATOM 552 CG2 VAL A 33 6.137 -12.658 -2.517 1.00 0.830 C ATOM 553 H VAL A 33 8.713 -14.501 -2.498 1.00 0.720 H ATOM 554 HA VAL A 33 8.527 -11.534 -2.516 1.00 0.710 H ATOM 555 HB VAL A 33 7.085 -13.531 -0.779 1.00 1.000 H ATOM 556 1HG1 VAL A 33 5.775 -11.561 -0.022 1.00 1.000 H ATOM 557 2HG1 VAL A 33 7.480 -11.386 0.428 1.00 1.000 H ATOM 558 3HG1 VAL A 33 6.819 -10.504 -0.949 1.00 1.000 H ATOM 559 1HG2 VAL A 33 5.129 -12.791 -2.131 1.00 1.000 H ATOM 560 2HG2 VAL A 33 6.196 -11.734 -3.076 1.00 1.000 H ATOM 561 3HG2 VAL A 33 6.374 -13.488 -3.173 1.00 1.000 H ATOM 562 N LEU A 34 10.074 -10.956 -0.838 1.00 0.560 N ATOM 563 CA LEU A 34 11.143 -10.533 0.039 1.00 0.580 C ATOM 564 C LEU A 34 10.594 -10.207 1.417 1.00 0.620 C ATOM 565 O LEU A 34 9.793 -9.278 1.578 1.00 0.590 O ATOM 566 CB LEU A 34 11.794 -9.276 -0.560 1.00 0.800 C ATOM 567 CG LEU A 34 12.396 -9.406 -1.995 1.00 0.800 C ATOM 568 CD1 LEU A 34 12.800 -8.010 -2.498 1.00 0.800 C ATOM 569 CD2 LEU A 34 13.610 -10.341 -1.976 1.00 0.800 C ATOM 570 H LEU A 34 9.636 -10.258 -1.445 1.00 0.670 H ATOM 571 HA LEU A 34 11.864 -11.342 0.134 1.00 0.700 H ATOM 572 1HB LEU A 34 11.032 -8.497 -0.609 1.00 0.960 H ATOM 573 2HB LEU A 34 12.587 -8.946 0.107 1.00 0.960 H ATOM 574 HG LEU A 34 11.634 -9.804 -2.676 1.00 0.960 H ATOM 575 1HD1 LEU A 34 13.201 -8.081 -3.506 1.00 0.960 H ATOM 576 2HD1 LEU A 34 11.919 -7.371 -2.506 1.00 0.960 H ATOM 577 3HD1 LEU A 34 13.554 -7.581 -1.847 1.00 0.960 H ATOM 578 1HD2 LEU A 34 14.024 -10.422 -2.975 1.00 0.960 H ATOM 579 2HD2 LEU A 34 14.371 -9.940 -1.305 1.00 0.960 H ATOM 580 3HD2 LEU A 34 13.311 -11.330 -1.638 1.00 0.960 H ATOM 581 N SER A 35 11.082 -10.924 2.428 1.00 0.690 N ATOM 582 CA SER A 35 10.627 -10.781 3.815 1.00 0.760 C ATOM 583 C SER A 35 10.948 -9.418 4.418 1.00 0.740 C ATOM 584 O SER A 35 10.341 -8.994 5.400 1.00 0.790 O ATOM 585 CB SER A 35 11.248 -11.871 4.660 1.00 1.040 C ATOM 586 OG SER A 35 12.632 -11.696 4.755 1.00 1.040 O ATOM 587 H SER A 35 11.759 -11.652 2.227 1.00 0.830 H ATOM 588 HA SER A 35 9.543 -10.909 3.827 1.00 0.910 H ATOM 589 1HB SER A 35 10.807 -11.854 5.656 1.00 1.240 H ATOM 590 2HB SER A 35 11.028 -12.842 4.220 1.00 1.240 H ATOM 591 HG SER A 35 12.957 -12.428 5.290 1.00 1.240 H ATOM 592 N HIS A 36 11.882 -8.720 3.790 1.00 0.690 N ATOM 593 CA HIS A 36 12.325 -7.404 4.211 1.00 0.680 C ATOM 594 C HIS A 36 11.376 -6.300 3.764 1.00 0.620 C ATOM 595 O HIS A 36 11.374 -5.208 4.340 1.00 0.650 O ATOM 596 CB HIS A 36 13.696 -7.101 3.602 1.00 0.960 C ATOM 597 CG HIS A 36 14.802 -7.952 4.104 1.00 0.960 C ATOM 598 ND1 HIS A 36 15.301 -7.857 5.387 1.00 0.960 N ATOM 599 CD2 HIS A 36 15.514 -8.925 3.493 1.00 0.960 C ATOM 600 CE1 HIS A 36 16.275 -8.736 5.541 1.00 0.960 C ATOM 601 NE2 HIS A 36 16.425 -9.395 4.407 1.00 0.960 N ATOM 602 H HIS A 36 12.322 -9.160 2.999 1.00 0.830 H ATOM 603 HA HIS A 36 12.402 -7.371 5.297 1.00 0.820 H ATOM 604 1HB HIS A 36 13.640 -7.244 2.530 1.00 1.150 H ATOM 605 2HB HIS A 36 13.950 -6.055 3.776 1.00 1.150 H ATOM 606 HD2 HIS A 36 15.392 -9.270 2.465 1.00 1.150 H ATOM 607 HE1 HIS A 36 16.856 -8.891 6.450 1.00 1.150 H ATOM 608 HE2 HIS A 36 17.099 -10.129 4.235 1.00 1.150 H ATOM 609 N PHE A 37 10.611 -6.548 2.693 1.00 0.560 N ATOM 610 CA PHE A 37 9.770 -5.496 2.148 1.00 0.530 C ATOM 611 C PHE A 37 8.283 -5.869 2.075 1.00 0.570 C ATOM 612 O PHE A 37 7.425 -4.991 1.981 1.00 0.610 O ATOM 613 CB PHE A 37 10.304 -5.116 0.771 1.00 0.750 C ATOM 614 CG PHE A 37 11.737 -4.699 0.808 1.00 0.750 C ATOM 615 CD1 PHE A 37 12.706 -5.565 0.349 1.00 0.750 C ATOM 616 CD2 PHE A 37 12.129 -3.476 1.314 1.00 0.750 C ATOM 617 CE1 PHE A 37 14.039 -5.227 0.386 1.00 0.750 C ATOM 618 CE2 PHE A 37 13.465 -3.129 1.356 1.00 0.750 C ATOM 619 CZ PHE A 37 14.419 -4.006 0.890 1.00 0.750 C ATOM 620 H PHE A 37 10.595 -7.469 2.260 1.00 0.670 H ATOM 621 HA PHE A 37 9.852 -4.624 2.796 1.00 0.640 H ATOM 622 1HB PHE A 37 10.224 -5.970 0.107 1.00 0.900 H ATOM 623 2HB PHE A 37 9.718 -4.298 0.358 1.00 0.900 H ATOM 624 HD1 PHE A 37 12.403 -6.522 -0.043 1.00 0.900 H ATOM 625 HD2 PHE A 37 11.372 -2.783 1.688 1.00 0.900 H ATOM 626 HE1 PHE A 37 14.791 -5.924 0.013 1.00 0.900 H ATOM 627 HE2 PHE A 37 13.767 -2.159 1.760 1.00 0.900 H ATOM 628 HZ PHE A 37 15.472 -3.733 0.921 1.00 0.900 H ATOM 629 N GLY A 38 7.968 -7.169 2.083 1.00 0.590 N ATOM 630 CA GLY A 38 6.591 -7.633 1.941 1.00 0.650 C ATOM 631 C GLY A 38 6.138 -7.716 0.488 1.00 0.540 C ATOM 632 O GLY A 38 4.962 -7.959 0.214 1.00 0.570 O ATOM 633 H GLY A 38 8.695 -7.877 2.160 1.00 0.710 H ATOM 634 1HA GLY A 38 6.503 -8.617 2.402 1.00 0.780 H ATOM 635 2HA GLY A 38 5.928 -6.966 2.491 1.00 0.780 H ATOM 636 N VAL A 39 7.066 -7.509 -0.439 1.00 0.470 N ATOM 637 CA VAL A 39 6.749 -7.535 -1.856 1.00 0.400 C ATOM 638 C VAL A 39 7.644 -8.478 -2.646 1.00 0.370 C ATOM 639 O VAL A 39 8.737 -8.845 -2.214 1.00 0.450 O ATOM 640 CB VAL A 39 6.837 -6.110 -2.446 1.00 0.590 C ATOM 641 CG1 VAL A 39 5.835 -5.203 -1.765 1.00 0.590 C ATOM 642 CG2 VAL A 39 8.239 -5.573 -2.302 1.00 0.590 C ATOM 643 H VAL A 39 8.004 -7.314 -0.126 1.00 0.560 H ATOM 644 HA VAL A 39 5.724 -7.875 -1.974 1.00 0.480 H ATOM 645 HB VAL A 39 6.585 -6.145 -3.466 1.00 0.710 H ATOM 646 1HG1 VAL A 39 5.887 -4.213 -2.205 1.00 0.710 H ATOM 647 2HG1 VAL A 39 4.846 -5.616 -1.908 1.00 0.710 H ATOM 648 3HG1 VAL A 39 6.052 -5.133 -0.700 1.00 0.710 H ATOM 649 1HG2 VAL A 39 8.301 -4.581 -2.735 1.00 0.710 H ATOM 650 2HG2 VAL A 39 8.476 -5.526 -1.269 1.00 0.710 H ATOM 651 3HG2 VAL A 39 8.925 -6.233 -2.807 1.00 0.710 H ATOM 652 N CYS A 40 7.158 -8.841 -3.815 1.00 0.330 N ATOM 653 CA CYS A 40 7.845 -9.711 -4.751 1.00 0.390 C ATOM 654 C CYS A 40 9.036 -9.021 -5.374 1.00 0.370 C ATOM 655 O CYS A 40 9.077 -7.795 -5.444 1.00 0.350 O ATOM 656 CB CYS A 40 6.892 -10.155 -5.849 1.00 0.520 C ATOM 657 SG CYS A 40 6.459 -8.861 -7.059 1.00 0.520 S ATOM 658 H CYS A 40 6.252 -8.479 -4.082 1.00 0.400 H ATOM 659 HA CYS A 40 8.183 -10.584 -4.232 1.00 0.470 H ATOM 660 1HB CYS A 40 7.336 -10.990 -6.391 1.00 0.630 H ATOM 661 2HB CYS A 40 5.974 -10.522 -5.403 1.00 0.630 H ATOM 662 N ARG A 41 9.970 -9.795 -5.904 1.00 0.440 N ATOM 663 CA ARG A 41 11.112 -9.184 -6.564 1.00 0.490 C ATOM 664 C ARG A 41 10.716 -8.294 -7.751 1.00 0.500 C ATOM 665 O ARG A 41 11.318 -7.243 -7.967 1.00 0.510 O ATOM 666 CB ARG A 41 12.122 -10.232 -7.010 1.00 0.670 C ATOM 667 CG ARG A 41 12.906 -10.875 -5.857 1.00 0.670 C ATOM 668 CD ARG A 41 14.121 -11.637 -6.324 1.00 0.670 C ATOM 669 NE ARG A 41 13.810 -12.821 -7.139 1.00 0.670 N ATOM 670 CZ ARG A 41 13.587 -14.073 -6.668 1.00 0.670 C ATOM 671 NH1 ARG A 41 13.629 -14.329 -5.373 1.00 0.670 N ATOM 672 NH2 ARG A 41 13.327 -15.052 -7.522 1.00 0.670 N ATOM 673 H ARG A 41 9.900 -10.808 -5.761 1.00 0.530 H ATOM 674 HA ARG A 41 11.615 -8.562 -5.826 1.00 0.590 H ATOM 675 1HB ARG A 41 11.609 -11.028 -7.546 1.00 0.800 H ATOM 676 2HB ARG A 41 12.836 -9.781 -7.693 1.00 0.800 H ATOM 677 1HG ARG A 41 13.241 -10.085 -5.194 1.00 0.800 H ATOM 678 2HG ARG A 41 12.253 -11.554 -5.306 1.00 0.800 H ATOM 679 1HD ARG A 41 14.734 -10.969 -6.930 1.00 0.800 H ATOM 680 2HD ARG A 41 14.701 -11.951 -5.460 1.00 0.800 H ATOM 681 HE ARG A 41 13.771 -12.691 -8.142 1.00 0.800 H ATOM 682 1HH1 ARG A 41 13.829 -13.593 -4.713 1.00 0.800 H ATOM 683 2HH1 ARG A 41 13.465 -15.268 -5.039 1.00 0.800 H ATOM 684 1HH2 ARG A 41 13.297 -14.863 -8.515 1.00 0.800 H ATOM 685 2HH2 ARG A 41 13.162 -15.990 -7.186 1.00 0.800 H ATOM 686 N LEU A 42 9.719 -8.696 -8.532 1.00 0.550 N ATOM 687 CA LEU A 42 9.340 -7.881 -9.691 1.00 0.640 C ATOM 688 C LEU A 42 8.831 -6.487 -9.306 1.00 0.580 C ATOM 689 O LEU A 42 9.295 -5.465 -9.826 1.00 0.600 O ATOM 690 CB LEU A 42 8.267 -8.625 -10.501 1.00 0.860 C ATOM 691 CG LEU A 42 7.658 -7.904 -11.727 1.00 0.860 C ATOM 692 CD1 LEU A 42 8.743 -7.605 -12.765 1.00 0.860 C ATOM 693 CD2 LEU A 42 6.563 -8.801 -12.312 1.00 0.860 C ATOM 694 H LEU A 42 9.270 -9.581 -8.335 1.00 0.660 H ATOM 695 HA LEU A 42 10.227 -7.756 -10.303 1.00 0.770 H ATOM 696 1HB LEU A 42 8.696 -9.558 -10.852 1.00 1.030 H ATOM 697 2HB LEU A 42 7.446 -8.866 -9.840 1.00 1.030 H ATOM 698 HG LEU A 42 7.216 -6.952 -11.420 1.00 1.030 H ATOM 699 1HD1 LEU A 42 8.290 -7.101 -13.620 1.00 1.030 H ATOM 700 2HD1 LEU A 42 9.502 -6.955 -12.335 1.00 1.030 H ATOM 701 3HD1 LEU A 42 9.201 -8.536 -13.094 1.00 1.030 H ATOM 702 1HD2 LEU A 42 6.110 -8.307 -13.173 1.00 1.030 H ATOM 703 2HD2 LEU A 42 6.993 -9.755 -12.627 1.00 1.030 H ATOM 704 3HD2 LEU A 42 5.801 -8.983 -11.554 1.00 1.030 H ATOM 705 N CYS A 43 7.883 -6.456 -8.408 1.00 0.540 N ATOM 706 CA CYS A 43 7.279 -5.254 -7.912 1.00 0.510 C ATOM 707 C CYS A 43 8.242 -4.494 -7.010 1.00 0.430 C ATOM 708 O CYS A 43 8.200 -3.265 -6.975 1.00 0.460 O ATOM 709 CB CYS A 43 5.968 -5.638 -7.280 1.00 0.730 C ATOM 710 SG CYS A 43 6.149 -6.844 -6.038 1.00 0.730 S ATOM 711 H CYS A 43 7.572 -7.333 -8.044 1.00 0.650 H ATOM 712 HA CYS A 43 7.045 -4.617 -8.767 1.00 0.610 H ATOM 713 1HB CYS A 43 5.503 -4.760 -6.835 1.00 0.870 H ATOM 714 2HB CYS A 43 5.292 -6.027 -8.038 1.00 0.870 H ATOM 715 N PHE A 44 9.159 -5.206 -6.341 1.00 0.360 N ATOM 716 CA PHE A 44 10.193 -4.571 -5.557 1.00 0.310 C ATOM 717 C PHE A 44 10.998 -3.708 -6.475 1.00 0.360 C ATOM 718 O PHE A 44 11.238 -2.547 -6.168 1.00 0.360 O ATOM 719 CB PHE A 44 11.135 -5.559 -4.902 1.00 0.450 C ATOM 720 CG PHE A 44 12.272 -4.892 -4.246 1.00 0.450 C ATOM 721 CD1 PHE A 44 12.126 -4.273 -3.040 1.00 0.450 C ATOM 722 CD2 PHE A 44 13.514 -4.872 -4.857 1.00 0.450 C ATOM 723 CE1 PHE A 44 13.189 -3.647 -2.461 1.00 0.450 C ATOM 724 CE2 PHE A 44 14.571 -4.247 -4.266 1.00 0.450 C ATOM 725 CZ PHE A 44 14.401 -3.635 -3.063 1.00 0.450 C ATOM 726 H PHE A 44 9.124 -6.224 -6.343 1.00 0.430 H ATOM 727 HA PHE A 44 9.730 -3.946 -4.795 1.00 0.370 H ATOM 728 1HB PHE A 44 10.618 -6.162 -4.188 1.00 0.540 H ATOM 729 2HB PHE A 44 11.526 -6.221 -5.649 1.00 0.540 H ATOM 730 HD1 PHE A 44 11.156 -4.279 -2.546 1.00 0.540 H ATOM 731 HD2 PHE A 44 13.642 -5.362 -5.823 1.00 0.540 H ATOM 732 HE1 PHE A 44 13.066 -3.154 -1.508 1.00 0.540 H ATOM 733 HE2 PHE A 44 15.545 -4.235 -4.754 1.00 0.540 H ATOM 734 HZ PHE A 44 15.237 -3.139 -2.583 1.00 0.540 H ATOM 735 N ARG A 45 11.441 -4.281 -7.604 1.00 0.430 N ATOM 736 CA ARG A 45 12.228 -3.519 -8.548 1.00 0.520 C ATOM 737 C ARG A 45 11.473 -2.304 -9.060 1.00 0.550 C ATOM 738 O ARG A 45 12.043 -1.215 -9.098 1.00 0.570 O ATOM 739 CB ARG A 45 12.671 -4.372 -9.724 1.00 0.690 C ATOM 740 CG ARG A 45 13.766 -5.375 -9.413 1.00 0.690 C ATOM 741 CD ARG A 45 14.368 -5.949 -10.657 1.00 0.690 C ATOM 742 NE ARG A 45 13.407 -6.738 -11.450 1.00 0.690 N ATOM 743 CZ ARG A 45 13.136 -8.058 -11.284 1.00 0.690 C ATOM 744 NH1 ARG A 45 13.733 -8.755 -10.341 1.00 0.690 N ATOM 745 NH2 ARG A 45 12.267 -8.653 -12.085 1.00 0.690 N ATOM 746 H ARG A 45 11.247 -5.273 -7.782 1.00 0.520 H ATOM 747 HA ARG A 45 13.124 -3.179 -8.035 1.00 0.620 H ATOM 748 1HB ARG A 45 11.817 -4.935 -10.094 1.00 0.830 H ATOM 749 2HB ARG A 45 13.012 -3.737 -10.523 1.00 0.830 H ATOM 750 1HG ARG A 45 14.556 -4.876 -8.853 1.00 0.830 H ATOM 751 2HG ARG A 45 13.364 -6.182 -8.817 1.00 0.830 H ATOM 752 1HD ARG A 45 14.722 -5.126 -11.282 1.00 0.830 H ATOM 753 2HD ARG A 45 15.213 -6.581 -10.400 1.00 0.830 H ATOM 754 HE ARG A 45 12.925 -6.256 -12.198 1.00 0.830 H ATOM 755 1HH1 ARG A 45 14.397 -8.311 -9.728 1.00 0.830 H ATOM 756 2HH1 ARG A 45 13.531 -9.736 -10.233 1.00 0.830 H ATOM 757 1HH2 ARG A 45 11.807 -8.123 -12.813 1.00 0.830 H ATOM 758 2HH2 ARG A 45 12.064 -9.635 -11.975 1.00 0.830 H ATOM 759 N GLU A 46 10.181 -2.432 -9.384 1.00 0.590 N ATOM 760 CA GLU A 46 9.474 -1.243 -9.855 1.00 0.670 C ATOM 761 C GLU A 46 9.446 -0.153 -8.776 1.00 0.620 C ATOM 762 O GLU A 46 9.687 1.028 -9.064 1.00 0.670 O ATOM 763 CB GLU A 46 8.033 -1.581 -10.250 1.00 0.910 C ATOM 764 CG GLU A 46 7.877 -2.425 -11.511 1.00 0.910 C ATOM 765 CD GLU A 46 6.428 -2.752 -11.810 1.00 0.910 C ATOM 766 OE1 GLU A 46 5.603 -2.496 -10.962 1.00 0.910 O ATOM 767 OE2 GLU A 46 6.149 -3.240 -12.880 1.00 0.910 O ATOM 768 H GLU A 46 9.732 -3.356 -9.364 1.00 0.710 H ATOM 769 HA GLU A 46 9.996 -0.852 -10.726 1.00 0.800 H ATOM 770 1HB GLU A 46 7.560 -2.123 -9.429 1.00 1.090 H ATOM 771 2HB GLU A 46 7.473 -0.658 -10.392 1.00 1.090 H ATOM 772 1HG GLU A 46 8.306 -1.887 -12.356 1.00 1.090 H ATOM 773 2HG GLU A 46 8.436 -3.354 -11.382 1.00 1.090 H ATOM 774 N LEU A 47 9.200 -0.556 -7.526 1.00 0.530 N ATOM 775 CA LEU A 47 9.175 0.381 -6.418 1.00 0.520 C ATOM 776 C LEU A 47 10.556 0.986 -6.201 1.00 0.470 C ATOM 777 O LEU A 47 10.700 2.186 -5.931 1.00 0.520 O ATOM 778 CB LEU A 47 8.718 -0.352 -5.148 1.00 0.730 C ATOM 779 CG LEU A 47 7.241 -0.812 -5.056 1.00 0.730 C ATOM 780 CD1 LEU A 47 7.099 -1.740 -3.847 1.00 0.730 C ATOM 781 CD2 LEU A 47 6.319 0.394 -4.890 1.00 0.730 C ATOM 782 H LEU A 47 8.981 -1.544 -7.356 1.00 0.640 H ATOM 783 HA LEU A 47 8.484 1.183 -6.661 1.00 0.620 H ATOM 784 1HB LEU A 47 9.327 -1.246 -5.058 1.00 0.880 H ATOM 785 2HB LEU A 47 8.914 0.261 -4.308 1.00 0.880 H ATOM 786 HG LEU A 47 6.966 -1.357 -5.957 1.00 0.880 H ATOM 787 1HD1 LEU A 47 6.091 -2.077 -3.762 1.00 0.880 H ATOM 788 2HD1 LEU A 47 7.753 -2.599 -3.983 1.00 0.880 H ATOM 789 3HD1 LEU A 47 7.376 -1.206 -2.941 1.00 0.880 H ATOM 790 1HD2 LEU A 47 5.290 0.050 -4.818 1.00 0.880 H ATOM 791 2HD2 LEU A 47 6.585 0.933 -3.984 1.00 0.880 H ATOM 792 3HD2 LEU A 47 6.409 1.057 -5.745 1.00 0.880 H ATOM 793 N ALA A 48 11.591 0.156 -6.324 1.00 0.400 N ATOM 794 CA ALA A 48 12.954 0.604 -6.148 1.00 0.400 C ATOM 795 C ALA A 48 13.321 1.651 -7.192 1.00 0.500 C ATOM 796 O ALA A 48 13.840 2.713 -6.846 1.00 0.550 O ATOM 797 CB ALA A 48 13.894 -0.579 -6.251 1.00 0.560 C ATOM 798 H ALA A 48 11.416 -0.830 -6.504 1.00 0.480 H ATOM 799 HA ALA A 48 13.044 1.053 -5.159 1.00 0.480 H ATOM 800 1HB ALA A 48 14.913 -0.245 -6.105 1.00 0.670 H ATOM 801 2HB ALA A 48 13.628 -1.320 -5.494 1.00 0.670 H ATOM 802 3HB ALA A 48 13.802 -1.022 -7.233 1.00 0.670 H ATOM 803 N TYR A 49 12.935 1.422 -8.452 1.00 0.560 N ATOM 804 CA TYR A 49 13.262 2.350 -9.528 1.00 0.680 C ATOM 805 C TYR A 49 12.519 3.657 -9.353 1.00 0.710 C ATOM 806 O TYR A 49 13.038 4.730 -9.665 1.00 0.780 O ATOM 807 CB TYR A 49 12.945 1.753 -10.905 1.00 0.900 C ATOM 808 CG TYR A 49 13.893 0.637 -11.364 1.00 0.900 C ATOM 809 CD1 TYR A 49 13.387 -0.616 -11.690 1.00 0.900 C ATOM 810 CD2 TYR A 49 15.263 0.867 -11.453 1.00 0.900 C ATOM 811 CE1 TYR A 49 14.234 -1.622 -12.100 1.00 0.900 C ATOM 812 CE2 TYR A 49 16.109 -0.146 -11.861 1.00 0.900 C ATOM 813 CZ TYR A 49 15.595 -1.387 -12.183 1.00 0.900 C ATOM 814 OH TYR A 49 16.433 -2.398 -12.593 1.00 0.900 O ATOM 815 H TYR A 49 12.489 0.528 -8.679 1.00 0.670 H ATOM 816 HA TYR A 49 14.325 2.570 -9.474 1.00 0.820 H ATOM 817 1HB TYR A 49 11.931 1.343 -10.882 1.00 1.080 H ATOM 818 2HB TYR A 49 12.960 2.542 -11.653 1.00 1.080 H ATOM 819 HD1 TYR A 49 12.317 -0.805 -11.625 1.00 1.080 H ATOM 820 HD2 TYR A 49 15.673 1.844 -11.202 1.00 1.080 H ATOM 821 HE1 TYR A 49 13.834 -2.599 -12.359 1.00 1.080 H ATOM 822 HE2 TYR A 49 17.182 0.034 -11.930 1.00 1.080 H ATOM 823 HH TYR A 49 17.336 -2.074 -12.620 1.00 1.080 H ATOM 824 N ALA A 50 11.322 3.576 -8.791 1.00 0.700 N ATOM 825 CA ALA A 50 10.496 4.741 -8.545 1.00 0.770 C ATOM 826 C ALA A 50 10.989 5.563 -7.352 1.00 0.720 C ATOM 827 O ALA A 50 10.477 6.657 -7.108 1.00 0.820 O ATOM 828 CB ALA A 50 9.064 4.306 -8.284 1.00 1.050 C ATOM 829 H ALA A 50 10.932 2.645 -8.608 1.00 0.840 H ATOM 830 HA ALA A 50 10.531 5.371 -9.431 1.00 0.920 H ATOM 831 1HB ALA A 50 8.439 5.183 -8.128 1.00 1.260 H ATOM 832 2HB ALA A 50 8.697 3.740 -9.139 1.00 1.260 H ATOM 833 3HB ALA A 50 9.038 3.676 -7.399 1.00 1.260 H ATOM 834 N GLY A 51 11.927 5.024 -6.558 1.00 0.620 N ATOM 835 CA GLY A 51 12.398 5.699 -5.357 1.00 0.600 C ATOM 836 C GLY A 51 11.428 5.517 -4.190 1.00 0.600 C ATOM 837 O GLY A 51 11.527 6.212 -3.177 1.00 0.640 O ATOM 838 H GLY A 51 12.387 4.147 -6.815 1.00 0.740 H ATOM 839 1HA GLY A 51 13.376 5.296 -5.088 1.00 0.720 H ATOM 840 2HA GLY A 51 12.531 6.758 -5.567 1.00 0.720 H ATOM 841 N ALA A 52 10.458 4.616 -4.365 1.00 0.600 N ATOM 842 CA ALA A 52 9.407 4.328 -3.399 1.00 0.630 C ATOM 843 C ALA A 52 9.904 3.742 -2.078 1.00 0.600 C ATOM 844 O ALA A 52 9.253 3.921 -1.048 1.00 0.680 O ATOM 845 CB ALA A 52 8.399 3.380 -4.011 1.00 0.870 C ATOM 846 H ALA A 52 10.477 4.056 -5.220 1.00 0.720 H ATOM 847 HA ALA A 52 8.907 5.270 -3.176 1.00 0.760 H ATOM 848 1HB ALA A 52 7.588 3.207 -3.306 1.00 1.040 H ATOM 849 2HB ALA A 52 8.003 3.806 -4.930 1.00 1.040 H ATOM 850 3HB ALA A 52 8.888 2.466 -4.222 1.00 1.040 H ATOM 851 N ILE A 53 11.002 2.977 -2.105 1.00 0.510 N ATOM 852 CA ILE A 53 11.473 2.318 -0.896 1.00 0.510 C ATOM 853 C ILE A 53 12.764 2.967 -0.368 1.00 0.540 C ATOM 854 O ILE A 53 13.800 2.889 -1.036 1.00 0.480 O ATOM 855 CB ILE A 53 11.766 0.836 -1.179 1.00 0.710 C ATOM 856 CG1 ILE A 53 10.497 0.150 -1.716 1.00 0.710 C ATOM 857 CG2 ILE A 53 12.218 0.162 0.124 1.00 0.710 C ATOM 858 CD1 ILE A 53 10.720 -1.244 -2.276 1.00 0.710 C ATOM 859 H ILE A 53 11.513 2.851 -2.968 1.00 0.610 H ATOM 860 HA ILE A 53 10.680 2.345 -0.165 1.00 0.610 H ATOM 861 HB ILE A 53 12.547 0.752 -1.934 1.00 0.860 H ATOM 862 1HG1 ILE A 53 9.763 0.092 -0.917 1.00 0.860 H ATOM 863 2HG1 ILE A 53 10.092 0.763 -2.500 1.00 0.860 H ATOM 864 1HG2 ILE A 53 12.434 -0.871 -0.055 1.00 0.860 H ATOM 865 2HG2 ILE A 53 13.112 0.641 0.512 1.00 0.860 H ATOM 866 3HG2 ILE A 53 11.427 0.243 0.868 1.00 0.860 H ATOM 867 1HD1 ILE A 53 9.785 -1.647 -2.641 1.00 0.860 H ATOM 868 2HD1 ILE A 53 11.438 -1.197 -3.104 1.00 0.860 H ATOM 869 3HD1 ILE A 53 11.093 -1.894 -1.507 1.00 0.860 H ATOM 870 N PRO A 54 12.749 3.596 0.819 1.00 0.640 N ATOM 871 CA PRO A 54 13.885 4.261 1.415 1.00 0.690 C ATOM 872 C PRO A 54 15.044 3.303 1.565 1.00 0.680 C ATOM 873 O PRO A 54 14.851 2.135 1.901 1.00 0.680 O ATOM 874 CB PRO A 54 13.350 4.683 2.788 1.00 1.030 C ATOM 875 CG PRO A 54 11.865 4.814 2.592 1.00 1.030 C ATOM 876 CD PRO A 54 11.503 3.724 1.608 1.00 1.030 C ATOM 877 HA PRO A 54 14.164 5.132 0.801 1.00 0.830 H ATOM 878 1HB PRO A 54 13.617 3.926 3.542 1.00 1.240 H ATOM 879 2HB PRO A 54 13.823 5.625 3.101 1.00 1.240 H ATOM 880 1HG PRO A 54 11.343 4.703 3.556 1.00 1.240 H ATOM 881 2HG PRO A 54 11.617 5.816 2.212 1.00 1.240 H ATOM 882 1HD PRO A 54 11.257 2.780 2.120 1.00 1.240 H ATOM 883 2HD PRO A 54 10.676 4.117 1.000 1.00 1.240 H ATOM 884 N GLY A 55 16.248 3.797 1.323 1.00 0.690 N ATOM 885 CA GLY A 55 17.444 2.984 1.471 1.00 0.730 C ATOM 886 C GLY A 55 17.789 2.142 0.245 1.00 0.690 C ATOM 887 O GLY A 55 18.908 1.632 0.147 1.00 0.790 O ATOM 888 H GLY A 55 16.340 4.762 1.040 1.00 0.830 H ATOM 889 1HA GLY A 55 18.287 3.635 1.707 1.00 0.880 H ATOM 890 2HA GLY A 55 17.316 2.325 2.328 1.00 0.880 H ATOM 891 N VAL A 56 16.853 1.967 -0.688 1.00 0.580 N ATOM 892 CA VAL A 56 17.153 1.118 -1.823 1.00 0.590 C ATOM 893 C VAL A 56 17.750 1.914 -2.966 1.00 0.700 C ATOM 894 O VAL A 56 17.115 2.793 -3.543 1.00 1.110 O ATOM 895 CB VAL A 56 15.880 0.381 -2.274 1.00 0.820 C ATOM 896 CG1 VAL A 56 16.153 -0.470 -3.493 1.00 0.820 C ATOM 897 CG2 VAL A 56 15.389 -0.494 -1.130 1.00 0.820 C ATOM 898 H VAL A 56 15.928 2.412 -0.629 1.00 0.700 H ATOM 899 HA VAL A 56 17.882 0.371 -1.511 1.00 0.710 H ATOM 900 HB VAL A 56 15.112 1.114 -2.533 1.00 0.990 H ATOM 901 1HG1 VAL A 56 15.238 -0.966 -3.773 1.00 0.990 H ATOM 902 2HG1 VAL A 56 16.493 0.156 -4.318 1.00 0.990 H ATOM 903 3HG1 VAL A 56 16.916 -1.212 -3.264 1.00 0.990 H ATOM 904 1HG2 VAL A 56 14.482 -1.007 -1.429 1.00 0.990 H ATOM 905 2HG2 VAL A 56 16.151 -1.224 -0.873 1.00 0.990 H ATOM 906 3HG2 VAL A 56 15.188 0.130 -0.264 1.00 0.990 H ATOM 907 N LYS A 57 18.966 1.565 -3.330 1.00 0.690 N ATOM 908 CA LYS A 57 19.673 2.264 -4.381 1.00 0.780 C ATOM 909 C LYS A 57 20.167 1.269 -5.392 1.00 0.820 C ATOM 910 O LYS A 57 20.459 0.124 -5.046 1.00 1.000 O ATOM 911 CB LYS A 57 20.875 3.027 -3.808 1.00 1.060 C ATOM 912 CG LYS A 57 20.559 4.094 -2.737 1.00 1.060 C ATOM 913 CD LYS A 57 19.836 5.305 -3.321 1.00 1.060 C ATOM 914 CE LYS A 57 19.628 6.390 -2.273 1.00 1.060 C ATOM 915 NZ LYS A 57 18.886 7.566 -2.826 1.00 1.060 N ATOM 916 H LYS A 57 19.424 0.816 -2.827 1.00 0.830 H ATOM 917 HA LYS A 57 18.994 2.948 -4.887 1.00 0.940 H ATOM 918 1HB LYS A 57 21.566 2.311 -3.362 1.00 1.270 H ATOM 919 2HB LYS A 57 21.409 3.515 -4.625 1.00 1.270 H ATOM 920 1HG LYS A 57 19.935 3.650 -1.957 1.00 1.270 H ATOM 921 2HG LYS A 57 21.490 4.424 -2.280 1.00 1.270 H ATOM 922 1HD LYS A 57 20.410 5.713 -4.153 1.00 1.270 H ATOM 923 2HD LYS A 57 18.856 4.998 -3.689 1.00 1.270 H ATOM 924 1HE LYS A 57 19.061 5.972 -1.441 1.00 1.270 H ATOM 925 2HE LYS A 57 20.599 6.724 -1.908 1.00 1.270 H ATOM 926 1HZ LYS A 57 18.767 8.262 -2.102 1.00 1.270 H ATOM 927 2HZ LYS A 57 19.409 7.967 -3.593 1.00 1.270 H ATOM 928 3HZ LYS A 57 17.979 7.267 -3.158 1.00 1.270 H ATOM 929 N LYS A 58 20.260 1.684 -6.643 1.00 0.900 N ATOM 930 CA LYS A 58 20.880 0.812 -7.608 1.00 1.060 C ATOM 931 C LYS A 58 22.364 0.718 -7.260 1.00 1.140 C ATOM 932 O LYS A 58 23.003 1.728 -6.953 1.00 1.810 O ATOM 933 CB LYS A 58 20.668 1.301 -9.043 1.00 1.420 C ATOM 934 CG LYS A 58 21.243 0.344 -10.061 1.00 1.420 C ATOM 935 CD LYS A 58 21.058 0.767 -11.498 1.00 1.420 C ATOM 936 CE LYS A 58 21.787 -0.234 -12.407 1.00 1.420 C ATOM 937 NZ LYS A 58 23.286 -0.154 -12.210 1.00 1.420 N ATOM 938 H LYS A 58 19.960 2.613 -6.899 1.00 1.080 H ATOM 939 HA LYS A 58 20.448 -0.185 -7.516 1.00 1.270 H ATOM 940 1HB LYS A 58 19.605 1.421 -9.243 1.00 1.700 H ATOM 941 2HB LYS A 58 21.148 2.271 -9.176 1.00 1.700 H ATOM 942 1HG LYS A 58 22.289 0.257 -9.883 1.00 1.700 H ATOM 943 2HG LYS A 58 20.790 -0.636 -9.921 1.00 1.700 H ATOM 944 1HD LYS A 58 19.997 0.788 -11.752 1.00 1.700 H ATOM 945 2HD LYS A 58 21.480 1.761 -11.649 1.00 1.700 H ATOM 946 1HE LYS A 58 21.456 -1.241 -12.163 1.00 1.700 H ATOM 947 2HE LYS A 58 21.556 -0.027 -13.450 1.00 1.700 H ATOM 948 1HZ LYS A 58 23.826 -0.828 -12.796 1.00 1.700 H ATOM 949 2HZ LYS A 58 23.611 0.774 -12.444 1.00 1.700 H ATOM 950 3HZ LYS A 58 23.538 -0.347 -11.238 1.00 1.700 H ATOM 951 N ALA A 59 22.898 -0.491 -7.278 1.00 1.240 N ATOM 952 CA ALA A 59 24.317 -0.732 -7.040 1.00 1.500 C ATOM 953 C ALA A 59 25.096 -0.107 -8.177 1.00 2.250 C ATOM 954 O ALA A 59 24.581 -0.025 -9.292 1.00 2.740 O ATOM 955 CB ALA A 59 24.608 -2.217 -6.947 1.00 2.000 C ATOM 956 H ALA A 59 22.297 -1.273 -7.489 1.00 1.490 H ATOM 957 HA ALA A 59 24.605 -0.240 -6.111 1.00 1.800 H ATOM 958 1HB ALA A 59 25.674 -2.366 -6.774 1.00 2.400 H ATOM 959 2HB ALA A 59 24.040 -2.647 -6.124 1.00 2.400 H ATOM 960 3HB ALA A 59 24.323 -2.700 -7.880 1.00 2.400 H ATOM 961 N SER A 60 26.331 0.306 -7.935 1.00 2.970 N ATOM 962 CA SER A 60 27.115 0.887 -9.013 1.00 4.060 C ATOM 963 C SER A 60 27.255 -0.081 -10.179 1.00 4.620 C ATOM 964 O SER A 60 27.426 -1.284 -9.964 1.00 5.040 O ATOM 965 CB SER A 60 28.499 1.252 -8.511 1.00 5.250 C ATOM 966 OG SER A 60 28.435 2.235 -7.512 1.00 5.250 O ATOM 967 H SER A 60 26.729 0.244 -7.010 1.00 3.560 H ATOM 968 HA SER A 60 26.608 1.786 -9.365 1.00 4.870 H ATOM 969 1HB SER A 60 28.987 0.361 -8.120 1.00 6.300 H ATOM 970 2HB SER A 60 29.100 1.611 -9.347 1.00 6.300 H ATOM 971 HG SER A 60 29.347 2.417 -7.261 1.00 6.300 H ATOM 972 N TRP A 61 27.228 0.494 -11.396 1.00 4.960 N ATOM 973 CA TRP A 61 27.395 -0.138 -12.719 1.00 5.920 C ATOM 974 C TRP A 61 26.065 -0.437 -13.418 1.00 6.170 C ATOM 975 O TRP A 61 25.410 0.497 -13.886 1.00 6.760 O ATOM 976 OXT TRP A 61 25.473 -1.490 -13.176 1.00 8.880 O ATOM 977 CB TRP A 61 28.263 -1.408 -12.690 1.00 7.420 C ATOM 978 CG TRP A 61 29.706 -1.137 -12.331 1.00 7.420 C ATOM 979 CD1 TRP A 61 30.316 -1.357 -11.131 1.00 7.420 C ATOM 980 CD2 TRP A 61 30.717 -0.582 -13.196 1.00 7.420 C ATOM 981 NE1 TRP A 61 31.629 -0.978 -11.194 1.00 7.420 N ATOM 982 CE2 TRP A 61 31.893 -0.500 -12.448 1.00 7.420 C ATOM 983 CE3 TRP A 61 30.719 -0.148 -14.526 1.00 7.420 C ATOM 984 CZ2 TRP A 61 33.067 -0.007 -12.984 1.00 7.420 C ATOM 985 CZ3 TRP A 61 31.896 0.346 -15.064 1.00 7.420 C ATOM 986 CH2 TRP A 61 33.040 0.416 -14.311 1.00 7.420 C ATOM 987 H TRP A 61 27.075 1.492 -11.398 1.00 5.950 H ATOM 988 HA TRP A 61 27.931 0.572 -13.348 1.00 7.100 H ATOM 989 1HB TRP A 61 27.852 -2.170 -12.045 1.00 8.900 H ATOM 990 2HB TRP A 61 28.266 -1.838 -13.688 1.00 8.900 H ATOM 991 HD1 TRP A 61 29.827 -1.773 -10.252 1.00 8.900 H ATOM 992 HE1 TRP A 61 32.294 -1.041 -10.437 1.00 8.900 H ATOM 993 HE3 TRP A 61 29.813 -0.202 -15.127 1.00 8.900 H ATOM 994 HZ2 TRP A 61 33.986 0.056 -12.403 1.00 8.900 H ATOM 995 HZ3 TRP A 61 31.890 0.681 -16.100 1.00 8.900 H ATOM 996 HH2 TRP A 61 33.949 0.809 -14.764 1.00 8.900 H TER 997 ENDMDL REMARK ID 14032 MODEL 3 SSGCID - MygeA.18852.a 30S ribosomal protein S14 type Z MG_164 PFRMAT TS TARGET SSGCID - MygeA.18852.a 30S ribosomal protein S14 type Z MG_164 AUTHOR BAKER-ROSETTASERVER METHOD ROSETTA provides both ab initio and METHOD comparative models of protein domains. METHOD Comparative models are built from structures METHOD detected and aligned by HHSEARCH, SPARKS, and METHOD Raptor. Loop regions are assembled from fragments and METHOD optimized to fit the aligned template structures. METHOD De novo models are built using the Rosetta de METHOD novo protocol. The procedure is fully automated. MODEL 3 PARENT 3j9mAK_305 REMARK PARENT 3j9mAK_305 REMARK PARSRC alignment REMARK SCORE 0.81 ATOM 1 N MET A 1 -4.978 -3.900 -8.477 1.00 4.860 N ATOM 2 CA MET A 1 -3.835 -4.791 -8.574 1.00 4.440 C ATOM 3 C MET A 1 -4.200 -6.173 -8.025 1.00 3.360 C ATOM 4 O MET A 1 -3.992 -7.183 -8.698 1.00 2.870 O ATOM 5 CB MET A 1 -2.640 -4.184 -7.832 1.00 6.380 C ATOM 6 CG MET A 1 -2.021 -2.900 -8.483 1.00 6.380 C ATOM 7 SD MET A 1 -1.264 -3.176 -10.088 1.00 6.380 S ATOM 8 CE MET A 1 0.248 -4.047 -9.627 1.00 6.380 C ATOM 9 1H MET A 1 -4.785 -3.022 -8.934 1.00 5.830 H ATOM 10 2H MET A 1 -5.785 -4.338 -8.899 1.00 5.830 H ATOM 11 3H MET A 1 -5.151 -3.750 -7.487 1.00 5.830 H ATOM 12 HA MET A 1 -3.574 -4.911 -9.624 1.00 5.330 H ATOM 13 1HB MET A 1 -2.950 -3.917 -6.842 1.00 7.660 H ATOM 14 2HB MET A 1 -1.869 -4.937 -7.726 1.00 7.660 H ATOM 15 1HG MET A 1 -2.801 -2.154 -8.609 1.00 7.660 H ATOM 16 2HG MET A 1 -1.271 -2.471 -7.827 1.00 7.660 H ATOM 17 1HE MET A 1 0.820 -4.275 -10.527 1.00 7.660 H ATOM 18 2HE MET A 1 0.848 -3.415 -8.973 1.00 7.660 H ATOM 19 3HE MET A 1 0.005 -4.975 -9.116 1.00 7.660 H ATOM 20 N ALA A 2 -4.747 -6.220 -6.811 1.00 3.230 N ATOM 21 CA ALA A 2 -5.172 -7.478 -6.203 1.00 2.410 C ATOM 22 C ALA A 2 -6.496 -7.962 -6.752 1.00 1.640 C ATOM 23 O ALA A 2 -7.306 -7.171 -7.248 1.00 2.090 O ATOM 24 CB ALA A 2 -5.304 -7.336 -4.714 1.00 3.700 C ATOM 25 H ALA A 2 -4.872 -5.365 -6.271 1.00 3.880 H ATOM 26 HA ALA A 2 -4.414 -8.230 -6.424 1.00 2.890 H ATOM 27 1HB ALA A 2 -5.595 -8.274 -4.271 1.00 4.440 H ATOM 28 2HB ALA A 2 -4.356 -7.023 -4.310 1.00 4.440 H ATOM 29 3HB ALA A 2 -6.060 -6.614 -4.520 1.00 4.440 H ATOM 30 N LYS A 3 -6.711 -9.267 -6.629 1.00 0.850 N ATOM 31 CA LYS A 3 -7.962 -9.891 -6.981 1.00 0.840 C ATOM 32 C LYS A 3 -8.999 -9.607 -5.907 1.00 0.700 C ATOM 33 O LYS A 3 -8.679 -9.590 -4.710 1.00 0.640 O ATOM 34 CB LYS A 3 -7.766 -11.396 -7.147 1.00 1.180 C ATOM 35 CG LYS A 3 -6.880 -11.784 -8.323 1.00 1.180 C ATOM 36 CD LYS A 3 -6.737 -13.300 -8.439 1.00 1.180 C ATOM 37 CE LYS A 3 -5.844 -13.691 -9.615 1.00 1.180 C ATOM 38 NZ LYS A 3 -5.683 -15.170 -9.726 1.00 1.180 N ATOM 39 H LYS A 3 -5.965 -9.838 -6.260 1.00 1.020 H ATOM 40 HA LYS A 3 -8.315 -9.464 -7.922 1.00 1.010 H ATOM 41 1HB LYS A 3 -7.317 -11.805 -6.239 1.00 1.420 H ATOM 42 2HB LYS A 3 -8.734 -11.878 -7.275 1.00 1.420 H ATOM 43 1HG LYS A 3 -7.314 -11.394 -9.244 1.00 1.420 H ATOM 44 2HG LYS A 3 -5.893 -11.339 -8.195 1.00 1.420 H ATOM 45 1HD LYS A 3 -6.303 -13.695 -7.518 1.00 1.420 H ATOM 46 2HD LYS A 3 -7.719 -13.750 -8.579 1.00 1.420 H ATOM 47 1HE LYS A 3 -6.285 -13.314 -10.537 1.00 1.420 H ATOM 48 2HE LYS A 3 -4.862 -13.238 -9.483 1.00 1.420 H ATOM 49 1HZ LYS A 3 -5.088 -15.386 -10.514 1.00 1.420 H ATOM 50 2HZ LYS A 3 -5.263 -15.530 -8.880 1.00 1.420 H ATOM 51 3HZ LYS A 3 -6.587 -15.600 -9.861 1.00 1.420 H ATOM 52 N LYS A 4 -10.261 -9.498 -6.321 1.00 0.760 N ATOM 53 CA LYS A 4 -11.359 -9.272 -5.386 1.00 0.770 C ATOM 54 C LYS A 4 -11.351 -10.252 -4.226 1.00 0.800 C ATOM 55 O LYS A 4 -11.594 -9.864 -3.087 1.00 0.790 O ATOM 56 CB LYS A 4 -12.711 -9.340 -6.096 1.00 1.070 C ATOM 57 CG LYS A 4 -13.909 -9.081 -5.174 1.00 1.070 C ATOM 58 CD LYS A 4 -15.225 -9.077 -5.939 1.00 1.070 C ATOM 59 CE LYS A 4 -16.407 -8.873 -4.997 1.00 1.070 C ATOM 60 NZ LYS A 4 -17.708 -8.859 -5.729 1.00 1.070 N ATOM 61 H LYS A 4 -10.453 -9.532 -7.314 1.00 0.910 H ATOM 62 HA LYS A 4 -11.245 -8.269 -4.972 1.00 0.920 H ATOM 63 1HB LYS A 4 -12.739 -8.605 -6.900 1.00 1.290 H ATOM 64 2HB LYS A 4 -12.839 -10.325 -6.543 1.00 1.290 H ATOM 65 1HG LYS A 4 -13.962 -9.866 -4.419 1.00 1.290 H ATOM 66 2HG LYS A 4 -13.778 -8.126 -4.664 1.00 1.290 H ATOM 67 1HD LYS A 4 -15.216 -8.275 -6.679 1.00 1.290 H ATOM 68 2HD LYS A 4 -15.345 -10.027 -6.457 1.00 1.290 H ATOM 69 1HE LYS A 4 -16.422 -9.680 -4.265 1.00 1.290 H ATOM 70 2HE LYS A 4 -16.286 -7.925 -4.473 1.00 1.290 H ATOM 71 1HZ LYS A 4 -18.464 -8.722 -5.072 1.00 1.290 H ATOM 72 2HZ LYS A 4 -17.709 -8.106 -6.403 1.00 1.290 H ATOM 73 3HZ LYS A 4 -17.837 -9.739 -6.209 1.00 1.290 H ATOM 74 N SER A 5 -11.054 -11.525 -4.484 1.00 0.910 N ATOM 75 CA SER A 5 -11.092 -12.507 -3.412 1.00 0.980 C ATOM 76 C SER A 5 -10.106 -12.197 -2.286 1.00 0.860 C ATOM 77 O SER A 5 -10.360 -12.555 -1.133 1.00 0.890 O ATOM 78 CB SER A 5 -10.809 -13.887 -3.974 1.00 1.340 C ATOM 79 OG SER A 5 -9.494 -13.978 -4.454 1.00 1.340 O ATOM 80 H SER A 5 -10.823 -11.816 -5.422 1.00 1.090 H ATOM 81 HA SER A 5 -12.097 -12.506 -2.992 1.00 1.180 H ATOM 82 1HB SER A 5 -10.968 -14.634 -3.197 1.00 1.610 H ATOM 83 2HB SER A 5 -11.508 -14.099 -4.780 1.00 1.610 H ATOM 84 HG SER A 5 -9.400 -14.871 -4.802 1.00 1.610 H ATOM 85 N LEU A 6 -9.021 -11.471 -2.578 1.00 0.760 N ATOM 86 CA LEU A 6 -8.052 -11.130 -1.555 1.00 0.670 C ATOM 87 C LEU A 6 -8.596 -9.966 -0.767 1.00 0.560 C ATOM 88 O LEU A 6 -8.503 -9.940 0.462 1.00 0.600 O ATOM 89 CB LEU A 6 -6.718 -10.741 -2.200 1.00 0.970 C ATOM 90 CG LEU A 6 -5.963 -11.861 -2.951 1.00 0.970 C ATOM 91 CD1 LEU A 6 -4.800 -11.242 -3.706 1.00 0.970 C ATOM 92 CD2 LEU A 6 -5.448 -12.911 -1.958 1.00 0.970 C ATOM 93 H LEU A 6 -8.855 -11.144 -3.528 1.00 0.910 H ATOM 94 HA LEU A 6 -7.927 -11.971 -0.882 1.00 0.800 H ATOM 95 1HB LEU A 6 -6.907 -9.940 -2.909 1.00 1.170 H ATOM 96 2HB LEU A 6 -6.062 -10.354 -1.425 1.00 1.170 H ATOM 97 HG LEU A 6 -6.632 -12.336 -3.672 1.00 1.170 H ATOM 98 1HD1 LEU A 6 -4.264 -12.020 -4.248 1.00 1.170 H ATOM 99 2HD1 LEU A 6 -5.175 -10.515 -4.407 1.00 1.170 H ATOM 100 3HD1 LEU A 6 -4.124 -10.756 -3.006 1.00 1.170 H ATOM 101 1HD2 LEU A 6 -4.911 -13.687 -2.504 1.00 1.170 H ATOM 102 2HD2 LEU A 6 -4.776 -12.440 -1.244 1.00 1.170 H ATOM 103 3HD2 LEU A 6 -6.276 -13.369 -1.425 1.00 1.170 H ATOM 104 N LYS A 7 -9.193 -9.008 -1.484 1.00 0.510 N ATOM 105 CA LYS A 7 -9.770 -7.823 -0.848 1.00 0.510 C ATOM 106 C LYS A 7 -10.895 -8.234 0.114 1.00 0.620 C ATOM 107 O LYS A 7 -11.089 -7.617 1.174 1.00 0.690 O ATOM 108 CB LYS A 7 -10.289 -6.833 -1.898 1.00 0.710 C ATOM 109 CG LYS A 7 -9.186 -6.122 -2.726 1.00 0.710 C ATOM 110 CD LYS A 7 -9.801 -5.151 -3.747 1.00 0.710 C ATOM 111 CE LYS A 7 -8.733 -4.443 -4.597 1.00 0.710 C ATOM 112 NZ LYS A 7 -9.346 -3.497 -5.589 1.00 0.710 N ATOM 113 H LYS A 7 -9.194 -9.112 -2.506 1.00 0.610 H ATOM 114 HA LYS A 7 -8.993 -7.331 -0.263 1.00 0.610 H ATOM 115 1HB LYS A 7 -10.943 -7.359 -2.591 1.00 0.860 H ATOM 116 2HB LYS A 7 -10.887 -6.069 -1.404 1.00 0.860 H ATOM 117 1HG LYS A 7 -8.523 -5.574 -2.057 1.00 0.860 H ATOM 118 2HG LYS A 7 -8.597 -6.874 -3.259 1.00 0.860 H ATOM 119 1HD LYS A 7 -10.465 -5.706 -4.413 1.00 0.860 H ATOM 120 2HD LYS A 7 -10.390 -4.397 -3.223 1.00 0.860 H ATOM 121 1HE LYS A 7 -8.065 -3.883 -3.946 1.00 0.860 H ATOM 122 2HE LYS A 7 -8.153 -5.196 -5.140 1.00 0.860 H ATOM 123 1HZ LYS A 7 -8.616 -3.050 -6.139 1.00 0.860 H ATOM 124 2HZ LYS A 7 -9.961 -4.007 -6.207 1.00 0.860 H ATOM 125 3HZ LYS A 7 -9.873 -2.788 -5.097 1.00 0.860 H ATOM 126 N VAL A 8 -11.648 -9.266 -0.286 1.00 0.700 N ATOM 127 CA VAL A 8 -12.720 -9.797 0.533 1.00 0.820 C ATOM 128 C VAL A 8 -12.172 -10.572 1.724 1.00 0.830 C ATOM 129 O VAL A 8 -12.574 -10.310 2.852 1.00 0.860 O ATOM 130 CB VAL A 8 -13.673 -10.691 -0.292 1.00 1.100 C ATOM 131 CG1 VAL A 8 -14.694 -11.396 0.635 1.00 1.100 C ATOM 132 CG2 VAL A 8 -14.423 -9.815 -1.317 1.00 1.100 C ATOM 133 H VAL A 8 -11.459 -9.666 -1.210 1.00 0.840 H ATOM 134 HA VAL A 8 -13.302 -8.957 0.910 1.00 0.980 H ATOM 135 HB VAL A 8 -13.091 -11.454 -0.809 1.00 1.320 H ATOM 136 1HG1 VAL A 8 -15.354 -12.015 0.032 1.00 1.320 H ATOM 137 2HG1 VAL A 8 -14.180 -12.026 1.358 1.00 1.320 H ATOM 138 3HG1 VAL A 8 -15.283 -10.646 1.165 1.00 1.320 H ATOM 139 1HG2 VAL A 8 -15.088 -10.436 -1.913 1.00 1.320 H ATOM 140 2HG2 VAL A 8 -15.004 -9.058 -0.791 1.00 1.320 H ATOM 141 3HG2 VAL A 8 -13.710 -9.324 -1.967 1.00 1.320 H ATOM 142 N LYS A 9 -11.233 -11.504 1.519 1.00 0.830 N ATOM 143 CA LYS A 9 -10.701 -12.260 2.656 1.00 0.900 C ATOM 144 C LYS A 9 -10.091 -11.332 3.702 1.00 0.840 C ATOM 145 O LYS A 9 -10.277 -11.524 4.901 1.00 0.900 O ATOM 146 CB LYS A 9 -9.684 -13.302 2.194 1.00 1.230 C ATOM 147 CG LYS A 9 -10.303 -14.502 1.468 1.00 1.230 C ATOM 148 CD LYS A 9 -9.232 -15.477 0.975 1.00 1.230 C ATOM 149 CE LYS A 9 -9.850 -16.661 0.242 1.00 1.230 C ATOM 150 NZ LYS A 9 -8.812 -17.601 -0.274 1.00 1.230 N ATOM 151 H LYS A 9 -10.901 -11.714 0.573 1.00 1.000 H ATOM 152 HA LYS A 9 -11.527 -12.787 3.123 1.00 1.080 H ATOM 153 1HB LYS A 9 -8.975 -12.828 1.509 1.00 1.480 H ATOM 154 2HB LYS A 9 -9.122 -13.670 3.050 1.00 1.480 H ATOM 155 1HG LYS A 9 -10.959 -15.025 2.160 1.00 1.480 H ATOM 156 2HG LYS A 9 -10.903 -14.161 0.632 1.00 1.480 H ATOM 157 1HD LYS A 9 -8.562 -14.950 0.290 1.00 1.480 H ATOM 158 2HD LYS A 9 -8.650 -15.842 1.820 1.00 1.480 H ATOM 159 1HE LYS A 9 -10.507 -17.198 0.925 1.00 1.480 H ATOM 160 2HE LYS A 9 -10.440 -16.290 -0.598 1.00 1.480 H ATOM 161 1HZ LYS A 9 -9.260 -18.370 -0.753 1.00 1.480 H ATOM 162 2HZ LYS A 9 -8.206 -17.110 -0.918 1.00 1.480 H ATOM 163 3HZ LYS A 9 -8.265 -17.960 0.496 1.00 1.480 H ATOM 164 N GLN A 10 -9.438 -10.278 3.235 1.00 0.760 N ATOM 165 CA GLN A 10 -8.813 -9.248 4.046 1.00 0.790 C ATOM 166 C GLN A 10 -9.781 -8.539 4.975 1.00 0.800 C ATOM 167 O GLN A 10 -9.381 -7.977 5.998 1.00 0.910 O ATOM 168 CB GLN A 10 -8.195 -8.204 3.116 1.00 1.090 C ATOM 169 CG GLN A 10 -7.522 -7.033 3.782 1.00 1.090 C ATOM 170 CD GLN A 10 -6.361 -7.390 4.579 1.00 1.090 C ATOM 171 OE1 GLN A 10 -5.470 -8.165 4.171 1.00 1.090 O ATOM 172 NE2 GLN A 10 -6.342 -6.797 5.747 1.00 1.090 N ATOM 173 H GLN A 10 -9.309 -10.198 2.222 1.00 0.910 H ATOM 174 HA GLN A 10 -8.035 -9.714 4.648 1.00 0.950 H ATOM 175 1HB GLN A 10 -7.471 -8.695 2.474 1.00 1.310 H ATOM 176 2HB GLN A 10 -8.967 -7.805 2.474 1.00 1.310 H ATOM 177 1HG GLN A 10 -7.223 -6.323 3.037 1.00 1.310 H ATOM 178 2HG GLN A 10 -8.228 -6.539 4.437 1.00 1.310 H ATOM 179 1HE2 GLN A 10 -5.587 -6.924 6.399 1.00 1.310 H ATOM 180 2HE2 GLN A 10 -7.097 -6.194 6.010 1.00 1.310 H ATOM 181 N SER A 11 -11.033 -8.470 4.563 1.00 0.790 N ATOM 182 CA SER A 11 -12.059 -7.738 5.252 1.00 0.890 C ATOM 183 C SER A 11 -12.758 -8.589 6.313 1.00 0.910 C ATOM 184 O SER A 11 -13.608 -8.089 7.056 1.00 1.020 O ATOM 185 CB SER A 11 -13.068 -7.258 4.217 1.00 1.210 C ATOM 186 OG SER A 11 -12.465 -6.390 3.261 1.00 1.210 O ATOM 187 H SER A 11 -11.332 -9.025 3.762 1.00 0.950 H ATOM 188 HA SER A 11 -11.600 -6.878 5.739 1.00 1.070 H ATOM 189 1HB SER A 11 -13.506 -8.114 3.709 1.00 1.450 H ATOM 190 2HB SER A 11 -13.872 -6.734 4.726 1.00 1.450 H ATOM 191 HG SER A 11 -11.984 -6.966 2.592 1.00 1.450 H ATOM 192 N ARG A 12 -12.440 -9.885 6.368 1.00 0.870 N ATOM 193 CA ARG A 12 -13.097 -10.771 7.309 1.00 0.910 C ATOM 194 C ARG A 12 -12.444 -10.586 8.674 1.00 0.910 C ATOM 195 O ARG A 12 -11.252 -10.325 8.741 1.00 1.280 O ATOM 196 CB ARG A 12 -12.981 -12.211 6.846 1.00 1.260 C ATOM 197 CG ARG A 12 -13.721 -12.490 5.549 1.00 1.260 C ATOM 198 CD ARG A 12 -13.546 -13.874 5.075 1.00 1.260 C ATOM 199 NE ARG A 12 -14.193 -14.065 3.783 1.00 1.260 N ATOM 200 CZ ARG A 12 -14.125 -15.180 3.029 1.00 1.260 C ATOM 201 NH1 ARG A 12 -13.431 -16.225 3.438 1.00 1.260 N ATOM 202 NH2 ARG A 12 -14.763 -15.224 1.870 1.00 1.260 N ATOM 203 H ARG A 12 -11.705 -10.265 5.763 1.00 1.040 H ATOM 204 HA ARG A 12 -14.146 -10.510 7.325 1.00 1.090 H ATOM 205 1HB ARG A 12 -11.930 -12.455 6.688 1.00 1.510 H ATOM 206 2HB ARG A 12 -13.363 -12.882 7.613 1.00 1.510 H ATOM 207 1HG ARG A 12 -14.784 -12.311 5.695 1.00 1.510 H ATOM 208 2HG ARG A 12 -13.348 -11.821 4.775 1.00 1.510 H ATOM 209 1HD ARG A 12 -12.481 -14.084 4.968 1.00 1.510 H ATOM 210 2HD ARG A 12 -13.990 -14.564 5.791 1.00 1.510 H ATOM 211 HE ARG A 12 -14.741 -13.291 3.426 1.00 1.510 H ATOM 212 1HH1 ARG A 12 -12.946 -16.199 4.323 1.00 1.510 H ATOM 213 2HH1 ARG A 12 -13.388 -17.059 2.869 1.00 1.510 H ATOM 214 1HH2 ARG A 12 -15.297 -14.425 1.557 1.00 1.510 H ATOM 215 2HH2 ARG A 12 -14.723 -16.055 1.298 1.00 1.510 H ATOM 216 N PRO A 13 -13.166 -10.682 9.792 1.00 1.310 N ATOM 217 CA PRO A 13 -12.592 -10.594 11.123 1.00 1.570 C ATOM 218 C PRO A 13 -11.497 -11.629 11.272 1.00 1.240 C ATOM 219 O PRO A 13 -11.666 -12.767 10.834 1.00 1.750 O ATOM 220 CB PRO A 13 -13.790 -10.923 12.022 1.00 2.350 C ATOM 221 CG PRO A 13 -15.000 -10.502 11.209 1.00 2.350 C ATOM 222 CD PRO A 13 -14.636 -10.829 9.767 1.00 2.350 C ATOM 223 HA PRO A 13 -12.208 -9.578 11.295 1.00 1.880 H ATOM 224 1HB PRO A 13 -13.788 -11.996 12.270 1.00 2.830 H ATOM 225 2HB PRO A 13 -13.705 -10.377 12.973 1.00 2.830 H ATOM 226 1HG PRO A 13 -15.894 -11.045 11.555 1.00 2.830 H ATOM 227 2HG PRO A 13 -15.203 -9.431 11.357 1.00 2.830 H ATOM 228 1HD PRO A 13 -14.928 -11.854 9.496 1.00 2.830 H ATOM 229 2HD PRO A 13 -15.114 -10.063 9.140 1.00 2.830 H ATOM 230 N ASN A 14 -10.397 -11.252 11.924 1.00 1.620 N ATOM 231 CA ASN A 14 -9.308 -12.194 12.124 1.00 2.110 C ATOM 232 C ASN A 14 -9.421 -12.924 13.440 1.00 2.000 C ATOM 233 O ASN A 14 -9.295 -12.345 14.519 1.00 2.630 O ATOM 234 CB ASN A 14 -7.958 -11.535 11.986 1.00 2.760 C ATOM 235 CG ASN A 14 -7.705 -11.127 10.591 1.00 2.760 C ATOM 236 OD1 ASN A 14 -8.044 -11.881 9.675 1.00 2.760 O ATOM 237 ND2 ASN A 14 -7.127 -9.975 10.397 1.00 2.760 N ATOM 238 H ASN A 14 -10.315 -10.306 12.266 1.00 1.940 H ATOM 239 HA ASN A 14 -9.373 -12.956 11.347 1.00 2.530 H ATOM 240 1HB ASN A 14 -7.902 -10.662 12.633 1.00 3.310 H ATOM 241 2HB ASN A 14 -7.175 -12.231 12.300 1.00 3.310 H ATOM 242 1HD2 ASN A 14 -6.939 -9.672 9.465 1.00 3.310 H ATOM 243 2HD2 ASN A 14 -6.870 -9.403 11.175 1.00 3.310 H ATOM 244 N LYS A 15 -9.667 -14.209 13.318 1.00 2.070 N ATOM 245 CA LYS A 15 -9.849 -15.117 14.434 1.00 2.650 C ATOM 246 C LYS A 15 -8.502 -15.501 15.025 1.00 2.480 C ATOM 247 O LYS A 15 -7.451 -15.150 14.486 1.00 2.670 O ATOM 248 CB LYS A 15 -10.603 -16.363 13.979 1.00 3.480 C ATOM 249 CG LYS A 15 -12.032 -16.092 13.525 1.00 3.480 C ATOM 250 CD LYS A 15 -12.731 -17.379 13.098 1.00 3.480 C ATOM 251 CE LYS A 15 -14.165 -17.114 12.647 1.00 3.480 C ATOM 252 NZ LYS A 15 -14.853 -18.364 12.209 1.00 3.480 N ATOM 253 H LYS A 15 -9.795 -14.543 12.369 1.00 2.480 H ATOM 254 HA LYS A 15 -10.427 -14.610 15.208 1.00 3.180 H ATOM 255 1HB LYS A 15 -10.070 -16.826 13.154 1.00 4.170 H ATOM 256 2HB LYS A 15 -10.638 -17.088 14.790 1.00 4.170 H ATOM 257 1HG LYS A 15 -12.588 -15.635 14.344 1.00 4.170 H ATOM 258 2HG LYS A 15 -12.020 -15.392 12.686 1.00 4.170 H ATOM 259 1HD LYS A 15 -12.179 -17.835 12.275 1.00 4.170 H ATOM 260 2HD LYS A 15 -12.747 -18.080 13.933 1.00 4.170 H ATOM 261 1HE LYS A 15 -14.723 -16.676 13.473 1.00 4.170 H ATOM 262 2HE LYS A 15 -14.152 -16.408 11.816 1.00 4.170 H ATOM 263 1HZ LYS A 15 -15.797 -18.146 11.919 1.00 4.170 H ATOM 264 2HZ LYS A 15 -14.350 -18.774 11.434 1.00 4.170 H ATOM 265 3HZ LYS A 15 -14.882 -19.022 12.975 1.00 4.170 H ATOM 266 N PHE A 16 -8.514 -16.174 16.166 1.00 2.600 N ATOM 267 CA PHE A 16 -7.255 -16.582 16.765 1.00 2.860 C ATOM 268 C PHE A 16 -6.398 -17.358 15.777 1.00 3.020 C ATOM 269 O PHE A 16 -6.889 -18.275 15.113 1.00 3.590 O ATOM 270 CB PHE A 16 -7.495 -17.452 17.995 1.00 3.900 C ATOM 271 CG PHE A 16 -6.225 -17.905 18.626 1.00 3.900 C ATOM 272 CD1 PHE A 16 -5.501 -17.069 19.453 1.00 3.900 C ATOM 273 CD2 PHE A 16 -5.737 -19.176 18.370 1.00 3.900 C ATOM 274 CE1 PHE A 16 -4.317 -17.493 20.007 1.00 3.900 C ATOM 275 CE2 PHE A 16 -4.557 -19.600 18.922 1.00 3.900 C ATOM 276 CZ PHE A 16 -3.844 -18.757 19.741 1.00 3.900 C ATOM 277 H PHE A 16 -9.392 -16.418 16.605 1.00 3.120 H ATOM 278 HA PHE A 16 -6.711 -15.685 17.065 1.00 3.430 H ATOM 279 1HB PHE A 16 -8.067 -16.897 18.735 1.00 4.680 H ATOM 280 2HB PHE A 16 -8.073 -18.332 17.717 1.00 4.680 H ATOM 281 HD1 PHE A 16 -5.872 -16.065 19.663 1.00 4.680 H ATOM 282 HD2 PHE A 16 -6.302 -19.842 17.710 1.00 4.680 H ATOM 283 HE1 PHE A 16 -3.750 -16.826 20.658 1.00 4.680 H ATOM 284 HE2 PHE A 16 -4.182 -20.602 18.709 1.00 4.680 H ATOM 285 HZ PHE A 16 -2.905 -19.091 20.180 1.00 4.680 H ATOM 286 N SER A 17 -5.110 -16.980 15.706 1.00 3.020 N ATOM 287 CA SER A 17 -4.071 -17.566 14.841 1.00 3.400 C ATOM 288 C SER A 17 -4.112 -17.042 13.399 1.00 3.130 C ATOM 289 O SER A 17 -3.241 -17.378 12.591 1.00 3.650 O ATOM 290 CB SER A 17 -4.135 -19.087 14.815 1.00 4.610 C ATOM 291 OG SER A 17 -5.048 -19.549 13.865 1.00 4.610 O ATOM 292 H SER A 17 -4.825 -16.203 16.285 1.00 3.620 H ATOM 293 HA SER A 17 -3.104 -17.290 15.261 1.00 4.080 H ATOM 294 1HB SER A 17 -3.146 -19.480 14.588 1.00 5.530 H ATOM 295 2HB SER A 17 -4.411 -19.458 15.794 1.00 5.530 H ATOM 296 HG SER A 17 -5.909 -19.260 14.192 1.00 5.530 H ATOM 297 N VAL A 18 -5.113 -16.226 13.066 1.00 2.640 N ATOM 298 CA VAL A 18 -5.237 -15.701 11.719 1.00 2.770 C ATOM 299 C VAL A 18 -4.499 -14.376 11.549 1.00 2.060 C ATOM 300 O VAL A 18 -4.704 -13.433 12.303 1.00 2.330 O ATOM 301 CB VAL A 18 -6.723 -15.513 11.373 1.00 3.830 C ATOM 302 CG1 VAL A 18 -6.883 -14.916 9.986 1.00 3.830 C ATOM 303 CG2 VAL A 18 -7.432 -16.868 11.495 1.00 3.830 C ATOM 304 H VAL A 18 -5.812 -15.945 13.760 1.00 3.170 H ATOM 305 HA VAL A 18 -4.812 -16.428 11.029 1.00 3.320 H ATOM 306 HB VAL A 18 -7.159 -14.809 12.068 1.00 4.590 H ATOM 307 1HG1 VAL A 18 -7.941 -14.776 9.771 1.00 4.590 H ATOM 308 2HG1 VAL A 18 -6.384 -13.946 9.927 1.00 4.590 H ATOM 309 3HG1 VAL A 18 -6.450 -15.587 9.246 1.00 4.590 H ATOM 310 1HG2 VAL A 18 -8.488 -16.745 11.271 1.00 4.590 H ATOM 311 2HG2 VAL A 18 -6.990 -17.572 10.794 1.00 4.590 H ATOM 312 3HG2 VAL A 18 -7.320 -17.254 12.512 1.00 4.590 H ATOM 313 N ARG A 19 -3.601 -14.351 10.576 1.00 1.870 N ATOM 314 CA ARG A 19 -2.764 -13.209 10.184 1.00 1.890 C ATOM 315 C ARG A 19 -3.434 -11.874 9.797 1.00 1.650 C ATOM 316 O ARG A 19 -4.248 -11.975 8.881 1.00 2.030 O ATOM 317 CB ARG A 19 -1.891 -13.616 9.017 1.00 2.640 C ATOM 318 CG ARG A 19 -0.798 -14.643 9.282 1.00 2.640 C ATOM 319 CD ARG A 19 0.342 -14.068 10.057 1.00 2.640 C ATOM 320 NE ARG A 19 0.959 -12.942 9.340 1.00 2.640 N ATOM 321 CZ ARG A 19 1.899 -13.042 8.366 1.00 2.640 C ATOM 322 NH1 ARG A 19 2.350 -14.219 7.977 1.00 2.640 N ATOM 323 NH2 ARG A 19 2.369 -11.941 7.800 1.00 2.640 N ATOM 324 H ARG A 19 -3.506 -15.204 10.045 1.00 2.240 H ATOM 325 HA ARG A 19 -2.126 -12.990 11.037 1.00 2.270 H ATOM 326 1HB ARG A 19 -2.531 -14.055 8.269 1.00 3.170 H ATOM 327 2HB ARG A 19 -1.435 -12.727 8.584 1.00 3.170 H ATOM 328 1HG ARG A 19 -1.212 -15.471 9.856 1.00 3.170 H ATOM 329 2HG ARG A 19 -0.422 -15.013 8.329 1.00 3.170 H ATOM 330 1HD ARG A 19 0.001 -13.710 11.024 1.00 3.170 H ATOM 331 2HD ARG A 19 1.097 -14.834 10.218 1.00 3.170 H ATOM 332 HE ARG A 19 0.653 -12.008 9.595 1.00 3.170 H ATOM 333 1HH1 ARG A 19 2.000 -15.064 8.400 1.00 3.170 H ATOM 334 2HH1 ARG A 19 3.049 -14.278 7.250 1.00 3.170 H ATOM 335 1HH2 ARG A 19 2.024 -11.036 8.093 1.00 3.170 H ATOM 336 2HH2 ARG A 19 3.068 -12.002 7.074 1.00 3.170 H ATOM 337 N ASP A 20 -3.736 -11.046 10.784 1.00 1.360 N ATOM 338 CA ASP A 20 -3.184 -9.679 10.813 1.00 1.470 C ATOM 339 C ASP A 20 -2.615 -9.071 9.508 1.00 1.160 C ATOM 340 O ASP A 20 -1.438 -8.724 9.493 1.00 1.580 O ATOM 341 CB ASP A 20 -2.108 -9.580 11.901 1.00 2.010 C ATOM 342 CG ASP A 20 -2.679 -9.637 13.319 1.00 2.010 C ATOM 343 OD1 ASP A 20 -3.864 -9.410 13.490 1.00 2.010 O ATOM 344 OD2 ASP A 20 -1.919 -9.891 14.226 1.00 2.010 O ATOM 345 H ASP A 20 -4.685 -11.096 11.134 1.00 1.630 H ATOM 346 HA ASP A 20 -4.001 -9.027 11.123 1.00 1.760 H ATOM 347 1HB ASP A 20 -1.391 -10.389 11.782 1.00 2.420 H ATOM 348 2HB ASP A 20 -1.564 -8.640 11.796 1.00 2.420 H ATOM 349 N TYR A 21 -3.340 -8.969 8.414 1.00 1.010 N ATOM 350 CA TYR A 21 -2.713 -8.369 7.228 1.00 0.980 C ATOM 351 C TYR A 21 -3.143 -6.940 7.011 1.00 0.780 C ATOM 352 O TYR A 21 -4.246 -6.561 7.388 1.00 1.080 O ATOM 353 CB TYR A 21 -2.998 -9.150 5.945 1.00 1.380 C ATOM 354 CG TYR A 21 -2.297 -10.466 5.787 1.00 1.380 C ATOM 355 CD1 TYR A 21 -2.973 -11.648 5.978 1.00 1.380 C ATOM 356 CD2 TYR A 21 -0.957 -10.483 5.429 1.00 1.380 C ATOM 357 CE1 TYR A 21 -2.320 -12.846 5.796 1.00 1.380 C ATOM 358 CE2 TYR A 21 -0.303 -11.681 5.260 1.00 1.380 C ATOM 359 CZ TYR A 21 -0.980 -12.860 5.439 1.00 1.380 C ATOM 360 OH TYR A 21 -0.332 -14.060 5.258 1.00 1.380 O ATOM 361 H TYR A 21 -4.306 -9.268 8.390 1.00 1.210 H ATOM 362 HA TYR A 21 -1.635 -8.359 7.368 1.00 1.180 H ATOM 363 1HB TYR A 21 -4.065 -9.349 5.901 1.00 1.660 H ATOM 364 2HB TYR A 21 -2.756 -8.527 5.080 1.00 1.660 H ATOM 365 HD1 TYR A 21 -4.027 -11.639 6.262 1.00 1.660 H ATOM 366 HD2 TYR A 21 -0.421 -9.545 5.278 1.00 1.660 H ATOM 367 HE1 TYR A 21 -2.859 -13.781 5.936 1.00 1.660 H ATOM 368 HE2 TYR A 21 0.749 -11.695 4.976 1.00 1.660 H ATOM 369 HH TYR A 21 -0.943 -14.783 5.415 1.00 1.660 H ATOM 370 N THR A 22 -2.275 -6.155 6.398 1.00 0.820 N ATOM 371 CA THR A 22 -2.600 -4.795 6.012 1.00 0.940 C ATOM 372 C THR A 22 -2.529 -4.714 4.508 1.00 0.760 C ATOM 373 O THR A 22 -1.581 -5.209 3.910 1.00 0.920 O ATOM 374 CB THR A 22 -1.628 -3.768 6.639 1.00 1.270 C ATOM 375 OG1 THR A 22 -1.714 -3.835 8.065 1.00 1.270 O ATOM 376 CG2 THR A 22 -1.982 -2.355 6.187 1.00 1.270 C ATOM 377 H THR A 22 -1.371 -6.529 6.149 1.00 0.980 H ATOM 378 HA THR A 22 -3.617 -4.561 6.324 1.00 1.130 H ATOM 379 HB THR A 22 -0.608 -3.996 6.330 1.00 1.520 H ATOM 380 HG1 THR A 22 -1.366 -4.680 8.363 1.00 1.520 H ATOM 381 1HG2 THR A 22 -1.289 -1.647 6.638 1.00 1.520 H ATOM 382 2HG2 THR A 22 -1.909 -2.284 5.113 1.00 1.520 H ATOM 383 3HG2 THR A 22 -2.997 -2.117 6.498 1.00 1.520 H ATOM 384 N ARG A 23 -3.540 -4.128 3.893 1.00 0.780 N ATOM 385 CA ARG A 23 -3.519 -3.959 2.456 1.00 0.630 C ATOM 386 C ARG A 23 -3.861 -2.558 2.054 1.00 0.600 C ATOM 387 O ARG A 23 -4.582 -1.834 2.736 1.00 0.680 O ATOM 388 CB ARG A 23 -4.451 -4.914 1.728 1.00 0.940 C ATOM 389 CG ARG A 23 -4.038 -6.342 1.784 1.00 0.940 C ATOM 390 CD ARG A 23 -4.984 -7.248 1.098 1.00 0.940 C ATOM 391 NE ARG A 23 -4.622 -8.612 1.332 1.00 0.940 N ATOM 392 CZ ARG A 23 -3.851 -9.386 0.522 1.00 0.940 C ATOM 393 NH1 ARG A 23 -3.389 -8.929 -0.644 1.00 0.940 N ATOM 394 NH2 ARG A 23 -3.554 -10.621 0.901 1.00 0.940 N ATOM 395 H ARG A 23 -4.311 -3.762 4.436 1.00 0.940 H ATOM 396 HA ARG A 23 -2.512 -4.160 2.100 1.00 0.760 H ATOM 397 1HB ARG A 23 -5.450 -4.833 2.140 1.00 1.130 H ATOM 398 2HB ARG A 23 -4.505 -4.634 0.675 1.00 1.130 H ATOM 399 1HG ARG A 23 -3.092 -6.425 1.275 1.00 1.130 H ATOM 400 2HG ARG A 23 -3.919 -6.662 2.812 1.00 1.130 H ATOM 401 1HD ARG A 23 -5.972 -7.102 1.443 1.00 1.130 H ATOM 402 2HD ARG A 23 -4.978 -7.068 0.050 1.00 1.130 H ATOM 403 HE ARG A 23 -4.929 -8.984 2.243 1.00 1.130 H ATOM 404 1HH1 ARG A 23 -3.613 -7.971 -0.978 1.00 1.130 H ATOM 405 2HH1 ARG A 23 -2.819 -9.525 -1.224 1.00 1.130 H ATOM 406 1HH2 ARG A 23 -3.906 -10.973 1.783 1.00 1.130 H ATOM 407 2HH2 ARG A 23 -2.983 -11.212 0.315 1.00 1.130 H ATOM 408 N CYS A 24 -3.357 -2.246 0.902 1.00 0.520 N ATOM 409 CA CYS A 24 -3.534 -1.039 0.136 1.00 0.510 C ATOM 410 C CYS A 24 -4.990 -0.717 -0.196 1.00 0.580 C ATOM 411 O CYS A 24 -5.632 -1.409 -0.988 1.00 0.640 O ATOM 412 CB CYS A 24 -2.751 -1.257 -1.129 1.00 0.720 C ATOM 413 SG CYS A 24 -2.862 -0.056 -2.332 1.00 0.720 S ATOM 414 H CYS A 24 -2.740 -2.950 0.505 1.00 0.620 H ATOM 415 HA CYS A 24 -3.107 -0.214 0.703 1.00 0.610 H ATOM 416 1HB CYS A 24 -1.701 -1.374 -0.874 1.00 0.860 H ATOM 417 2HB CYS A 24 -3.067 -2.185 -1.558 1.00 0.860 H ATOM 418 N LEU A 25 -5.443 0.454 0.238 1.00 0.620 N ATOM 419 CA LEU A 25 -6.824 0.902 0.029 1.00 0.740 C ATOM 420 C LEU A 25 -7.258 1.004 -1.432 1.00 0.790 C ATOM 421 O LEU A 25 -8.427 0.777 -1.743 1.00 0.920 O ATOM 422 CB LEU A 25 -7.015 2.302 0.638 1.00 0.990 C ATOM 423 CG LEU A 25 -6.997 2.441 2.172 1.00 0.990 C ATOM 424 CD1 LEU A 25 -6.931 3.928 2.511 1.00 0.990 C ATOM 425 CD2 LEU A 25 -8.251 1.815 2.776 1.00 0.990 C ATOM 426 H LEU A 25 -4.829 0.978 0.869 1.00 0.740 H ATOM 427 HA LEU A 25 -7.479 0.188 0.519 1.00 0.890 H ATOM 428 1HB LEU A 25 -6.235 2.938 0.263 1.00 1.190 H ATOM 429 2HB LEU A 25 -7.966 2.694 0.285 1.00 1.190 H ATOM 430 HG LEU A 25 -6.128 1.950 2.583 1.00 1.190 H ATOM 431 1HD1 LEU A 25 -6.910 4.054 3.592 1.00 1.190 H ATOM 432 2HD1 LEU A 25 -6.021 4.360 2.085 1.00 1.190 H ATOM 433 3HD1 LEU A 25 -7.801 4.439 2.103 1.00 1.190 H ATOM 434 1HD2 LEU A 25 -8.225 1.937 3.858 1.00 1.190 H ATOM 435 2HD2 LEU A 25 -9.137 2.309 2.376 1.00 1.190 H ATOM 436 3HD2 LEU A 25 -8.292 0.756 2.541 1.00 1.190 H ATOM 437 N ARG A 26 -6.345 1.363 -2.331 1.00 0.730 N ATOM 438 CA ARG A 26 -6.732 1.544 -3.724 1.00 0.850 C ATOM 439 C ARG A 26 -6.299 0.409 -4.644 1.00 0.890 C ATOM 440 O ARG A 26 -6.845 0.246 -5.733 1.00 1.220 O ATOM 441 CB ARG A 26 -6.107 2.817 -4.287 1.00 1.140 C ATOM 442 CG ARG A 26 -6.844 4.144 -4.033 1.00 1.140 C ATOM 443 CD ARG A 26 -6.607 4.668 -2.671 1.00 1.140 C ATOM 444 NE ARG A 26 -7.137 6.017 -2.503 1.00 1.140 N ATOM 445 CZ ARG A 26 -6.984 6.792 -1.401 1.00 1.140 C ATOM 446 NH1 ARG A 26 -6.311 6.354 -0.357 1.00 1.140 N ATOM 447 NH2 ARG A 26 -7.510 8.003 -1.381 1.00 1.140 N ATOM 448 H ARG A 26 -5.395 1.550 -2.042 1.00 0.880 H ATOM 449 HA ARG A 26 -7.817 1.631 -3.771 1.00 1.020 H ATOM 450 1HB ARG A 26 -5.098 2.920 -3.881 1.00 1.370 H ATOM 451 2HB ARG A 26 -6.002 2.710 -5.366 1.00 1.370 H ATOM 452 1HG ARG A 26 -6.502 4.893 -4.748 1.00 1.370 H ATOM 453 2HG ARG A 26 -7.916 3.988 -4.154 1.00 1.370 H ATOM 454 1HD ARG A 26 -7.099 4.025 -1.948 1.00 1.370 H ATOM 455 2HD ARG A 26 -5.554 4.683 -2.488 1.00 1.370 H ATOM 456 HE ARG A 26 -7.661 6.406 -3.277 1.00 1.370 H ATOM 457 1HH1 ARG A 26 -5.904 5.432 -0.368 1.00 1.370 H ATOM 458 2HH1 ARG A 26 -6.186 6.939 0.460 1.00 1.370 H ATOM 459 1HH2 ARG A 26 -8.026 8.342 -2.182 1.00 1.370 H ATOM 460 2HH2 ARG A 26 -7.402 8.593 -0.569 1.00 1.370 H ATOM 461 N CYS A 27 -5.307 -0.350 -4.246 1.00 0.800 N ATOM 462 CA CYS A 27 -4.761 -1.354 -5.126 1.00 0.820 C ATOM 463 C CYS A 27 -4.925 -2.796 -4.631 1.00 0.740 C ATOM 464 O CYS A 27 -4.936 -3.726 -5.448 1.00 0.820 O ATOM 465 CB CYS A 27 -3.303 -1.032 -5.339 1.00 1.140 C ATOM 466 SG CYS A 27 -2.291 -1.306 -3.940 1.00 1.140 S ATOM 467 H CYS A 27 -4.905 -0.211 -3.334 1.00 0.960 H ATOM 468 HA CYS A 27 -5.263 -1.269 -6.086 1.00 0.980 H ATOM 469 1HB CYS A 27 -2.916 -1.616 -6.143 1.00 1.370 H ATOM 470 2HB CYS A 27 -3.203 0.016 -5.622 1.00 1.370 H ATOM 471 N GLY A 28 -5.097 -2.991 -3.317 1.00 0.650 N ATOM 472 CA GLY A 28 -5.237 -4.302 -2.689 1.00 0.660 C ATOM 473 C GLY A 28 -3.938 -5.072 -2.390 1.00 0.590 C ATOM 474 O GLY A 28 -3.990 -6.212 -1.916 1.00 0.670 O ATOM 475 H GLY A 28 -5.139 -2.201 -2.672 1.00 0.780 H ATOM 476 1HA GLY A 28 -5.763 -4.149 -1.745 1.00 0.790 H ATOM 477 2HA GLY A 28 -5.898 -4.903 -3.288 1.00 0.790 H ATOM 478 N ARG A 29 -2.792 -4.478 -2.675 1.00 0.530 N ATOM 479 CA ARG A 29 -1.503 -5.110 -2.448 1.00 0.530 C ATOM 480 C ARG A 29 -1.117 -5.046 -0.971 1.00 0.630 C ATOM 481 O ARG A 29 -1.356 -4.045 -0.294 1.00 0.710 O ATOM 482 CB ARG A 29 -0.421 -4.420 -3.260 1.00 0.740 C ATOM 483 CG ARG A 29 -0.610 -4.515 -4.762 1.00 0.740 C ATOM 484 CD ARG A 29 0.421 -3.751 -5.510 1.00 0.740 C ATOM 485 NE ARG A 29 1.739 -4.363 -5.423 1.00 0.740 N ATOM 486 CZ ARG A 29 2.882 -3.812 -5.885 1.00 0.740 C ATOM 487 NH1 ARG A 29 2.868 -2.629 -6.453 1.00 0.740 N ATOM 488 NH2 ARG A 29 4.021 -4.477 -5.768 1.00 0.740 N ATOM 489 H ARG A 29 -2.828 -3.549 -3.077 1.00 0.640 H ATOM 490 HA ARG A 29 -1.568 -6.154 -2.754 1.00 0.640 H ATOM 491 1HB ARG A 29 -0.376 -3.368 -2.988 1.00 0.890 H ATOM 492 2HB ARG A 29 0.548 -4.852 -3.017 1.00 0.890 H ATOM 493 1HG ARG A 29 -0.566 -5.556 -5.075 1.00 0.890 H ATOM 494 2HG ARG A 29 -1.581 -4.108 -5.011 1.00 0.890 H ATOM 495 1HD ARG A 29 0.145 -3.713 -6.547 1.00 0.890 H ATOM 496 2HD ARG A 29 0.477 -2.738 -5.106 1.00 0.890 H ATOM 497 HE ARG A 29 1.802 -5.278 -4.999 1.00 0.890 H ATOM 498 1HH1 ARG A 29 2.000 -2.126 -6.552 1.00 0.890 H ATOM 499 2HH1 ARG A 29 3.726 -2.222 -6.800 1.00 0.890 H ATOM 500 1HH2 ARG A 29 4.021 -5.392 -5.344 1.00 0.890 H ATOM 501 2HH2 ARG A 29 4.883 -4.079 -6.112 1.00 0.890 H ATOM 502 N ALA A 30 -0.545 -6.135 -0.444 1.00 0.670 N ATOM 503 CA ALA A 30 -0.081 -6.141 0.954 1.00 0.790 C ATOM 504 C ALA A 30 1.375 -5.682 1.088 1.00 0.780 C ATOM 505 O ALA A 30 1.869 -5.440 2.190 1.00 1.080 O ATOM 506 CB ALA A 30 -0.239 -7.527 1.561 1.00 1.060 C ATOM 507 H ALA A 30 -0.416 -6.958 -1.016 1.00 0.800 H ATOM 508 HA ALA A 30 -0.698 -5.447 1.517 1.00 0.950 H ATOM 509 1HB ALA A 30 0.072 -7.493 2.607 1.00 1.270 H ATOM 510 2HB ALA A 30 -1.275 -7.840 1.509 1.00 1.270 H ATOM 511 3HB ALA A 30 0.380 -8.235 1.020 1.00 1.270 H ATOM 512 N ARG A 31 2.075 -5.623 -0.032 1.00 0.630 N ATOM 513 CA ARG A 31 3.482 -5.277 -0.036 1.00 0.700 C ATOM 514 C ARG A 31 3.665 -3.779 -0.130 1.00 0.710 C ATOM 515 O ARG A 31 2.948 -3.105 -0.867 1.00 1.620 O ATOM 516 CB ARG A 31 4.194 -5.949 -1.200 1.00 0.950 C ATOM 517 CG ARG A 31 5.706 -5.713 -1.271 1.00 0.950 C ATOM 518 CD ARG A 31 6.332 -6.501 -2.350 1.00 0.950 C ATOM 519 NE ARG A 31 7.769 -6.267 -2.428 1.00 0.950 N ATOM 520 CZ ARG A 31 8.598 -6.810 -3.349 1.00 0.950 C ATOM 521 NH1 ARG A 31 8.128 -7.620 -4.278 1.00 0.950 N ATOM 522 NH2 ARG A 31 9.891 -6.525 -3.317 1.00 0.950 N ATOM 523 H ARG A 31 1.603 -5.815 -0.899 1.00 0.760 H ATOM 524 HA ARG A 31 3.929 -5.626 0.895 1.00 0.840 H ATOM 525 1HB ARG A 31 4.029 -7.024 -1.151 1.00 1.140 H ATOM 526 2HB ARG A 31 3.764 -5.593 -2.136 1.00 1.140 H ATOM 527 1HG ARG A 31 5.908 -4.666 -1.487 1.00 1.140 H ATOM 528 2HG ARG A 31 6.171 -5.990 -0.326 1.00 1.140 H ATOM 529 1HD ARG A 31 6.164 -7.562 -2.168 1.00 1.140 H ATOM 530 2HD ARG A 31 5.884 -6.214 -3.301 1.00 1.140 H ATOM 531 HE ARG A 31 8.179 -5.653 -1.736 1.00 1.140 H ATOM 532 1HH1 ARG A 31 7.145 -7.843 -4.308 1.00 1.140 H ATOM 533 2HH1 ARG A 31 8.752 -8.022 -4.963 1.00 1.140 H ATOM 534 1HH2 ARG A 31 10.256 -5.906 -2.607 1.00 1.140 H ATOM 535 2HH2 ARG A 31 10.517 -6.926 -4.001 1.00 1.140 H ATOM 536 N ALA A 32 4.655 -3.262 0.583 1.00 0.740 N ATOM 537 CA ALA A 32 5.025 -1.850 0.539 1.00 0.590 C ATOM 538 C ALA A 32 3.883 -0.906 0.871 1.00 0.460 C ATOM 539 O ALA A 32 3.736 0.118 0.200 1.00 0.460 O ATOM 540 CB ALA A 32 5.556 -1.497 -0.847 1.00 0.890 C ATOM 541 H ALA A 32 5.181 -3.884 1.180 1.00 0.890 H ATOM 542 HA ALA A 32 5.813 -1.692 1.275 1.00 0.710 H ATOM 543 1HB ALA A 32 5.865 -0.464 -0.858 1.00 1.060 H ATOM 544 2HB ALA A 32 6.405 -2.132 -1.083 1.00 1.060 H ATOM 545 3HB ALA A 32 4.782 -1.641 -1.596 1.00 1.060 H ATOM 546 N VAL A 33 3.092 -1.231 1.900 1.00 0.450 N ATOM 547 CA VAL A 33 1.985 -0.366 2.308 1.00 0.450 C ATOM 548 C VAL A 33 2.457 0.621 3.364 1.00 0.480 C ATOM 549 O VAL A 33 3.061 0.237 4.367 1.00 0.550 O ATOM 550 CB VAL A 33 0.766 -1.189 2.772 1.00 0.630 C ATOM 551 CG1 VAL A 33 -0.382 -0.242 3.224 1.00 0.630 C ATOM 552 CG2 VAL A 33 0.304 -2.079 1.610 1.00 0.630 C ATOM 553 H VAL A 33 3.290 -2.090 2.398 1.00 0.540 H ATOM 554 HA VAL A 33 1.656 0.217 1.479 1.00 0.540 H ATOM 555 HB VAL A 33 1.046 -1.813 3.619 1.00 0.760 H ATOM 556 1HG1 VAL A 33 -1.235 -0.828 3.533 1.00 0.760 H ATOM 557 2HG1 VAL A 33 -0.059 0.384 4.055 1.00 0.760 H ATOM 558 3HG1 VAL A 33 -0.677 0.392 2.393 1.00 0.760 H ATOM 559 1HG2 VAL A 33 -0.547 -2.677 1.924 1.00 0.760 H ATOM 560 2HG2 VAL A 33 0.022 -1.460 0.768 1.00 0.760 H ATOM 561 3HG2 VAL A 33 1.112 -2.741 1.308 1.00 0.760 H ATOM 562 N LEU A 34 2.184 1.897 3.115 1.00 0.460 N ATOM 563 CA LEU A 34 2.580 2.982 3.989 1.00 0.500 C ATOM 564 C LEU A 34 1.523 3.188 5.059 1.00 0.570 C ATOM 565 O LEU A 34 0.381 3.558 4.761 1.00 0.560 O ATOM 566 CB LEU A 34 2.717 4.267 3.155 1.00 0.680 C ATOM 567 CG LEU A 34 3.746 4.245 1.986 1.00 0.680 C ATOM 568 CD1 LEU A 34 3.574 5.522 1.146 1.00 0.680 C ATOM 569 CD2 LEU A 34 5.171 4.160 2.543 1.00 0.680 C ATOM 570 H LEU A 34 1.678 2.123 2.260 1.00 0.550 H ATOM 571 HA LEU A 34 3.521 2.726 4.472 1.00 0.600 H ATOM 572 1HB LEU A 34 1.743 4.480 2.712 1.00 0.820 H ATOM 573 2HB LEU A 34 2.983 5.085 3.819 1.00 0.820 H ATOM 574 HG LEU A 34 3.547 3.382 1.338 1.00 0.820 H ATOM 575 1HD1 LEU A 34 4.272 5.514 0.313 1.00 0.820 H ATOM 576 2HD1 LEU A 34 2.556 5.555 0.762 1.00 0.820 H ATOM 577 3HD1 LEU A 34 3.761 6.398 1.756 1.00 0.820 H ATOM 578 1HD2 LEU A 34 5.882 4.152 1.726 1.00 0.820 H ATOM 579 2HD2 LEU A 34 5.368 5.023 3.180 1.00 0.820 H ATOM 580 3HD2 LEU A 34 5.290 3.247 3.121 1.00 0.820 H ATOM 581 N SER A 35 1.923 3.017 6.318 1.00 0.660 N ATOM 582 CA SER A 35 1.027 3.109 7.476 1.00 0.740 C ATOM 583 C SER A 35 0.446 4.504 7.680 1.00 0.740 C ATOM 584 O SER A 35 -0.576 4.681 8.343 1.00 0.810 O ATOM 585 CB SER A 35 1.772 2.682 8.721 1.00 1.000 C ATOM 586 OG SER A 35 2.789 3.593 9.026 1.00 1.000 O ATOM 587 H SER A 35 2.883 2.742 6.489 1.00 0.790 H ATOM 588 HA SER A 35 0.198 2.418 7.315 1.00 0.890 H ATOM 589 1HB SER A 35 1.076 2.615 9.557 1.00 1.200 H ATOM 590 2HB SER A 35 2.199 1.692 8.568 1.00 1.200 H ATOM 591 HG SER A 35 3.221 3.254 9.818 1.00 1.200 H ATOM 592 N HIS A 36 1.086 5.486 7.064 1.00 0.690 N ATOM 593 CA HIS A 36 0.685 6.879 7.135 1.00 0.700 C ATOM 594 C HIS A 36 -0.473 7.199 6.200 1.00 0.670 C ATOM 595 O HIS A 36 -1.191 8.180 6.410 1.00 0.710 O ATOM 596 CB HIS A 36 1.856 7.777 6.730 1.00 0.980 C ATOM 597 CG HIS A 36 3.007 7.760 7.666 1.00 0.980 C ATOM 598 ND1 HIS A 36 2.960 8.320 8.926 1.00 0.980 N ATOM 599 CD2 HIS A 36 4.250 7.246 7.526 1.00 0.980 C ATOM 600 CE1 HIS A 36 4.128 8.151 9.521 1.00 0.980 C ATOM 601 NE2 HIS A 36 4.928 7.504 8.693 1.00 0.980 N ATOM 602 H HIS A 36 1.914 5.237 6.551 1.00 0.830 H ATOM 603 HA HIS A 36 0.382 7.123 8.152 1.00 0.840 H ATOM 604 1HB HIS A 36 2.220 7.457 5.761 1.00 1.170 H ATOM 605 2HB HIS A 36 1.508 8.805 6.622 1.00 1.170 H ATOM 606 HD2 HIS A 36 4.642 6.726 6.651 1.00 1.170 H ATOM 607 HE1 HIS A 36 4.389 8.489 10.524 1.00 1.170 H ATOM 608 HE2 HIS A 36 5.884 7.237 8.882 1.00 1.170 H ATOM 609 N PHE A 37 -0.624 6.417 5.124 1.00 0.610 N ATOM 610 CA PHE A 37 -1.635 6.742 4.132 1.00 0.600 C ATOM 611 C PHE A 37 -2.644 5.607 3.884 1.00 0.620 C ATOM 612 O PHE A 37 -3.729 5.840 3.350 1.00 0.670 O ATOM 613 CB PHE A 37 -0.925 7.134 2.842 1.00 0.840 C ATOM 614 CG PHE A 37 0.050 8.248 3.028 1.00 0.840 C ATOM 615 CD1 PHE A 37 1.401 7.969 3.003 1.00 0.840 C ATOM 616 CD2 PHE A 37 -0.352 9.551 3.251 1.00 0.840 C ATOM 617 CE1 PHE A 37 2.338 8.959 3.186 1.00 0.840 C ATOM 618 CE2 PHE A 37 0.586 10.551 3.439 1.00 0.840 C ATOM 619 CZ PHE A 37 1.930 10.252 3.404 1.00 0.840 C ATOM 620 H PHE A 37 -0.050 5.586 4.990 1.00 0.730 H ATOM 621 HA PHE A 37 -2.197 7.604 4.488 1.00 0.720 H ATOM 622 1HB PHE A 37 -0.374 6.279 2.469 1.00 1.010 H ATOM 623 2HB PHE A 37 -1.654 7.434 2.091 1.00 1.010 H ATOM 624 HD1 PHE A 37 1.717 6.952 2.832 1.00 1.010 H ATOM 625 HD2 PHE A 37 -1.417 9.787 3.282 1.00 1.010 H ATOM 626 HE1 PHE A 37 3.401 8.717 3.155 1.00 1.010 H ATOM 627 HE2 PHE A 37 0.261 11.580 3.615 1.00 1.010 H ATOM 628 HZ PHE A 37 2.667 11.039 3.549 1.00 1.010 H ATOM 629 N GLY A 38 -2.282 4.367 4.236 1.00 0.610 N ATOM 630 CA GLY A 38 -3.140 3.212 3.977 1.00 0.660 C ATOM 631 C GLY A 38 -2.991 2.666 2.560 1.00 0.580 C ATOM 632 O GLY A 38 -3.768 1.811 2.135 1.00 0.630 O ATOM 633 H GLY A 38 -1.378 4.195 4.672 1.00 0.730 H ATOM 634 1HA GLY A 38 -2.895 2.425 4.692 1.00 0.790 H ATOM 635 2HA GLY A 38 -4.178 3.487 4.153 1.00 0.790 H ATOM 636 N VAL A 39 -2.011 3.174 1.831 1.00 0.490 N ATOM 637 CA VAL A 39 -1.771 2.768 0.456 1.00 0.430 C ATOM 638 C VAL A 39 -0.337 2.340 0.208 1.00 0.360 C ATOM 639 O VAL A 39 0.576 2.700 0.949 1.00 0.430 O ATOM 640 CB VAL A 39 -2.143 3.909 -0.507 1.00 0.630 C ATOM 641 CG1 VAL A 39 -3.595 4.233 -0.394 1.00 0.630 C ATOM 642 CG2 VAL A 39 -1.331 5.117 -0.199 1.00 0.630 C ATOM 643 H VAL A 39 -1.426 3.871 2.268 1.00 0.590 H ATOM 644 HA VAL A 39 -2.413 1.924 0.228 1.00 0.520 H ATOM 645 HB VAL A 39 -1.954 3.604 -1.495 1.00 0.750 H ATOM 646 1HG1 VAL A 39 -3.820 5.028 -1.088 1.00 0.750 H ATOM 647 2HG1 VAL A 39 -4.167 3.347 -0.638 1.00 0.750 H ATOM 648 3HG1 VAL A 39 -3.830 4.559 0.619 1.00 0.750 H ATOM 649 1HG2 VAL A 39 -1.583 5.918 -0.890 1.00 0.750 H ATOM 650 2HG2 VAL A 39 -1.552 5.417 0.791 1.00 0.750 H ATOM 651 3HG2 VAL A 39 -0.290 4.875 -0.284 1.00 0.750 H ATOM 652 N CYS A 40 -0.154 1.603 -0.864 1.00 0.320 N ATOM 653 CA CYS A 40 1.136 1.116 -1.312 1.00 0.310 C ATOM 654 C CYS A 40 1.987 2.230 -1.883 1.00 0.260 C ATOM 655 O CYS A 40 1.460 3.236 -2.350 1.00 0.250 O ATOM 656 CB CYS A 40 0.944 0.041 -2.371 1.00 0.440 C ATOM 657 SG CYS A 40 0.371 0.657 -3.994 1.00 0.440 S ATOM 658 H CYS A 40 -0.967 1.366 -1.417 1.00 0.380 H ATOM 659 HA CYS A 40 1.651 0.681 -0.479 1.00 0.370 H ATOM 660 1HB CYS A 40 1.887 -0.487 -2.523 1.00 0.530 H ATOM 661 2HB CYS A 40 0.226 -0.692 -2.016 1.00 0.530 H ATOM 662 N ARG A 41 3.297 2.027 -1.942 1.00 0.300 N ATOM 663 CA ARG A 41 4.147 3.043 -2.544 1.00 0.340 C ATOM 664 C ARG A 41 3.790 3.341 -4.008 1.00 0.340 C ATOM 665 O ARG A 41 3.862 4.490 -4.440 1.00 0.350 O ATOM 666 CB ARG A 41 5.623 2.683 -2.430 1.00 0.460 C ATOM 667 CG ARG A 41 6.189 2.812 -1.010 1.00 0.460 C ATOM 668 CD ARG A 41 7.697 2.795 -0.977 1.00 0.460 C ATOM 669 NE ARG A 41 8.290 1.518 -1.392 1.00 0.460 N ATOM 670 CZ ARG A 41 8.572 0.472 -0.575 1.00 0.460 C ATOM 671 NH1 ARG A 41 8.316 0.532 0.719 1.00 0.460 N ATOM 672 NH2 ARG A 41 9.116 -0.621 -1.084 1.00 0.460 N ATOM 673 H ARG A 41 3.680 1.192 -1.482 1.00 0.360 H ATOM 674 HA ARG A 41 4.007 3.958 -1.971 1.00 0.410 H ATOM 675 1HB ARG A 41 5.773 1.654 -2.754 1.00 0.550 H ATOM 676 2HB ARG A 41 6.206 3.325 -3.085 1.00 0.550 H ATOM 677 1HG ARG A 41 5.858 3.759 -0.599 1.00 0.550 H ATOM 678 2HG ARG A 41 5.811 2.000 -0.387 1.00 0.550 H ATOM 679 1HD ARG A 41 8.064 3.567 -1.656 1.00 0.550 H ATOM 680 2HD ARG A 41 8.037 3.028 0.027 1.00 0.550 H ATOM 681 HE ARG A 41 8.516 1.412 -2.373 1.00 0.550 H ATOM 682 1HH1 ARG A 41 7.907 1.362 1.120 1.00 0.550 H ATOM 683 2HH1 ARG A 41 8.538 -0.253 1.314 1.00 0.550 H ATOM 684 1HH2 ARG A 41 9.319 -0.671 -2.074 1.00 0.550 H ATOM 685 2HH2 ARG A 41 9.335 -1.403 -0.486 1.00 0.550 H ATOM 686 N LEU A 42 3.430 2.325 -4.791 1.00 0.390 N ATOM 687 CA LEU A 42 3.107 2.572 -6.205 1.00 0.450 C ATOM 688 C LEU A 42 1.925 3.528 -6.391 1.00 0.410 C ATOM 689 O LEU A 42 2.006 4.529 -7.113 1.00 0.450 O ATOM 690 CB LEU A 42 2.785 1.232 -6.899 1.00 0.610 C ATOM 691 CG LEU A 42 2.301 1.273 -8.384 1.00 0.610 C ATOM 692 CD1 LEU A 42 3.393 1.854 -9.280 1.00 0.610 C ATOM 693 CD2 LEU A 42 1.905 -0.158 -8.817 1.00 0.610 C ATOM 694 H LEU A 42 3.418 1.392 -4.399 1.00 0.470 H ATOM 695 HA LEU A 42 3.979 3.020 -6.666 1.00 0.540 H ATOM 696 1HB LEU A 42 3.680 0.618 -6.867 1.00 0.730 H ATOM 697 2HB LEU A 42 2.020 0.728 -6.337 1.00 0.730 H ATOM 698 HG LEU A 42 1.424 1.921 -8.468 1.00 0.730 H ATOM 699 1HD1 LEU A 42 3.033 1.881 -10.309 1.00 0.730 H ATOM 700 2HD1 LEU A 42 3.633 2.869 -8.965 1.00 0.730 H ATOM 701 3HD1 LEU A 42 4.283 1.233 -9.222 1.00 0.730 H ATOM 702 1HD2 LEU A 42 1.546 -0.140 -9.849 1.00 0.730 H ATOM 703 2HD2 LEU A 42 2.767 -0.818 -8.749 1.00 0.730 H ATOM 704 3HD2 LEU A 42 1.109 -0.529 -8.167 1.00 0.730 H ATOM 705 N CYS A 43 0.835 3.198 -5.752 1.00 0.430 N ATOM 706 CA CYS A 43 -0.381 3.951 -5.800 1.00 0.440 C ATOM 707 C CYS A 43 -0.248 5.251 -5.024 1.00 0.370 C ATOM 708 O CYS A 43 -0.856 6.250 -5.405 1.00 0.460 O ATOM 709 CB CYS A 43 -1.477 3.032 -5.331 1.00 0.610 C ATOM 710 SG CYS A 43 -1.150 2.364 -3.754 1.00 0.610 S ATOM 711 H CYS A 43 0.863 2.371 -5.191 1.00 0.520 H ATOM 712 HA CYS A 43 -0.586 4.195 -6.843 1.00 0.530 H ATOM 713 1HB CYS A 43 -2.420 3.574 -5.285 1.00 0.730 H ATOM 714 2HB CYS A 43 -1.594 2.209 -6.034 1.00 0.730 H ATOM 715 N PHE A 44 0.599 5.271 -3.989 1.00 0.280 N ATOM 716 CA PHE A 44 0.865 6.487 -3.263 1.00 0.240 C ATOM 717 C PHE A 44 1.461 7.476 -4.218 1.00 0.270 C ATOM 718 O PHE A 44 1.030 8.622 -4.255 1.00 0.320 O ATOM 719 CB PHE A 44 1.802 6.301 -2.095 1.00 0.350 C ATOM 720 CG PHE A 44 2.108 7.584 -1.443 1.00 0.350 C ATOM 721 CD1 PHE A 44 1.161 8.238 -0.683 1.00 0.350 C ATOM 722 CD2 PHE A 44 3.356 8.149 -1.581 1.00 0.350 C ATOM 723 CE1 PHE A 44 1.464 9.424 -0.096 1.00 0.350 C ATOM 724 CE2 PHE A 44 3.652 9.336 -0.980 1.00 0.350 C ATOM 725 CZ PHE A 44 2.708 9.969 -0.241 1.00 0.350 C ATOM 726 H PHE A 44 1.048 4.415 -3.668 1.00 0.340 H ATOM 727 HA PHE A 44 -0.076 6.885 -2.891 1.00 0.290 H ATOM 728 1HB PHE A 44 1.395 5.625 -1.384 1.00 0.420 H ATOM 729 2HB PHE A 44 2.726 5.874 -2.450 1.00 0.420 H ATOM 730 HD1 PHE A 44 0.170 7.805 -0.557 1.00 0.420 H ATOM 731 HD2 PHE A 44 4.112 7.636 -2.178 1.00 0.420 H ATOM 732 HE1 PHE A 44 0.721 9.932 0.497 1.00 0.420 H ATOM 733 HE2 PHE A 44 4.640 9.774 -1.087 1.00 0.420 H ATOM 734 HZ PHE A 44 2.949 10.904 0.240 1.00 0.420 H ATOM 735 N ARG A 45 2.477 7.050 -4.984 1.00 0.310 N ATOM 736 CA ARG A 45 3.093 7.951 -5.935 1.00 0.430 C ATOM 737 C ARG A 45 2.075 8.501 -6.920 1.00 0.510 C ATOM 738 O ARG A 45 2.053 9.711 -7.145 1.00 0.570 O ATOM 739 CB ARG A 45 4.212 7.267 -6.716 1.00 0.550 C ATOM 740 CG ARG A 45 5.500 7.014 -5.942 1.00 0.550 C ATOM 741 CD ARG A 45 6.641 6.634 -6.837 1.00 0.550 C ATOM 742 NE ARG A 45 6.441 5.340 -7.513 1.00 0.550 N ATOM 743 CZ ARG A 45 6.777 4.125 -7.007 1.00 0.550 C ATOM 744 NH1 ARG A 45 7.311 4.020 -5.808 1.00 0.550 N ATOM 745 NH2 ARG A 45 6.573 3.036 -7.730 1.00 0.550 N ATOM 746 H ARG A 45 2.835 6.095 -4.876 1.00 0.370 H ATOM 747 HA ARG A 45 3.524 8.781 -5.381 1.00 0.520 H ATOM 748 1HB ARG A 45 3.858 6.298 -7.062 1.00 0.660 H ATOM 749 2HB ARG A 45 4.451 7.852 -7.591 1.00 0.660 H ATOM 750 1HG ARG A 45 5.776 7.923 -5.413 1.00 0.660 H ATOM 751 2HG ARG A 45 5.349 6.223 -5.226 1.00 0.660 H ATOM 752 1HD ARG A 45 6.748 7.399 -7.608 1.00 0.660 H ATOM 753 2HD ARG A 45 7.560 6.589 -6.261 1.00 0.660 H ATOM 754 HE ARG A 45 6.042 5.361 -8.443 1.00 0.660 H ATOM 755 1HH1 ARG A 45 7.472 4.843 -5.250 1.00 0.660 H ATOM 756 2HH1 ARG A 45 7.566 3.114 -5.445 1.00 0.660 H ATOM 757 1HH2 ARG A 45 6.166 3.112 -8.652 1.00 0.660 H ATOM 758 2HH2 ARG A 45 6.827 2.130 -7.366 1.00 0.660 H ATOM 759 N GLU A 46 1.179 7.662 -7.457 1.00 0.550 N ATOM 760 CA GLU A 46 0.198 8.203 -8.395 1.00 0.690 C ATOM 761 C GLU A 46 -0.702 9.249 -7.726 1.00 0.660 C ATOM 762 O GLU A 46 -0.969 10.312 -8.302 1.00 0.740 O ATOM 763 CB GLU A 46 -0.687 7.091 -8.968 1.00 0.910 C ATOM 764 CG GLU A 46 0.003 6.124 -9.927 1.00 0.910 C ATOM 765 CD GLU A 46 -0.935 5.037 -10.417 1.00 0.910 C ATOM 766 OE1 GLU A 46 -2.016 4.936 -9.882 1.00 0.910 O ATOM 767 OE2 GLU A 46 -0.577 4.324 -11.325 1.00 0.910 O ATOM 768 H GLU A 46 1.234 6.656 -7.258 1.00 0.660 H ATOM 769 HA GLU A 46 0.734 8.684 -9.213 1.00 0.830 H ATOM 770 1HB GLU A 46 -1.092 6.503 -8.143 1.00 1.090 H ATOM 771 2HB GLU A 46 -1.532 7.536 -9.492 1.00 1.090 H ATOM 772 1HG GLU A 46 0.386 6.679 -10.781 1.00 1.090 H ATOM 773 2HG GLU A 46 0.849 5.663 -9.413 1.00 1.090 H ATOM 774 N LEU A 47 -1.131 8.965 -6.494 1.00 0.570 N ATOM 775 CA LEU A 47 -1.978 9.879 -5.746 1.00 0.590 C ATOM 776 C LEU A 47 -1.219 11.168 -5.442 1.00 0.530 C ATOM 777 O LEU A 47 -1.764 12.277 -5.536 1.00 0.620 O ATOM 778 CB LEU A 47 -2.421 9.170 -4.447 1.00 0.820 C ATOM 779 CG LEU A 47 -3.424 7.974 -4.610 1.00 0.820 C ATOM 780 CD1 LEU A 47 -3.505 7.171 -3.300 1.00 0.820 C ATOM 781 CD2 LEU A 47 -4.815 8.508 -4.947 1.00 0.820 C ATOM 782 H LEU A 47 -0.895 8.053 -6.087 1.00 0.680 H ATOM 783 HA LEU A 47 -2.842 10.126 -6.353 1.00 0.710 H ATOM 784 1HB LEU A 47 -1.533 8.785 -3.952 1.00 0.980 H ATOM 785 2HB LEU A 47 -2.881 9.883 -3.798 1.00 0.980 H ATOM 786 HG LEU A 47 -3.081 7.317 -5.406 1.00 0.980 H ATOM 787 1HD1 LEU A 47 -4.188 6.350 -3.437 1.00 0.980 H ATOM 788 2HD1 LEU A 47 -2.519 6.780 -3.057 1.00 0.980 H ATOM 789 3HD1 LEU A 47 -3.855 7.796 -2.497 1.00 0.980 H ATOM 790 1HD2 LEU A 47 -5.502 7.670 -5.054 1.00 0.980 H ATOM 791 2HD2 LEU A 47 -5.158 9.157 -4.142 1.00 0.980 H ATOM 792 3HD2 LEU A 47 -4.790 9.067 -5.876 1.00 0.980 H ATOM 793 N ALA A 48 0.057 11.037 -5.089 1.00 0.430 N ATOM 794 CA ALA A 48 0.882 12.183 -4.784 1.00 0.440 C ATOM 795 C ALA A 48 1.051 13.082 -6.003 1.00 0.540 C ATOM 796 O ALA A 48 0.869 14.296 -5.903 1.00 0.610 O ATOM 797 CB ALA A 48 2.233 11.719 -4.297 1.00 0.610 C ATOM 798 H ALA A 48 0.448 10.103 -4.987 1.00 0.520 H ATOM 799 HA ALA A 48 0.395 12.756 -3.996 1.00 0.530 H ATOM 800 1HB ALA A 48 2.825 12.582 -4.058 1.00 0.730 H ATOM 801 2HB ALA A 48 2.104 11.088 -3.413 1.00 0.730 H ATOM 802 3HB ALA A 48 2.718 11.147 -5.080 1.00 0.730 H ATOM 803 N TYR A 49 1.281 12.489 -7.179 1.00 0.610 N ATOM 804 CA TYR A 49 1.480 13.275 -8.391 1.00 0.770 C ATOM 805 C TYR A 49 0.191 13.957 -8.808 1.00 0.820 C ATOM 806 O TYR A 49 0.205 15.063 -9.350 1.00 0.940 O ATOM 807 CB TYR A 49 2.020 12.415 -9.542 1.00 1.010 C ATOM 808 CG TYR A 49 3.494 12.009 -9.404 1.00 1.010 C ATOM 809 CD1 TYR A 49 3.852 10.670 -9.314 1.00 1.010 C ATOM 810 CD2 TYR A 49 4.483 12.984 -9.365 1.00 1.010 C ATOM 811 CE1 TYR A 49 5.177 10.312 -9.182 1.00 1.010 C ATOM 812 CE2 TYR A 49 5.809 12.619 -9.236 1.00 1.010 C ATOM 813 CZ TYR A 49 6.153 11.291 -9.141 1.00 1.010 C ATOM 814 OH TYR A 49 7.474 10.930 -9.012 1.00 1.010 O ATOM 815 H TYR A 49 1.413 11.473 -7.211 1.00 0.730 H ATOM 816 HA TYR A 49 2.205 14.056 -8.173 1.00 0.920 H ATOM 817 1HB TYR A 49 1.423 11.499 -9.605 1.00 1.220 H ATOM 818 2HB TYR A 49 1.898 12.948 -10.483 1.00 1.220 H ATOM 819 HD1 TYR A 49 3.087 9.899 -9.351 1.00 1.220 H ATOM 820 HD2 TYR A 49 4.217 14.038 -9.437 1.00 1.220 H ATOM 821 HE1 TYR A 49 5.456 9.265 -9.115 1.00 1.220 H ATOM 822 HE2 TYR A 49 6.584 13.385 -9.207 1.00 1.220 H ATOM 823 HH TYR A 49 8.027 11.714 -9.059 1.00 1.220 H ATOM 824 N ALA A 50 -0.934 13.329 -8.491 1.00 0.780 N ATOM 825 CA ALA A 50 -2.241 13.870 -8.802 1.00 0.880 C ATOM 826 C ALA A 50 -2.640 15.005 -7.855 1.00 0.840 C ATOM 827 O ALA A 50 -3.662 15.657 -8.072 1.00 0.970 O ATOM 828 CB ALA A 50 -3.285 12.768 -8.719 1.00 1.190 C ATOM 829 H ALA A 50 -0.871 12.383 -8.099 1.00 0.940 H ATOM 830 HA ALA A 50 -2.209 14.266 -9.816 1.00 1.060 H ATOM 831 1HB ALA A 50 -4.261 13.168 -8.981 1.00 1.430 H ATOM 832 2HB ALA A 50 -3.018 11.967 -9.408 1.00 1.430 H ATOM 833 3HB ALA A 50 -3.310 12.376 -7.706 1.00 1.430 H ATOM 834 N GLY A 51 -1.881 15.213 -6.768 1.00 0.720 N ATOM 835 CA GLY A 51 -2.222 16.222 -5.776 1.00 0.690 C ATOM 836 C GLY A 51 -3.286 15.726 -4.797 1.00 0.700 C ATOM 837 O GLY A 51 -3.861 16.514 -4.044 1.00 0.730 O ATOM 838 H GLY A 51 -1.005 14.701 -6.636 1.00 0.860 H ATOM 839 1HA GLY A 51 -1.318 16.493 -5.226 1.00 0.830 H ATOM 840 2HA GLY A 51 -2.572 17.121 -6.280 1.00 0.830 H ATOM 841 N ALA A 52 -3.585 14.424 -4.856 1.00 0.700 N ATOM 842 CA ALA A 52 -4.599 13.772 -4.038 1.00 0.760 C ATOM 843 C ALA A 52 -4.298 13.778 -2.542 1.00 0.720 C ATOM 844 O ALA A 52 -5.225 13.741 -1.732 1.00 0.840 O ATOM 845 CB ALA A 52 -4.785 12.337 -4.490 1.00 1.040 C ATOM 846 H ALA A 52 -3.036 13.834 -5.484 1.00 0.840 H ATOM 847 HA ALA A 52 -5.534 14.311 -4.193 1.00 0.910 H ATOM 848 1HB ALA A 52 -5.579 11.873 -3.908 1.00 1.250 H ATOM 849 2HB ALA A 52 -5.042 12.315 -5.547 1.00 1.250 H ATOM 850 3HB ALA A 52 -3.877 11.812 -4.330 1.00 1.250 H ATOM 851 N ILE A 53 -3.015 13.734 -2.162 1.00 0.600 N ATOM 852 CA ILE A 53 -2.669 13.631 -0.754 1.00 0.610 C ATOM 853 C ILE A 53 -2.141 14.966 -0.200 1.00 0.600 C ATOM 854 O ILE A 53 -1.064 15.411 -0.615 1.00 0.530 O ATOM 855 CB ILE A 53 -1.566 12.578 -0.547 1.00 0.850 C ATOM 856 CG1 ILE A 53 -1.939 11.220 -1.229 1.00 0.850 C ATOM 857 CG2 ILE A 53 -1.338 12.381 0.954 1.00 0.850 C ATOM 858 CD1 ILE A 53 -3.224 10.546 -0.773 1.00 0.850 C ATOM 859 H ILE A 53 -2.277 13.770 -2.851 1.00 0.720 H ATOM 860 HA ILE A 53 -3.539 13.298 -0.212 1.00 0.730 H ATOM 861 HB ILE A 53 -0.644 12.925 -1.011 1.00 1.020 H ATOM 862 1HG1 ILE A 53 -2.013 11.400 -2.294 1.00 1.020 H ATOM 863 2HG1 ILE A 53 -1.122 10.525 -1.063 1.00 1.020 H ATOM 864 1HG2 ILE A 53 -0.560 11.661 1.097 1.00 1.020 H ATOM 865 2HG2 ILE A 53 -1.045 13.320 1.418 1.00 1.020 H ATOM 866 3HG2 ILE A 53 -2.244 12.032 1.433 1.00 1.020 H ATOM 867 1HD1 ILE A 53 -3.350 9.634 -1.325 1.00 1.020 H ATOM 868 2HD1 ILE A 53 -3.178 10.309 0.284 1.00 1.020 H ATOM 869 3HD1 ILE A 53 -4.077 11.193 -0.963 1.00 1.020 H ATOM 870 N PRO A 54 -2.834 15.607 0.754 1.00 0.730 N ATOM 871 CA PRO A 54 -2.450 16.870 1.343 1.00 0.780 C ATOM 872 C PRO A 54 -1.069 16.774 1.952 1.00 0.720 C ATOM 873 O PRO A 54 -0.720 15.757 2.551 1.00 0.730 O ATOM 874 CB PRO A 54 -3.509 17.069 2.436 1.00 1.170 C ATOM 875 CG PRO A 54 -4.705 16.293 1.954 1.00 1.170 C ATOM 876 CD PRO A 54 -4.129 15.086 1.251 1.00 1.170 C ATOM 877 HA PRO A 54 -2.498 17.661 0.580 1.00 0.940 H ATOM 878 1HB PRO A 54 -3.123 16.706 3.401 1.00 1.400 H ATOM 879 2HB PRO A 54 -3.720 18.141 2.561 1.00 1.400 H ATOM 880 1HG PRO A 54 -5.348 16.019 2.806 1.00 1.400 H ATOM 881 2HG PRO A 54 -5.318 16.915 1.284 1.00 1.400 H ATOM 882 1HD PRO A 54 -3.980 14.243 1.943 1.00 1.400 H ATOM 883 2HD PRO A 54 -4.818 14.854 0.427 1.00 1.400 H ATOM 884 N GLY A 55 -0.290 17.835 1.808 1.00 0.730 N ATOM 885 CA GLY A 55 1.044 17.887 2.385 1.00 0.750 C ATOM 886 C GLY A 55 2.126 17.201 1.557 1.00 0.690 C ATOM 887 O GLY A 55 3.314 17.366 1.845 1.00 0.780 O ATOM 888 H GLY A 55 -0.634 18.634 1.295 1.00 0.880 H ATOM 889 1HA GLY A 55 1.321 18.930 2.539 1.00 0.900 H ATOM 890 2HA GLY A 55 1.015 17.429 3.373 1.00 0.900 H ATOM 891 N VAL A 56 1.755 16.428 0.537 1.00 0.630 N ATOM 892 CA VAL A 56 2.787 15.730 -0.200 1.00 0.690 C ATOM 893 C VAL A 56 3.247 16.542 -1.394 1.00 0.810 C ATOM 894 O VAL A 56 2.483 16.846 -2.306 1.00 1.230 O ATOM 895 CB VAL A 56 2.276 14.349 -0.631 1.00 0.940 C ATOM 896 CG1 VAL A 56 3.335 13.604 -1.436 1.00 0.940 C ATOM 897 CG2 VAL A 56 1.898 13.567 0.611 1.00 0.940 C ATOM 898 H VAL A 56 0.769 16.302 0.271 1.00 0.760 H ATOM 899 HA VAL A 56 3.640 15.578 0.459 1.00 0.830 H ATOM 900 HB VAL A 56 1.394 14.473 -1.264 1.00 1.130 H ATOM 901 1HG1 VAL A 56 2.940 12.639 -1.712 1.00 1.130 H ATOM 902 2HG1 VAL A 56 3.591 14.169 -2.335 1.00 1.130 H ATOM 903 3HG1 VAL A 56 4.228 13.468 -0.827 1.00 1.130 H ATOM 904 1HG2 VAL A 56 1.515 12.605 0.324 1.00 1.130 H ATOM 905 2HG2 VAL A 56 2.772 13.441 1.245 1.00 1.130 H ATOM 906 3HG2 VAL A 56 1.132 14.112 1.162 1.00 1.130 H ATOM 907 N LYS A 57 4.524 16.858 -1.400 1.00 0.780 N ATOM 908 CA LYS A 57 5.120 17.659 -2.447 1.00 0.950 C ATOM 909 C LYS A 57 6.293 16.919 -3.030 1.00 1.110 C ATOM 910 O LYS A 57 6.914 16.102 -2.353 1.00 1.240 O ATOM 911 CB LYS A 57 5.597 19.007 -1.892 1.00 1.260 C ATOM 912 CG LYS A 57 4.512 19.888 -1.240 1.00 1.260 C ATOM 913 CD LYS A 57 3.515 20.433 -2.263 1.00 1.260 C ATOM 914 CE LYS A 57 2.516 21.381 -1.613 1.00 1.260 C ATOM 915 NZ LYS A 57 1.509 21.892 -2.595 1.00 1.260 N ATOM 916 H LYS A 57 5.096 16.555 -0.622 1.00 0.940 H ATOM 917 HA LYS A 57 4.395 17.815 -3.244 1.00 1.140 H ATOM 918 1HB LYS A 57 6.366 18.829 -1.140 1.00 1.510 H ATOM 919 2HB LYS A 57 6.061 19.581 -2.695 1.00 1.510 H ATOM 920 1HG LYS A 57 3.970 19.301 -0.494 1.00 1.510 H ATOM 921 2HG LYS A 57 4.990 20.724 -0.733 1.00 1.510 H ATOM 922 1HD LYS A 57 4.048 20.957 -3.056 1.00 1.510 H ATOM 923 2HD LYS A 57 2.957 19.606 -2.703 1.00 1.510 H ATOM 924 1HE LYS A 57 1.996 20.852 -0.815 1.00 1.510 H ATOM 925 2HE LYS A 57 3.053 22.228 -1.186 1.00 1.510 H ATOM 926 1HZ LYS A 57 0.865 22.514 -2.125 1.00 1.510 H ATOM 927 2HZ LYS A 57 1.980 22.394 -3.335 1.00 1.510 H ATOM 928 3HZ LYS A 57 0.997 21.114 -2.990 1.00 1.510 H ATOM 929 N LYS A 58 6.605 17.199 -4.277 1.00 1.320 N ATOM 930 CA LYS A 58 7.774 16.612 -4.896 1.00 1.560 C ATOM 931 C LYS A 58 8.810 17.685 -5.124 1.00 1.600 C ATOM 932 O LYS A 58 8.473 18.868 -5.204 1.00 2.130 O ATOM 933 CB LYS A 58 7.395 15.920 -6.207 1.00 2.090 C ATOM 934 CG LYS A 58 6.340 14.807 -6.062 1.00 2.090 C ATOM 935 CD LYS A 58 6.883 13.645 -5.235 1.00 2.090 C ATOM 936 CE LYS A 58 5.929 12.495 -5.170 1.00 2.090 C ATOM 937 NZ LYS A 58 6.451 11.421 -4.284 1.00 2.090 N ATOM 938 H LYS A 58 6.044 17.861 -4.796 1.00 1.580 H ATOM 939 HA LYS A 58 8.219 15.887 -4.218 1.00 1.870 H ATOM 940 1HB LYS A 58 7.007 16.661 -6.907 1.00 2.510 H ATOM 941 2HB LYS A 58 8.287 15.488 -6.661 1.00 2.510 H ATOM 942 1HG LYS A 58 5.453 15.206 -5.565 1.00 2.510 H ATOM 943 2HG LYS A 58 6.049 14.452 -7.039 1.00 2.510 H ATOM 944 1HD LYS A 58 7.826 13.301 -5.658 1.00 2.510 H ATOM 945 2HD LYS A 58 7.056 13.968 -4.211 1.00 2.510 H ATOM 946 1HE LYS A 58 4.984 12.847 -4.785 1.00 2.510 H ATOM 947 2HE LYS A 58 5.774 12.088 -6.169 1.00 2.510 H ATOM 948 1HZ LYS A 58 5.791 10.662 -4.253 1.00 2.510 H ATOM 949 2HZ LYS A 58 7.334 11.085 -4.646 1.00 2.510 H ATOM 950 3HZ LYS A 58 6.588 11.788 -3.351 1.00 2.510 H ATOM 951 N ALA A 59 10.068 17.279 -5.205 1.00 1.780 N ATOM 952 CA ALA A 59 11.140 18.205 -5.521 1.00 2.080 C ATOM 953 C ALA A 59 10.935 18.774 -6.914 1.00 2.860 C ATOM 954 O ALA A 59 10.439 18.083 -7.807 1.00 3.420 O ATOM 955 CB ALA A 59 12.490 17.519 -5.436 1.00 2.790 C ATOM 956 H ALA A 59 10.277 16.298 -5.084 1.00 2.140 H ATOM 957 HA ALA A 59 11.106 19.030 -4.808 1.00 2.500 H ATOM 958 1HB ALA A 59 13.274 18.241 -5.672 1.00 3.350 H ATOM 959 2HB ALA A 59 12.642 17.129 -4.432 1.00 3.350 H ATOM 960 3HB ALA A 59 12.525 16.701 -6.154 1.00 3.350 H ATOM 961 N SER A 60 11.322 20.029 -7.096 1.00 3.510 N ATOM 962 CA SER A 60 11.266 20.690 -8.388 1.00 4.700 C ATOM 963 C SER A 60 12.449 20.292 -9.263 1.00 5.390 C ATOM 964 O SER A 60 13.407 19.688 -8.772 1.00 5.850 O ATOM 965 CB SER A 60 11.223 22.192 -8.191 1.00 6.100 C ATOM 966 OG SER A 60 12.413 22.657 -7.618 1.00 6.100 O ATOM 967 H SER A 60 11.692 20.554 -6.316 1.00 4.210 H ATOM 968 HA SER A 60 10.350 20.378 -8.894 1.00 5.640 H ATOM 969 1HB SER A 60 11.067 22.680 -9.150 1.00 7.320 H ATOM 970 2HB SER A 60 10.382 22.450 -7.550 1.00 7.320 H ATOM 971 HG SER A 60 12.324 23.614 -7.560 1.00 7.320 H ATOM 972 N TRP A 61 12.363 20.664 -10.549 1.00 5.840 N ATOM 973 CA TRP A 61 13.367 20.456 -11.606 1.00 6.850 C ATOM 974 C TRP A 61 13.187 19.100 -12.276 1.00 7.140 C ATOM 975 O TRP A 61 14.127 18.557 -12.857 1.00 7.680 O ATOM 976 OXT TRP A 61 12.081 18.563 -12.269 1.00 10.270 O ATOM 977 CB TRP A 61 14.818 20.591 -11.110 1.00 8.640 C ATOM 978 CG TRP A 61 15.168 21.964 -10.629 1.00 8.640 C ATOM 979 CD1 TRP A 61 15.229 22.387 -9.339 1.00 8.640 C ATOM 980 CD2 TRP A 61 15.507 23.108 -11.441 1.00 8.640 C ATOM 981 NE1 TRP A 61 15.582 23.710 -9.292 1.00 8.640 N ATOM 982 CE2 TRP A 61 15.755 24.167 -10.567 1.00 8.640 C ATOM 983 CE3 TRP A 61 15.617 23.316 -12.820 1.00 8.640 C ATOM 984 CZ2 TRP A 61 16.110 25.423 -11.022 1.00 8.640 C ATOM 985 CZ3 TRP A 61 15.972 24.575 -13.277 1.00 8.640 C ATOM 986 CH2 TRP A 61 16.212 25.602 -12.400 1.00 8.640 C ATOM 987 H TRP A 61 11.517 21.141 -10.819 1.00 7.010 H ATOM 988 HA TRP A 61 13.218 21.224 -12.364 1.00 8.220 H ATOM 989 1HB TRP A 61 15.062 19.863 -10.353 1.00 10.370 H ATOM 990 2HB TRP A 61 15.481 20.378 -11.945 1.00 10.370 H ATOM 991 HD1 TRP A 61 15.024 21.760 -8.469 1.00 10.370 H ATOM 992 HE1 TRP A 61 15.693 24.253 -8.449 1.00 10.370 H ATOM 993 HE3 TRP A 61 15.428 22.504 -13.520 1.00 10.370 H ATOM 994 HZ2 TRP A 61 16.305 26.251 -10.341 1.00 10.370 H ATOM 995 HZ3 TRP A 61 16.057 24.730 -14.351 1.00 10.370 H ATOM 996 HH2 TRP A 61 16.490 26.580 -12.792 1.00 10.370 H TER 997 ENDMDL REMARK ID 14032 MODEL 4 SSGCID - MygeA.18852.a 30S ribosomal protein S14 type Z MG_164 PFRMAT TS TARGET SSGCID - MygeA.18852.a 30S ribosomal protein S14 type Z MG_164 AUTHOR BAKER-ROSETTASERVER METHOD ROSETTA provides both ab initio and METHOD comparative models of protein domains. METHOD Comparative models are built from structures METHOD detected and aligned by HHSEARCH, SPARKS, and METHOD Raptor. Loop regions are assembled from fragments and METHOD optimized to fit the aligned template structures. METHOD De novo models are built using the Rosetta de METHOD novo protocol. The procedure is fully automated. MODEL 4 PARENT 3j9mAK_305 REMARK PARENT 3j9mAK_305 REMARK PARSRC alignment REMARK SCORE 0.81 ATOM 1 N MET A 1 -5.026 -4.232 -8.515 1.00 6.820 N ATOM 2 CA MET A 1 -3.917 -5.112 -8.848 1.00 6.230 C ATOM 3 C MET A 1 -4.246 -6.562 -8.459 1.00 5.020 C ATOM 4 O MET A 1 -3.331 -7.369 -8.292 1.00 4.640 O ATOM 5 CB MET A 1 -2.652 -4.710 -8.075 1.00 8.960 C ATOM 6 CG MET A 1 -2.054 -3.294 -8.340 1.00 8.960 C ATOM 7 SD MET A 1 -0.549 -3.010 -7.326 1.00 8.960 S ATOM 8 CE MET A 1 -0.333 -1.232 -7.308 1.00 8.960 C ATOM 9 1H MET A 1 -4.779 -3.272 -8.701 1.00 8.180 H ATOM 10 2H MET A 1 -5.856 -4.477 -9.034 1.00 8.180 H ATOM 11 3H MET A 1 -5.213 -4.349 -7.529 1.00 8.180 H ATOM 12 HA MET A 1 -3.739 -5.074 -9.921 1.00 7.480 H ATOM 13 1HB MET A 1 -2.859 -4.811 -7.022 1.00 10.750 H ATOM 14 2HB MET A 1 -1.866 -5.425 -8.305 1.00 10.750 H ATOM 15 1HG MET A 1 -1.785 -3.197 -9.392 1.00 10.750 H ATOM 16 2HG MET A 1 -2.782 -2.521 -8.096 1.00 10.750 H ATOM 17 1HE MET A 1 0.536 -0.979 -6.704 1.00 10.750 H ATOM 18 2HE MET A 1 -0.187 -0.864 -8.325 1.00 10.750 H ATOM 19 3HE MET A 1 -1.216 -0.762 -6.874 1.00 10.750 H ATOM 20 N ALA A 2 -5.534 -6.887 -8.280 1.00 4.670 N ATOM 21 CA ALA A 2 -5.936 -8.239 -7.872 1.00 3.750 C ATOM 22 C ALA A 2 -7.389 -8.522 -8.249 1.00 2.870 C ATOM 23 O ALA A 2 -8.147 -7.609 -8.579 1.00 3.140 O ATOM 24 CB ALA A 2 -5.763 -8.420 -6.381 1.00 5.620 C ATOM 25 H ALA A 2 -6.264 -6.213 -8.426 1.00 5.600 H ATOM 26 HA ALA A 2 -5.301 -8.953 -8.394 1.00 4.500 H ATOM 27 1HB ALA A 2 -6.039 -9.425 -6.088 1.00 6.740 H ATOM 28 2HB ALA A 2 -4.724 -8.236 -6.104 1.00 6.740 H ATOM 29 3HB ALA A 2 -6.401 -7.727 -5.894 1.00 6.740 H ATOM 30 N LYS A 3 -7.755 -9.803 -8.243 1.00 2.190 N ATOM 31 CA LYS A 3 -9.124 -10.249 -8.520 1.00 1.840 C ATOM 32 C LYS A 3 -10.154 -9.833 -7.444 1.00 1.500 C ATOM 33 O LYS A 3 -9.912 -9.929 -6.229 1.00 1.350 O ATOM 34 CB LYS A 3 -9.137 -11.766 -8.688 1.00 2.720 C ATOM 35 CG LYS A 3 -8.410 -12.268 -9.928 1.00 2.720 C ATOM 36 CD LYS A 3 -8.481 -13.793 -10.034 1.00 2.720 C ATOM 37 CE LYS A 3 -7.744 -14.306 -11.272 1.00 2.720 C ATOM 38 NZ LYS A 3 -7.794 -15.795 -11.376 1.00 2.720 N ATOM 39 H LYS A 3 -7.059 -10.493 -8.004 1.00 2.630 H ATOM 40 HA LYS A 3 -9.436 -9.797 -9.461 1.00 2.210 H ATOM 41 1HB LYS A 3 -8.669 -12.223 -7.836 1.00 3.260 H ATOM 42 2HB LYS A 3 -10.168 -12.121 -8.725 1.00 3.260 H ATOM 43 1HG LYS A 3 -8.862 -11.826 -10.816 1.00 3.260 H ATOM 44 2HG LYS A 3 -7.366 -11.961 -9.885 1.00 3.260 H ATOM 45 1HD LYS A 3 -8.033 -14.239 -9.143 1.00 3.260 H ATOM 46 2HD LYS A 3 -9.523 -14.107 -10.089 1.00 3.260 H ATOM 47 1HE LYS A 3 -8.200 -13.875 -12.162 1.00 3.260 H ATOM 48 2HE LYS A 3 -6.701 -13.992 -11.221 1.00 3.260 H ATOM 49 1HZ LYS A 3 -7.296 -16.092 -12.205 1.00 3.260 H ATOM 50 2HZ LYS A 3 -7.362 -16.207 -10.560 1.00 3.260 H ATOM 51 3HZ LYS A 3 -8.756 -16.099 -11.436 1.00 3.260 H ATOM 52 N LYS A 4 -11.348 -9.434 -7.901 1.00 1.440 N ATOM 53 CA LYS A 4 -12.443 -9.044 -6.996 1.00 1.210 C ATOM 54 C LYS A 4 -12.828 -10.128 -6.001 1.00 1.070 C ATOM 55 O LYS A 4 -13.157 -9.831 -4.852 1.00 0.930 O ATOM 56 CB LYS A 4 -13.690 -8.635 -7.780 1.00 1.790 C ATOM 57 CG LYS A 4 -14.855 -8.172 -6.887 1.00 1.790 C ATOM 58 CD LYS A 4 -16.043 -7.692 -7.705 1.00 1.790 C ATOM 59 CE LYS A 4 -17.199 -7.283 -6.799 1.00 1.790 C ATOM 60 NZ LYS A 4 -18.379 -6.808 -7.579 1.00 1.790 N ATOM 61 H LYS A 4 -11.487 -9.371 -8.901 1.00 1.730 H ATOM 62 HA LYS A 4 -12.107 -8.180 -6.421 1.00 1.450 H ATOM 63 1HB LYS A 4 -13.442 -7.824 -8.463 1.00 2.140 H ATOM 64 2HB LYS A 4 -14.039 -9.477 -8.376 1.00 2.140 H ATOM 65 1HG LYS A 4 -15.193 -8.998 -6.260 1.00 2.140 H ATOM 66 2HG LYS A 4 -14.514 -7.367 -6.235 1.00 2.140 H ATOM 67 1HD LYS A 4 -15.746 -6.837 -8.314 1.00 2.140 H ATOM 68 2HD LYS A 4 -16.375 -8.491 -8.366 1.00 2.140 H ATOM 69 1HE LYS A 4 -17.497 -8.139 -6.193 1.00 2.140 H ATOM 70 2HE LYS A 4 -16.868 -6.482 -6.138 1.00 2.140 H ATOM 71 1HZ LYS A 4 -19.121 -6.547 -6.944 1.00 2.140 H ATOM 72 2HZ LYS A 4 -18.117 -6.006 -8.135 1.00 2.140 H ATOM 73 3HZ LYS A 4 -18.703 -7.547 -8.187 1.00 2.140 H ATOM 74 N SER A 5 -12.841 -11.379 -6.453 1.00 1.210 N ATOM 75 CA SER A 5 -13.231 -12.478 -5.591 1.00 1.230 C ATOM 76 C SER A 5 -12.275 -12.667 -4.419 1.00 1.140 C ATOM 77 O SER A 5 -12.675 -13.199 -3.381 1.00 1.100 O ATOM 78 CB SER A 5 -13.319 -13.757 -6.403 1.00 1.710 C ATOM 79 OG SER A 5 -12.059 -14.148 -6.877 1.00 1.710 O ATOM 80 H SER A 5 -12.574 -11.574 -7.407 1.00 1.450 H ATOM 81 HA SER A 5 -14.220 -12.257 -5.192 1.00 1.480 H ATOM 82 1HB SER A 5 -13.739 -14.550 -5.783 1.00 2.060 H ATOM 83 2HB SER A 5 -13.995 -13.605 -7.242 1.00 2.060 H ATOM 84 HG SER A 5 -12.206 -14.946 -7.394 1.00 2.060 H ATOM 85 N LEU A 6 -11.023 -12.210 -4.549 1.00 1.200 N ATOM 86 CA LEU A 6 -10.065 -12.373 -3.474 1.00 1.140 C ATOM 87 C LEU A 6 -10.374 -11.338 -2.437 1.00 0.870 C ATOM 88 O LEU A 6 -10.373 -11.623 -1.240 1.00 0.770 O ATOM 89 CB LEU A 6 -8.640 -12.155 -3.985 1.00 1.620 C ATOM 90 CG LEU A 6 -8.099 -13.172 -4.995 1.00 1.620 C ATOM 91 CD1 LEU A 6 -6.782 -12.636 -5.548 1.00 1.620 C ATOM 92 CD2 LEU A 6 -7.887 -14.534 -4.325 1.00 1.620 C ATOM 93 H LEU A 6 -10.725 -11.721 -5.392 1.00 1.440 H ATOM 94 HA LEU A 6 -10.177 -13.357 -3.029 1.00 1.370 H ATOM 95 1HB LEU A 6 -8.592 -11.173 -4.453 1.00 1.940 H ATOM 96 2HB LEU A 6 -7.967 -12.148 -3.128 1.00 1.940 H ATOM 97 HG LEU A 6 -8.805 -13.286 -5.811 1.00 1.940 H ATOM 98 1HD1 LEU A 6 -6.382 -13.333 -6.282 1.00 1.940 H ATOM 99 2HD1 LEU A 6 -6.962 -11.675 -6.021 1.00 1.940 H ATOM 100 3HD1 LEU A 6 -6.067 -12.510 -4.737 1.00 1.940 H ATOM 101 1HD2 LEU A 6 -7.493 -15.237 -5.059 1.00 1.940 H ATOM 102 2HD2 LEU A 6 -7.175 -14.432 -3.504 1.00 1.940 H ATOM 103 3HD2 LEU A 6 -8.827 -14.916 -3.940 1.00 1.940 H ATOM 104 N LYS A 7 -10.685 -10.129 -2.905 1.00 0.840 N ATOM 105 CA LYS A 7 -11.009 -9.046 -1.991 1.00 0.740 C ATOM 106 C LYS A 7 -12.235 -9.438 -1.167 1.00 0.620 C ATOM 107 O LYS A 7 -12.305 -9.179 0.043 1.00 0.650 O ATOM 108 CB LYS A 7 -11.283 -7.760 -2.769 1.00 1.080 C ATOM 109 CG LYS A 7 -10.058 -7.138 -3.444 1.00 1.080 C ATOM 110 CD LYS A 7 -10.457 -5.889 -4.227 1.00 1.080 C ATOM 111 CE LYS A 7 -9.272 -5.257 -4.950 1.00 1.080 C ATOM 112 NZ LYS A 7 -9.684 -4.067 -5.751 1.00 1.080 N ATOM 113 H LYS A 7 -10.627 -9.971 -3.918 1.00 1.010 H ATOM 114 HA LYS A 7 -10.173 -8.892 -1.312 1.00 0.890 H ATOM 115 1HB LYS A 7 -12.022 -7.958 -3.543 1.00 1.290 H ATOM 116 2HB LYS A 7 -11.710 -7.017 -2.096 1.00 1.290 H ATOM 117 1HG LYS A 7 -9.316 -6.879 -2.691 1.00 1.290 H ATOM 118 2HG LYS A 7 -9.616 -7.866 -4.132 1.00 1.290 H ATOM 119 1HD LYS A 7 -11.215 -6.155 -4.965 1.00 1.290 H ATOM 120 2HD LYS A 7 -10.883 -5.156 -3.541 1.00 1.290 H ATOM 121 1HE LYS A 7 -8.532 -4.943 -4.216 1.00 1.290 H ATOM 122 2HE LYS A 7 -8.819 -5.997 -5.618 1.00 1.290 H ATOM 123 1HZ LYS A 7 -8.874 -3.676 -6.212 1.00 1.290 H ATOM 124 2HZ LYS A 7 -10.363 -4.344 -6.447 1.00 1.290 H ATOM 125 3HZ LYS A 7 -10.090 -3.370 -5.143 1.00 1.290 H ATOM 126 N VAL A 8 -13.203 -10.074 -1.833 1.00 0.660 N ATOM 127 CA VAL A 8 -14.415 -10.496 -1.161 1.00 0.770 C ATOM 128 C VAL A 8 -14.127 -11.585 -0.140 1.00 0.790 C ATOM 129 O VAL A 8 -14.584 -11.483 0.995 1.00 0.890 O ATOM 130 CB VAL A 8 -15.474 -10.972 -2.177 1.00 1.030 C ATOM 131 CG1 VAL A 8 -16.672 -11.595 -1.454 1.00 1.030 C ATOM 132 CG2 VAL A 8 -15.946 -9.776 -3.007 1.00 1.030 C ATOM 133 H VAL A 8 -13.085 -10.226 -2.841 1.00 0.790 H ATOM 134 HA VAL A 8 -14.826 -9.635 -0.635 1.00 0.920 H ATOM 135 HB VAL A 8 -15.035 -11.727 -2.826 1.00 1.240 H ATOM 136 1HG1 VAL A 8 -17.408 -11.920 -2.186 1.00 1.240 H ATOM 137 2HG1 VAL A 8 -16.361 -12.455 -0.864 1.00 1.240 H ATOM 138 3HG1 VAL A 8 -17.112 -10.849 -0.802 1.00 1.240 H ATOM 139 1HG2 VAL A 8 -16.686 -10.103 -3.736 1.00 1.240 H ATOM 140 2HG2 VAL A 8 -16.389 -9.032 -2.347 1.00 1.240 H ATOM 141 3HG2 VAL A 8 -15.108 -9.333 -3.524 1.00 1.240 H ATOM 142 N LYS A 9 -13.372 -12.621 -0.517 1.00 0.820 N ATOM 143 CA LYS A 9 -13.073 -13.682 0.439 1.00 0.940 C ATOM 144 C LYS A 9 -12.298 -13.151 1.638 1.00 0.820 C ATOM 145 O LYS A 9 -12.585 -13.510 2.778 1.00 0.950 O ATOM 146 CB LYS A 9 -12.291 -14.810 -0.234 1.00 1.270 C ATOM 147 CG LYS A 9 -13.110 -15.664 -1.206 1.00 1.270 C ATOM 148 CD LYS A 9 -12.243 -16.728 -1.884 1.00 1.270 C ATOM 149 CE LYS A 9 -13.052 -17.573 -2.860 1.00 1.270 C ATOM 150 NZ LYS A 9 -12.202 -18.584 -3.554 1.00 1.270 N ATOM 151 H LYS A 9 -13.019 -12.684 -1.476 1.00 0.980 H ATOM 152 HA LYS A 9 -14.016 -14.087 0.805 1.00 1.130 H ATOM 153 1HB LYS A 9 -11.460 -14.375 -0.798 1.00 1.520 H ATOM 154 2HB LYS A 9 -11.866 -15.464 0.525 1.00 1.520 H ATOM 155 1HG LYS A 9 -13.913 -16.156 -0.657 1.00 1.520 H ATOM 156 2HG LYS A 9 -13.560 -15.027 -1.962 1.00 1.520 H ATOM 157 1HD LYS A 9 -11.438 -16.231 -2.433 1.00 1.520 H ATOM 158 2HD LYS A 9 -11.801 -17.376 -1.129 1.00 1.520 H ATOM 159 1HE LYS A 9 -13.841 -18.088 -2.315 1.00 1.520 H ATOM 160 2HE LYS A 9 -13.505 -16.919 -3.606 1.00 1.520 H ATOM 161 1HZ LYS A 9 -12.771 -19.124 -4.192 1.00 1.520 H ATOM 162 2HZ LYS A 9 -11.474 -18.110 -4.072 1.00 1.520 H ATOM 163 3HZ LYS A 9 -11.784 -19.202 -2.873 1.00 1.520 H ATOM 164 N GLN A 10 -11.337 -12.263 1.392 1.00 0.670 N ATOM 165 CA GLN A 10 -10.515 -11.681 2.441 1.00 0.690 C ATOM 166 C GLN A 10 -11.354 -10.850 3.395 1.00 0.790 C ATOM 167 O GLN A 10 -11.032 -10.739 4.578 1.00 1.030 O ATOM 168 CB GLN A 10 -9.415 -10.813 1.855 1.00 0.960 C ATOM 169 CG GLN A 10 -8.319 -10.421 2.850 1.00 0.960 C ATOM 170 CD GLN A 10 -8.642 -9.229 3.716 1.00 0.960 C ATOM 171 OE1 GLN A 10 -9.446 -8.334 3.378 1.00 0.960 O ATOM 172 NE2 GLN A 10 -7.977 -9.199 4.860 1.00 0.960 N ATOM 173 H GLN A 10 -11.130 -12.008 0.422 1.00 0.800 H ATOM 174 HA GLN A 10 -10.059 -12.491 3.008 1.00 0.830 H ATOM 175 1HB GLN A 10 -8.957 -11.330 1.023 1.00 1.150 H ATOM 176 2HB GLN A 10 -9.867 -9.910 1.455 1.00 1.150 H ATOM 177 1HG GLN A 10 -8.136 -11.269 3.516 1.00 1.150 H ATOM 178 2HG GLN A 10 -7.413 -10.201 2.308 1.00 1.150 H ATOM 179 1HE2 GLN A 10 -8.118 -8.457 5.513 1.00 1.150 H ATOM 180 2HE2 GLN A 10 -7.316 -9.960 5.080 1.00 1.150 H ATOM 181 N SER A 11 -12.418 -10.241 2.878 1.00 0.790 N ATOM 182 CA SER A 11 -13.295 -9.390 3.651 1.00 1.050 C ATOM 183 C SER A 11 -14.408 -10.174 4.356 1.00 1.220 C ATOM 184 O SER A 11 -15.250 -9.578 5.032 1.00 1.520 O ATOM 185 CB SER A 11 -13.923 -8.362 2.726 1.00 1.370 C ATOM 186 OG SER A 11 -12.940 -7.547 2.130 1.00 1.370 O ATOM 187 H SER A 11 -12.607 -10.301 1.875 1.00 0.950 H ATOM 188 HA SER A 11 -12.695 -8.877 4.401 1.00 1.260 H ATOM 189 1HB SER A 11 -14.495 -8.874 1.950 1.00 1.640 H ATOM 190 2HB SER A 11 -14.615 -7.746 3.294 1.00 1.640 H ATOM 191 HG SER A 11 -12.571 -8.105 1.408 1.00 1.640 H ATOM 192 N ARG A 12 -14.469 -11.499 4.156 1.00 1.180 N ATOM 193 CA ARG A 12 -15.497 -12.336 4.761 1.00 1.420 C ATOM 194 C ARG A 12 -15.014 -13.619 5.499 1.00 1.720 C ATOM 195 O ARG A 12 -15.751 -14.606 5.479 1.00 2.310 O ATOM 196 CB ARG A 12 -16.496 -12.762 3.693 1.00 1.890 C ATOM 197 CG ARG A 12 -17.270 -11.641 3.032 1.00 1.890 C ATOM 198 CD ARG A 12 -18.206 -12.163 2.019 1.00 1.890 C ATOM 199 NE ARG A 12 -18.935 -11.090 1.358 1.00 1.890 N ATOM 200 CZ ARG A 12 -19.847 -11.255 0.376 1.00 1.890 C ATOM 201 NH1 ARG A 12 -20.143 -12.461 -0.068 1.00 1.890 N ATOM 202 NH2 ARG A 12 -20.441 -10.194 -0.146 1.00 1.890 N ATOM 203 H ARG A 12 -13.756 -11.960 3.582 1.00 1.420 H ATOM 204 HA ARG A 12 -16.029 -11.722 5.487 1.00 1.700 H ATOM 205 1HB ARG A 12 -15.958 -13.288 2.900 1.00 2.270 H ATOM 206 2HB ARG A 12 -17.222 -13.453 4.114 1.00 2.270 H ATOM 207 1HG ARG A 12 -17.832 -11.091 3.784 1.00 2.270 H ATOM 208 2HG ARG A 12 -16.580 -10.965 2.530 1.00 2.270 H ATOM 209 1HD ARG A 12 -17.641 -12.715 1.269 1.00 2.270 H ATOM 210 2HD ARG A 12 -18.924 -12.825 2.501 1.00 2.270 H ATOM 211 HE ARG A 12 -18.740 -10.145 1.666 1.00 2.270 H ATOM 212 1HH1 ARG A 12 -19.692 -13.273 0.324 1.00 2.270 H ATOM 213 2HH1 ARG A 12 -20.826 -12.575 -0.806 1.00 2.270 H ATOM 214 1HH2 ARG A 12 -20.215 -9.268 0.193 1.00 2.270 H ATOM 215 2HH2 ARG A 12 -21.124 -10.305 -0.882 1.00 2.270 H ATOM 216 N PRO A 13 -13.813 -13.676 6.128 1.00 2.160 N ATOM 217 CA PRO A 13 -13.272 -14.819 6.833 1.00 2.740 C ATOM 218 C PRO A 13 -13.901 -14.994 8.191 1.00 2.260 C ATOM 219 O PRO A 13 -14.442 -14.047 8.763 1.00 2.360 O ATOM 220 CB PRO A 13 -11.803 -14.450 7.021 1.00 4.110 C ATOM 221 CG PRO A 13 -11.843 -12.975 7.152 1.00 4.110 C ATOM 222 CD PRO A 13 -12.928 -12.541 6.201 1.00 4.110 C ATOM 223 HA PRO A 13 -13.390 -15.723 6.219 1.00 3.290 H ATOM 224 1HB PRO A 13 -11.397 -14.944 7.924 1.00 4.930 H ATOM 225 2HB PRO A 13 -11.210 -14.795 6.164 1.00 4.930 H ATOM 226 1HG PRO A 13 -12.044 -12.688 8.197 1.00 4.930 H ATOM 227 2HG PRO A 13 -10.861 -12.538 6.887 1.00 4.930 H ATOM 228 1HD PRO A 13 -13.429 -11.639 6.580 1.00 4.930 H ATOM 229 2HD PRO A 13 -12.453 -12.433 5.264 1.00 4.930 H ATOM 230 N ASN A 14 -13.735 -16.185 8.735 1.00 2.380 N ATOM 231 CA ASN A 14 -14.066 -16.460 10.118 1.00 2.340 C ATOM 232 C ASN A 14 -12.983 -15.808 10.967 1.00 1.840 C ATOM 233 O ASN A 14 -11.798 -16.091 10.789 1.00 2.430 O ATOM 234 CB ASN A 14 -14.183 -17.949 10.387 1.00 3.290 C ATOM 235 CG ASN A 14 -14.675 -18.269 11.790 1.00 3.290 C ATOM 236 OD1 ASN A 14 -14.216 -17.700 12.798 1.00 3.290 O ATOM 237 ND2 ASN A 14 -15.616 -19.187 11.871 1.00 3.290 N ATOM 238 H ASN A 14 -13.329 -16.921 8.176 1.00 2.860 H ATOM 239 HA ASN A 14 -15.016 -15.980 10.363 1.00 2.810 H ATOM 240 1HB ASN A 14 -14.875 -18.390 9.668 1.00 3.950 H ATOM 241 2HB ASN A 14 -13.228 -18.415 10.238 1.00 3.950 H ATOM 242 1HD2 ASN A 14 -15.987 -19.451 12.764 1.00 3.950 H ATOM 243 2HD2 ASN A 14 -15.964 -19.628 11.040 1.00 3.950 H ATOM 244 N LYS A 15 -13.365 -14.911 11.864 1.00 1.580 N ATOM 245 CA LYS A 15 -12.406 -14.166 12.683 1.00 2.050 C ATOM 246 C LYS A 15 -11.499 -15.046 13.558 1.00 1.980 C ATOM 247 O LYS A 15 -10.494 -14.566 14.083 1.00 2.510 O ATOM 248 CB LYS A 15 -13.129 -13.116 13.535 1.00 2.680 C ATOM 249 CG LYS A 15 -14.028 -13.632 14.657 1.00 2.680 C ATOM 250 CD LYS A 15 -14.742 -12.445 15.329 1.00 2.680 C ATOM 251 CE LYS A 15 -15.620 -12.866 16.492 1.00 2.680 C ATOM 252 NZ LYS A 15 -16.362 -11.705 17.076 1.00 2.680 N ATOM 253 H LYS A 15 -14.353 -14.721 11.956 1.00 1.900 H ATOM 254 HA LYS A 15 -11.750 -13.623 11.999 1.00 2.460 H ATOM 255 1HB LYS A 15 -12.385 -12.464 13.993 1.00 3.220 H ATOM 256 2HB LYS A 15 -13.742 -12.494 12.883 1.00 3.220 H ATOM 257 1HG LYS A 15 -14.758 -14.339 14.267 1.00 3.220 H ATOM 258 2HG LYS A 15 -13.415 -14.144 15.404 1.00 3.220 H ATOM 259 1HD LYS A 15 -13.994 -11.743 15.695 1.00 3.220 H ATOM 260 2HD LYS A 15 -15.363 -11.935 14.592 1.00 3.220 H ATOM 261 1HE LYS A 15 -16.334 -13.615 16.155 1.00 3.220 H ATOM 262 2HE LYS A 15 -14.995 -13.294 17.264 1.00 3.220 H ATOM 263 1HZ LYS A 15 -16.929 -12.021 17.850 1.00 3.220 H ATOM 264 2HZ LYS A 15 -15.704 -11.011 17.404 1.00 3.220 H ATOM 265 3HZ LYS A 15 -16.959 -11.293 16.371 1.00 3.220 H ATOM 266 N PHE A 16 -11.866 -16.312 13.760 1.00 1.750 N ATOM 267 CA PHE A 16 -11.060 -17.220 14.566 1.00 1.870 C ATOM 268 C PHE A 16 -10.247 -18.204 13.712 1.00 1.560 C ATOM 269 O PHE A 16 -9.651 -19.139 14.252 1.00 1.950 O ATOM 270 CB PHE A 16 -11.953 -18.043 15.488 1.00 2.570 C ATOM 271 CG PHE A 16 -12.733 -17.249 16.474 1.00 2.570 C ATOM 272 CD1 PHE A 16 -14.094 -17.063 16.298 1.00 2.570 C ATOM 273 CD2 PHE A 16 -12.123 -16.692 17.585 1.00 2.570 C ATOM 274 CE1 PHE A 16 -14.826 -16.349 17.211 1.00 2.570 C ATOM 275 CE2 PHE A 16 -12.856 -15.972 18.500 1.00 2.570 C ATOM 276 CZ PHE A 16 -14.208 -15.803 18.315 1.00 2.570 C ATOM 277 H PHE A 16 -12.718 -16.661 13.323 1.00 2.100 H ATOM 278 HA PHE A 16 -10.367 -16.630 15.163 1.00 2.240 H ATOM 279 1HB PHE A 16 -12.655 -18.614 14.880 1.00 3.080 H ATOM 280 2HB PHE A 16 -11.344 -18.759 16.035 1.00 3.080 H ATOM 281 HD1 PHE A 16 -14.585 -17.498 15.426 1.00 3.080 H ATOM 282 HD2 PHE A 16 -11.051 -16.831 17.734 1.00 3.080 H ATOM 283 HE1 PHE A 16 -15.896 -16.217 17.061 1.00 3.080 H ATOM 284 HE2 PHE A 16 -12.368 -15.539 19.374 1.00 3.080 H ATOM 285 HZ PHE A 16 -14.788 -15.240 19.042 1.00 3.080 H ATOM 286 N SER A 17 -10.245 -18.013 12.392 1.00 1.730 N ATOM 287 CA SER A 17 -9.545 -18.898 11.467 1.00 2.130 C ATOM 288 C SER A 17 -8.102 -18.522 11.175 1.00 1.790 C ATOM 289 O SER A 17 -7.726 -17.352 11.046 1.00 2.450 O ATOM 290 CB SER A 17 -10.276 -18.991 10.157 1.00 2.820 C ATOM 291 OG SER A 17 -9.535 -19.737 9.226 1.00 2.820 O ATOM 292 H SER A 17 -10.758 -17.219 11.999 1.00 2.080 H ATOM 293 HA SER A 17 -9.540 -19.892 11.912 1.00 2.560 H ATOM 294 1HB SER A 17 -11.232 -19.468 10.321 1.00 3.390 H ATOM 295 2HB SER A 17 -10.462 -17.994 9.765 1.00 3.390 H ATOM 296 HG SER A 17 -10.100 -19.779 8.444 1.00 3.390 H ATOM 297 N VAL A 18 -7.303 -19.554 10.976 1.00 1.360 N ATOM 298 CA VAL A 18 -5.888 -19.422 10.630 1.00 1.530 C ATOM 299 C VAL A 18 -5.677 -18.887 9.214 1.00 1.460 C ATOM 300 O VAL A 18 -4.569 -18.522 8.832 1.00 2.080 O ATOM 301 CB VAL A 18 -5.169 -20.780 10.768 1.00 2.070 C ATOM 302 CG1 VAL A 18 -5.282 -21.274 12.206 1.00 2.070 C ATOM 303 CG2 VAL A 18 -5.766 -21.802 9.777 1.00 2.070 C ATOM 304 H VAL A 18 -7.710 -20.469 11.090 1.00 1.630 H ATOM 305 HA VAL A 18 -5.433 -18.721 11.332 1.00 1.840 H ATOM 306 HB VAL A 18 -4.108 -20.645 10.552 1.00 2.490 H ATOM 307 1HG1 VAL A 18 -4.753 -22.223 12.309 1.00 2.490 H ATOM 308 2HG1 VAL A 18 -4.839 -20.537 12.875 1.00 2.490 H ATOM 309 3HG1 VAL A 18 -6.327 -21.416 12.470 1.00 2.490 H ATOM 310 1HG2 VAL A 18 -5.240 -22.750 9.883 1.00 2.490 H ATOM 311 2HG2 VAL A 18 -6.821 -21.955 9.982 1.00 2.490 H ATOM 312 3HG2 VAL A 18 -5.647 -21.447 8.756 1.00 2.490 H ATOM 313 N ARG A 19 -6.748 -18.849 8.435 1.00 1.520 N ATOM 314 CA ARG A 19 -6.695 -18.398 7.059 1.00 1.860 C ATOM 315 C ARG A 19 -6.842 -16.892 6.923 1.00 1.280 C ATOM 316 O ARG A 19 -6.997 -16.375 5.817 1.00 1.710 O ATOM 317 CB ARG A 19 -7.769 -19.089 6.239 1.00 2.470 C ATOM 318 CG ARG A 19 -7.586 -20.593 6.106 1.00 2.470 C ATOM 319 CD ARG A 19 -8.650 -21.209 5.284 1.00 2.470 C ATOM 320 NE ARG A 19 -8.475 -22.653 5.169 1.00 2.470 N ATOM 321 CZ ARG A 19 -9.278 -23.484 4.464 1.00 2.470 C ATOM 322 NH1 ARG A 19 -10.320 -23.013 3.804 1.00 2.470 N ATOM 323 NH2 ARG A 19 -9.014 -24.781 4.439 1.00 2.470 N ATOM 324 H ARG A 19 -7.637 -19.154 8.827 1.00 1.820 H ATOM 325 HA ARG A 19 -5.725 -18.681 6.650 1.00 2.230 H ATOM 326 1HB ARG A 19 -8.741 -18.907 6.690 1.00 2.960 H ATOM 327 2HB ARG A 19 -7.789 -18.669 5.234 1.00 2.960 H ATOM 328 1HG ARG A 19 -6.624 -20.803 5.642 1.00 2.960 H ATOM 329 2HG ARG A 19 -7.617 -21.048 7.096 1.00 2.960 H ATOM 330 1HD ARG A 19 -9.617 -21.013 5.746 1.00 2.960 H ATOM 331 2HD ARG A 19 -8.624 -20.776 4.284 1.00 2.960 H ATOM 332 HE ARG A 19 -7.689 -23.065 5.656 1.00 2.960 H ATOM 333 1HH1 ARG A 19 -10.528 -22.027 3.817 1.00 2.960 H ATOM 334 2HH1 ARG A 19 -10.914 -23.641 3.282 1.00 2.960 H ATOM 335 1HH2 ARG A 19 -8.217 -25.145 4.944 1.00 2.960 H ATOM 336 2HH2 ARG A 19 -9.607 -25.410 3.917 1.00 2.960 H ATOM 337 N ASP A 20 -6.833 -16.168 8.020 1.00 1.020 N ATOM 338 CA ASP A 20 -6.971 -14.731 7.917 1.00 1.340 C ATOM 339 C ASP A 20 -5.666 -14.065 7.452 1.00 1.100 C ATOM 340 O ASP A 20 -4.702 -13.965 8.210 1.00 1.220 O ATOM 341 CB ASP A 20 -7.395 -14.181 9.297 1.00 1.750 C ATOM 342 CG ASP A 20 -7.705 -12.657 9.372 1.00 1.750 C ATOM 343 OD1 ASP A 20 -7.477 -11.954 8.431 1.00 1.750 O ATOM 344 OD2 ASP A 20 -8.178 -12.224 10.400 1.00 1.750 O ATOM 345 H ASP A 20 -6.764 -16.612 8.940 1.00 1.220 H ATOM 346 HA ASP A 20 -7.752 -14.506 7.191 1.00 1.610 H ATOM 347 1HB ASP A 20 -8.279 -14.730 9.639 1.00 2.100 H ATOM 348 2HB ASP A 20 -6.602 -14.400 10.015 1.00 2.100 H ATOM 349 N TYR A 21 -5.622 -13.632 6.191 1.00 1.160 N ATOM 350 CA TYR A 21 -4.428 -12.999 5.656 1.00 0.970 C ATOM 351 C TYR A 21 -4.794 -11.550 5.420 1.00 0.860 C ATOM 352 O TYR A 21 -5.966 -11.240 5.196 1.00 1.120 O ATOM 353 CB TYR A 21 -3.968 -13.654 4.349 1.00 1.430 C ATOM 354 CG TYR A 21 -4.911 -13.470 3.155 1.00 1.430 C ATOM 355 CD1 TYR A 21 -4.748 -12.375 2.316 1.00 1.430 C ATOM 356 CD2 TYR A 21 -5.915 -14.387 2.891 1.00 1.430 C ATOM 357 CE1 TYR A 21 -5.562 -12.199 1.227 1.00 1.430 C ATOM 358 CE2 TYR A 21 -6.735 -14.205 1.785 1.00 1.430 C ATOM 359 CZ TYR A 21 -6.550 -13.117 0.956 1.00 1.430 C ATOM 360 OH TYR A 21 -7.347 -12.944 -0.150 1.00 1.430 O ATOM 361 H TYR A 21 -6.439 -13.740 5.607 1.00 1.390 H ATOM 362 HA TYR A 21 -3.624 -13.039 6.391 1.00 1.160 H ATOM 363 1HB TYR A 21 -2.994 -13.250 4.069 1.00 1.720 H ATOM 364 2HB TYR A 21 -3.841 -14.723 4.514 1.00 1.720 H ATOM 365 HD1 TYR A 21 -3.965 -11.658 2.517 1.00 1.720 H ATOM 366 HD2 TYR A 21 -6.055 -15.253 3.544 1.00 1.720 H ATOM 367 HE1 TYR A 21 -5.420 -11.341 0.575 1.00 1.720 H ATOM 368 HE2 TYR A 21 -7.522 -14.926 1.567 1.00 1.720 H ATOM 369 HH TYR A 21 -7.081 -12.149 -0.620 1.00 1.720 H ATOM 370 N THR A 22 -3.804 -10.677 5.451 1.00 0.650 N ATOM 371 CA THR A 22 -4.009 -9.258 5.227 1.00 0.670 C ATOM 372 C THR A 22 -3.849 -8.923 3.763 1.00 0.630 C ATOM 373 O THR A 22 -3.034 -9.529 3.072 1.00 0.810 O ATOM 374 CB THR A 22 -3.040 -8.433 6.106 1.00 0.930 C ATOM 375 OG1 THR A 22 -3.315 -8.714 7.485 1.00 0.930 O ATOM 376 CG2 THR A 22 -3.212 -6.933 5.879 1.00 0.930 C ATOM 377 H THR A 22 -2.870 -11.011 5.636 1.00 0.780 H ATOM 378 HA THR A 22 -5.029 -9.003 5.520 1.00 0.800 H ATOM 379 HB THR A 22 -2.012 -8.714 5.877 1.00 1.120 H ATOM 380 HG1 THR A 22 -3.117 -9.635 7.672 1.00 1.120 H ATOM 381 1HG2 THR A 22 -2.521 -6.392 6.523 1.00 1.120 H ATOM 382 2HG2 THR A 22 -3.002 -6.685 4.860 1.00 1.120 H ATOM 383 3HG2 THR A 22 -4.233 -6.642 6.118 1.00 1.120 H ATOM 384 N ARG A 23 -4.637 -7.979 3.276 1.00 0.680 N ATOM 385 CA ARG A 23 -4.468 -7.539 1.912 1.00 0.720 C ATOM 386 C ARG A 23 -4.383 -6.044 1.893 1.00 0.650 C ATOM 387 O ARG A 23 -4.884 -5.348 2.776 1.00 0.660 O ATOM 388 CB ARG A 23 -5.610 -7.923 0.995 1.00 0.990 C ATOM 389 CG ARG A 23 -6.908 -7.231 1.319 1.00 0.990 C ATOM 390 CD ARG A 23 -7.996 -7.608 0.418 1.00 0.990 C ATOM 391 NE ARG A 23 -9.275 -7.078 0.908 1.00 0.990 N ATOM 392 CZ ARG A 23 -9.803 -5.853 0.647 1.00 0.990 C ATOM 393 NH1 ARG A 23 -9.179 -4.998 -0.140 1.00 0.990 N ATOM 394 NH2 ARG A 23 -10.963 -5.509 1.196 1.00 0.990 N ATOM 395 H ARG A 23 -5.302 -7.513 3.880 1.00 0.820 H ATOM 396 HA ARG A 23 -3.540 -7.942 1.510 1.00 0.860 H ATOM 397 1HB ARG A 23 -5.346 -7.683 -0.038 1.00 1.190 H ATOM 398 2HB ARG A 23 -5.769 -8.995 1.048 1.00 1.190 H ATOM 399 1HG ARG A 23 -7.183 -7.424 2.335 1.00 1.190 H ATOM 400 2HG ARG A 23 -6.786 -6.157 1.193 1.00 1.190 H ATOM 401 1HD ARG A 23 -7.807 -7.212 -0.574 1.00 1.190 H ATOM 402 2HD ARG A 23 -8.069 -8.687 0.357 1.00 1.190 H ATOM 403 HE ARG A 23 -9.773 -7.680 1.579 1.00 1.190 H ATOM 404 1HH1 ARG A 23 -8.299 -5.249 -0.557 1.00 1.190 H ATOM 405 2HH1 ARG A 23 -9.576 -4.081 -0.314 1.00 1.190 H ATOM 406 1HH2 ARG A 23 -11.472 -6.165 1.798 1.00 1.190 H ATOM 407 2HH2 ARG A 23 -11.363 -4.606 1.010 1.00 1.190 H ATOM 408 N CYS A 24 -3.806 -5.591 0.830 1.00 0.620 N ATOM 409 CA CYS A 24 -3.643 -4.219 0.417 1.00 0.570 C ATOM 410 C CYS A 24 -4.942 -3.468 0.137 1.00 0.610 C ATOM 411 O CYS A 24 -5.610 -3.703 -0.874 1.00 0.690 O ATOM 412 CB CYS A 24 -2.824 -4.272 -0.836 1.00 0.820 C ATOM 413 SG CYS A 24 -2.603 -2.794 -1.652 1.00 0.820 S ATOM 414 H CYS A 24 -3.396 -6.305 0.232 1.00 0.740 H ATOM 415 HA CYS A 24 -3.094 -3.700 1.201 1.00 0.680 H ATOM 416 1HB CYS A 24 -1.844 -4.670 -0.595 1.00 0.980 H ATOM 417 2HB CYS A 24 -3.285 -4.973 -1.515 1.00 0.980 H ATOM 418 N LEU A 25 -5.193 -2.414 0.901 1.00 0.600 N ATOM 419 CA LEU A 25 -6.436 -1.647 0.770 1.00 0.670 C ATOM 420 C LEU A 25 -6.675 -1.025 -0.606 1.00 0.670 C ATOM 421 O LEU A 25 -7.818 -0.922 -1.049 1.00 0.760 O ATOM 422 CB LEU A 25 -6.443 -0.509 1.802 1.00 0.910 C ATOM 423 CG LEU A 25 -6.579 -0.904 3.292 1.00 0.910 C ATOM 424 CD1 LEU A 25 -6.298 0.325 4.145 1.00 0.910 C ATOM 425 CD2 LEU A 25 -7.991 -1.436 3.577 1.00 0.910 C ATOM 426 H LEU A 25 -4.562 -2.237 1.690 1.00 0.720 H ATOM 427 HA LEU A 25 -7.261 -2.326 0.964 1.00 0.800 H ATOM 428 1HB LEU A 25 -5.522 0.048 1.706 1.00 1.090 H ATOM 429 2HB LEU A 25 -7.265 0.159 1.561 1.00 1.090 H ATOM 430 HG LEU A 25 -5.851 -1.670 3.540 1.00 1.090 H ATOM 431 1HD1 LEU A 25 -6.378 0.063 5.199 1.00 1.090 H ATOM 432 2HD1 LEU A 25 -5.284 0.686 3.941 1.00 1.090 H ATOM 433 3HD1 LEU A 25 -7.015 1.109 3.911 1.00 1.090 H ATOM 434 1HD2 LEU A 25 -8.066 -1.699 4.631 1.00 1.090 H ATOM 435 2HD2 LEU A 25 -8.726 -0.666 3.341 1.00 1.090 H ATOM 436 3HD2 LEU A 25 -8.191 -2.320 2.981 1.00 1.090 H ATOM 437 N ARG A 26 -5.617 -0.590 -1.279 1.00 0.600 N ATOM 438 CA ARG A 26 -5.765 0.064 -2.575 1.00 0.640 C ATOM 439 C ARG A 26 -5.391 -0.784 -3.772 1.00 0.700 C ATOM 440 O ARG A 26 -5.407 -0.300 -4.904 1.00 0.990 O ATOM 441 CB ARG A 26 -4.882 1.287 -2.637 1.00 0.880 C ATOM 442 CG ARG A 26 -5.234 2.388 -1.703 1.00 0.880 C ATOM 443 CD ARG A 26 -4.236 3.453 -1.795 1.00 0.880 C ATOM 444 NE ARG A 26 -4.211 4.110 -3.107 1.00 0.880 N ATOM 445 CZ ARG A 26 -4.992 5.143 -3.495 1.00 0.880 C ATOM 446 NH1 ARG A 26 -5.889 5.656 -2.675 1.00 0.880 N ATOM 447 NH2 ARG A 26 -4.849 5.642 -4.713 1.00 0.880 N ATOM 448 H ARG A 26 -4.693 -0.707 -0.883 1.00 0.720 H ATOM 449 HA ARG A 26 -6.805 0.371 -2.684 1.00 0.770 H ATOM 450 1HB ARG A 26 -3.852 0.988 -2.433 1.00 1.060 H ATOM 451 2HB ARG A 26 -4.908 1.692 -3.646 1.00 1.060 H ATOM 452 1HG ARG A 26 -6.212 2.787 -1.962 1.00 1.060 H ATOM 453 2HG ARG A 26 -5.250 2.012 -0.678 1.00 1.060 H ATOM 454 1HD ARG A 26 -4.405 4.198 -1.022 1.00 1.060 H ATOM 455 2HD ARG A 26 -3.266 2.990 -1.650 1.00 1.060 H ATOM 456 HE ARG A 26 -3.535 3.765 -3.782 1.00 1.060 H ATOM 457 1HH1 ARG A 26 -6.002 5.283 -1.746 1.00 1.060 H ATOM 458 2HH1 ARG A 26 -6.465 6.429 -2.977 1.00 1.060 H ATOM 459 1HH2 ARG A 26 -4.158 5.250 -5.343 1.00 1.060 H ATOM 460 2HH2 ARG A 26 -5.423 6.415 -5.016 1.00 1.060 H ATOM 461 N CYS A 27 -4.988 -2.010 -3.548 1.00 0.610 N ATOM 462 CA CYS A 27 -4.524 -2.785 -4.673 1.00 0.660 C ATOM 463 C CYS A 27 -5.082 -4.205 -4.699 1.00 0.680 C ATOM 464 O CYS A 27 -5.271 -4.792 -5.767 1.00 0.750 O ATOM 465 CB CYS A 27 -3.024 -2.757 -4.698 1.00 0.900 C ATOM 466 SG CYS A 27 -2.234 -3.639 -3.474 1.00 0.900 S ATOM 467 H CYS A 27 -5.041 -2.404 -2.610 1.00 0.730 H ATOM 468 HA CYS A 27 -4.857 -2.291 -5.584 1.00 0.790 H ATOM 469 1HB CYS A 27 -2.706 -3.133 -5.604 1.00 1.080 H ATOM 470 2HB CYS A 27 -2.681 -1.725 -4.641 1.00 1.080 H ATOM 471 N GLY A 28 -5.361 -4.774 -3.531 1.00 0.660 N ATOM 472 CA GLY A 28 -5.864 -6.132 -3.415 1.00 0.710 C ATOM 473 C GLY A 28 -4.793 -7.208 -3.247 1.00 0.710 C ATOM 474 O GLY A 28 -5.121 -8.368 -2.987 1.00 0.780 O ATOM 475 H GLY A 28 -5.229 -4.274 -2.655 1.00 0.790 H ATOM 476 1HA GLY A 28 -6.526 -6.168 -2.550 1.00 0.850 H ATOM 477 2HA GLY A 28 -6.483 -6.352 -4.270 1.00 0.850 H ATOM 478 N ARG A 29 -3.526 -6.837 -3.397 1.00 0.670 N ATOM 479 CA ARG A 29 -2.418 -7.765 -3.235 1.00 0.720 C ATOM 480 C ARG A 29 -2.265 -8.262 -1.798 1.00 0.700 C ATOM 481 O ARG A 29 -2.409 -7.505 -0.835 1.00 0.700 O ATOM 482 CB ARG A 29 -1.092 -7.134 -3.627 1.00 0.990 C ATOM 483 CG ARG A 29 -0.890 -6.841 -5.100 1.00 0.990 C ATOM 484 CD ARG A 29 0.469 -6.275 -5.324 1.00 0.990 C ATOM 485 NE ARG A 29 0.773 -6.106 -6.732 1.00 0.990 N ATOM 486 CZ ARG A 29 1.958 -5.683 -7.228 1.00 0.990 C ATOM 487 NH1 ARG A 29 2.955 -5.382 -6.416 1.00 0.990 N ATOM 488 NH2 ARG A 29 2.114 -5.580 -8.539 1.00 0.990 N ATOM 489 H ARG A 29 -3.338 -5.878 -3.659 1.00 0.800 H ATOM 490 HA ARG A 29 -2.599 -8.625 -3.882 1.00 0.860 H ATOM 491 1HB ARG A 29 -0.952 -6.212 -3.076 1.00 1.190 H ATOM 492 2HB ARG A 29 -0.283 -7.798 -3.326 1.00 1.190 H ATOM 493 1HG ARG A 29 -1.000 -7.751 -5.686 1.00 1.190 H ATOM 494 2HG ARG A 29 -1.626 -6.109 -5.427 1.00 1.190 H ATOM 495 1HD ARG A 29 0.520 -5.293 -4.843 1.00 1.190 H ATOM 496 2HD ARG A 29 1.214 -6.937 -4.883 1.00 1.190 H ATOM 497 HE ARG A 29 0.046 -6.333 -7.396 1.00 1.190 H ATOM 498 1HH1 ARG A 29 2.840 -5.468 -5.418 1.00 1.190 H ATOM 499 2HH1 ARG A 29 3.843 -5.081 -6.793 1.00 1.190 H ATOM 500 1HH2 ARG A 29 1.346 -5.812 -9.157 1.00 1.190 H ATOM 501 2HH2 ARG A 29 2.995 -5.275 -8.927 1.00 1.190 H ATOM 502 N ALA A 30 -1.958 -9.552 -1.639 1.00 0.760 N ATOM 503 CA ALA A 30 -1.690 -10.118 -0.308 1.00 0.810 C ATOM 504 C ALA A 30 -0.193 -10.142 0.010 1.00 0.800 C ATOM 505 O ALA A 30 0.223 -10.561 1.087 1.00 1.100 O ATOM 506 CB ALA A 30 -2.248 -11.522 -0.217 1.00 1.110 C ATOM 507 H ALA A 30 -1.905 -10.151 -2.455 1.00 0.910 H ATOM 508 HA ALA A 30 -2.184 -9.495 0.433 1.00 0.970 H ATOM 509 1HB ALA A 30 -2.070 -11.913 0.787 1.00 1.340 H ATOM 510 2HB ALA A 30 -3.309 -11.495 -0.416 1.00 1.340 H ATOM 511 3HB ALA A 30 -1.757 -12.157 -0.947 1.00 1.340 H ATOM 512 N ARG A 31 0.616 -9.747 -0.958 1.00 0.670 N ATOM 513 CA ARG A 31 2.058 -9.776 -0.828 1.00 0.720 C ATOM 514 C ARG A 31 2.616 -8.419 -0.460 1.00 0.720 C ATOM 515 O ARG A 31 2.177 -7.393 -0.983 1.00 1.440 O ATOM 516 CB ARG A 31 2.693 -10.248 -2.129 1.00 0.990 C ATOM 517 CG ARG A 31 4.214 -10.388 -2.107 1.00 0.990 C ATOM 518 CD ARG A 31 4.727 -10.980 -3.359 1.00 0.990 C ATOM 519 NE ARG A 31 6.180 -11.115 -3.334 1.00 0.990 N ATOM 520 CZ ARG A 31 6.939 -11.574 -4.356 1.00 0.990 C ATOM 521 NH1 ARG A 31 6.380 -11.943 -5.492 1.00 0.990 N ATOM 522 NH2 ARG A 31 8.253 -11.655 -4.211 1.00 0.990 N ATOM 523 H ARG A 31 0.199 -9.405 -1.808 1.00 0.800 H ATOM 524 HA ARG A 31 2.319 -10.483 -0.040 1.00 0.860 H ATOM 525 1HB ARG A 31 2.276 -11.216 -2.402 1.00 1.190 H ATOM 526 2HB ARG A 31 2.442 -9.548 -2.924 1.00 1.190 H ATOM 527 1HG ARG A 31 4.676 -9.408 -2.009 1.00 1.190 H ATOM 528 2HG ARG A 31 4.518 -11.023 -1.276 1.00 1.190 H ATOM 529 1HD ARG A 31 4.290 -11.969 -3.497 1.00 1.190 H ATOM 530 2HD ARG A 31 4.454 -10.335 -4.194 1.00 1.190 H ATOM 531 HE ARG A 31 6.657 -10.846 -2.484 1.00 1.190 H ATOM 532 1HH1 ARG A 31 5.380 -11.885 -5.610 1.00 1.190 H ATOM 533 2HH1 ARG A 31 6.953 -12.285 -6.251 1.00 1.190 H ATOM 534 1HH2 ARG A 31 8.684 -11.375 -3.342 1.00 1.190 H ATOM 535 2HH2 ARG A 31 8.827 -11.996 -4.968 1.00 1.190 H ATOM 536 N ALA A 32 3.632 -8.421 0.400 1.00 0.670 N ATOM 537 CA ALA A 32 4.357 -7.215 0.787 1.00 0.670 C ATOM 538 C ALA A 32 3.465 -6.111 1.326 1.00 0.570 C ATOM 539 O ALA A 32 3.619 -4.957 0.919 1.00 0.630 O ATOM 540 CB ALA A 32 5.125 -6.669 -0.410 1.00 0.940 C ATOM 541 H ALA A 32 3.913 -9.307 0.796 1.00 0.800 H ATOM 542 HA ALA A 32 5.062 -7.488 1.573 1.00 0.800 H ATOM 543 1HB ALA A 32 5.685 -5.800 -0.107 1.00 1.130 H ATOM 544 2HB ALA A 32 5.807 -7.429 -0.783 1.00 1.130 H ATOM 545 3HB ALA A 32 4.436 -6.386 -1.201 1.00 1.130 H ATOM 546 N VAL A 33 2.547 -6.454 2.231 1.00 0.520 N ATOM 547 CA VAL A 33 1.655 -5.462 2.819 1.00 0.480 C ATOM 548 C VAL A 33 2.243 -4.939 4.119 1.00 0.500 C ATOM 549 O VAL A 33 2.655 -5.709 4.988 1.00 0.540 O ATOM 550 CB VAL A 33 0.230 -6.025 2.982 1.00 0.690 C ATOM 551 CG1 VAL A 33 -0.701 -4.964 3.619 1.00 0.690 C ATOM 552 CG2 VAL A 33 -0.294 -6.448 1.596 1.00 0.690 C ATOM 553 H VAL A 33 2.480 -7.423 2.514 1.00 0.620 H ATOM 554 HA VAL A 33 1.577 -4.618 2.171 1.00 0.580 H ATOM 555 HB VAL A 33 0.251 -6.892 3.642 1.00 0.830 H ATOM 556 1HG1 VAL A 33 -1.693 -5.364 3.711 1.00 0.830 H ATOM 557 2HG1 VAL A 33 -0.337 -4.674 4.603 1.00 0.830 H ATOM 558 3HG1 VAL A 33 -0.740 -4.090 2.983 1.00 0.830 H ATOM 559 1HG2 VAL A 33 -1.293 -6.861 1.689 1.00 0.830 H ATOM 560 2HG2 VAL A 33 -0.317 -5.585 0.940 1.00 0.830 H ATOM 561 3HG2 VAL A 33 0.360 -7.203 1.164 1.00 0.830 H ATOM 562 N LEU A 34 2.305 -3.616 4.222 1.00 0.500 N ATOM 563 CA LEU A 34 2.868 -2.936 5.369 1.00 0.540 C ATOM 564 C LEU A 34 1.799 -2.753 6.433 1.00 0.570 C ATOM 565 O LEU A 34 0.816 -2.031 6.230 1.00 0.550 O ATOM 566 CB LEU A 34 3.389 -1.561 4.920 1.00 0.740 C ATOM 567 CG LEU A 34 4.495 -1.550 3.814 1.00 0.740 C ATOM 568 CD1 LEU A 34 4.730 -0.100 3.350 1.00 0.740 C ATOM 569 CD2 LEU A 34 5.792 -2.150 4.367 1.00 0.740 C ATOM 570 H LEU A 34 1.937 -3.055 3.451 1.00 0.600 H ATOM 571 HA LEU A 34 3.670 -3.542 5.784 1.00 0.650 H ATOM 572 1HB LEU A 34 2.542 -1.001 4.521 1.00 0.890 H ATOM 573 2HB LEU A 34 3.778 -1.036 5.789 1.00 0.890 H ATOM 574 HG LEU A 34 4.153 -2.133 2.951 1.00 0.890 H ATOM 575 1HD1 LEU A 34 5.483 -0.078 2.569 1.00 0.890 H ATOM 576 2HD1 LEU A 34 3.797 0.302 2.961 1.00 0.890 H ATOM 577 3HD1 LEU A 34 5.068 0.507 4.182 1.00 0.890 H ATOM 578 1HD2 LEU A 34 6.558 -2.136 3.602 1.00 0.890 H ATOM 579 2HD2 LEU A 34 6.132 -1.564 5.222 1.00 0.890 H ATOM 580 3HD2 LEU A 34 5.624 -3.179 4.677 1.00 0.890 H ATOM 581 N SER A 35 2.030 -3.346 7.605 1.00 0.630 N ATOM 582 CA SER A 35 1.081 -3.331 8.724 1.00 0.680 C ATOM 583 C SER A 35 0.829 -1.936 9.287 1.00 0.690 C ATOM 584 O SER A 35 -0.180 -1.686 9.945 1.00 0.730 O ATOM 585 CB SER A 35 1.591 -4.237 9.822 1.00 0.930 C ATOM 586 OG SER A 35 2.766 -3.723 10.381 1.00 0.930 O ATOM 587 H SER A 35 2.874 -3.896 7.712 1.00 0.760 H ATOM 588 HA SER A 35 0.129 -3.727 8.363 1.00 0.820 H ATOM 589 1HB SER A 35 0.829 -4.335 10.595 1.00 1.120 H ATOM 590 2HB SER A 35 1.779 -5.230 9.417 1.00 1.120 H ATOM 591 HG SER A 35 3.036 -4.353 11.058 1.00 1.120 H ATOM 592 N HIS A 36 1.736 -1.024 8.979 1.00 0.650 N ATOM 593 CA HIS A 36 1.671 0.359 9.416 1.00 0.650 C ATOM 594 C HIS A 36 0.715 1.190 8.571 1.00 0.620 C ATOM 595 O HIS A 36 0.237 2.235 9.018 1.00 0.650 O ATOM 596 CB HIS A 36 3.054 1.005 9.296 1.00 0.910 C ATOM 597 CG HIS A 36 4.078 0.458 10.217 1.00 0.910 C ATOM 598 ND1 HIS A 36 4.047 0.663 11.581 1.00 0.910 N ATOM 599 CD2 HIS A 36 5.173 -0.294 9.971 1.00 0.910 C ATOM 600 CE1 HIS A 36 5.084 0.059 12.134 1.00 0.910 C ATOM 601 NE2 HIS A 36 5.783 -0.528 11.181 1.00 0.910 N ATOM 602 H HIS A 36 2.526 -1.334 8.439 1.00 0.780 H ATOM 603 HA HIS A 36 1.344 0.404 10.452 1.00 0.780 H ATOM 604 1HB HIS A 36 3.418 0.865 8.283 1.00 1.090 H ATOM 605 2HB HIS A 36 2.971 2.080 9.462 1.00 1.090 H ATOM 606 HD2 HIS A 36 5.512 -0.650 8.997 1.00 1.090 H ATOM 607 HE1 HIS A 36 5.321 0.048 13.198 1.00 1.090 H ATOM 608 HE2 HIS A 36 6.629 -1.065 11.313 1.00 1.090 H ATOM 609 N PHE A 37 0.481 0.768 7.321 1.00 0.570 N ATOM 610 CA PHE A 37 -0.328 1.578 6.426 1.00 0.560 C ATOM 611 C PHE A 37 -1.557 0.846 5.871 1.00 0.610 C ATOM 612 O PHE A 37 -2.503 1.483 5.407 1.00 0.670 O ATOM 613 CB PHE A 37 0.562 2.074 5.291 1.00 0.790 C ATOM 614 CG PHE A 37 1.766 2.806 5.791 1.00 0.790 C ATOM 615 CD1 PHE A 37 3.002 2.209 5.699 1.00 0.790 C ATOM 616 CD2 PHE A 37 1.676 4.053 6.376 1.00 0.790 C ATOM 617 CE1 PHE A 37 4.134 2.835 6.166 1.00 0.790 C ATOM 618 CE2 PHE A 37 2.810 4.687 6.852 1.00 0.790 C ATOM 619 CZ PHE A 37 4.038 4.076 6.743 1.00 0.790 C ATOM 620 H PHE A 37 0.851 -0.120 6.988 1.00 0.680 H ATOM 621 HA PHE A 37 -0.688 2.443 6.981 1.00 0.670 H ATOM 622 1HB PHE A 37 0.904 1.227 4.704 1.00 0.950 H ATOM 623 2HB PHE A 37 -0.003 2.740 4.640 1.00 0.950 H ATOM 624 HD1 PHE A 37 3.073 1.236 5.248 1.00 0.950 H ATOM 625 HD2 PHE A 37 0.702 4.535 6.468 1.00 0.950 H ATOM 626 HE1 PHE A 37 5.106 2.346 6.075 1.00 0.950 H ATOM 627 HE2 PHE A 37 2.732 5.674 7.315 1.00 0.950 H ATOM 628 HZ PHE A 37 4.930 4.575 7.115 1.00 0.950 H ATOM 629 N GLY A 38 -1.541 -0.491 5.885 1.00 0.620 N ATOM 630 CA GLY A 38 -2.631 -1.287 5.321 1.00 0.700 C ATOM 631 C GLY A 38 -2.515 -1.488 3.813 1.00 0.600 C ATOM 632 O GLY A 38 -3.437 -2.014 3.184 1.00 0.560 O ATOM 633 H GLY A 38 -0.743 -0.991 6.271 1.00 0.740 H ATOM 634 1HA GLY A 38 -2.644 -2.259 5.812 1.00 0.840 H ATOM 635 2HA GLY A 38 -3.581 -0.806 5.550 1.00 0.840 H ATOM 636 N VAL A 39 -1.400 -1.060 3.237 1.00 0.590 N ATOM 637 CA VAL A 39 -1.167 -1.168 1.806 1.00 0.520 C ATOM 638 C VAL A 39 0.155 -1.846 1.466 1.00 0.460 C ATOM 639 O VAL A 39 1.068 -1.927 2.292 1.00 0.480 O ATOM 640 CB VAL A 39 -1.232 0.221 1.143 1.00 0.760 C ATOM 641 CG1 VAL A 39 -2.613 0.837 1.329 1.00 0.760 C ATOM 642 CG2 VAL A 39 -0.168 1.107 1.728 1.00 0.760 C ATOM 643 H VAL A 39 -0.703 -0.639 3.835 1.00 0.710 H ATOM 644 HA VAL A 39 -1.963 -1.764 1.374 1.00 0.620 H ATOM 645 HB VAL A 39 -1.072 0.118 0.107 1.00 0.910 H ATOM 646 1HG1 VAL A 39 -2.650 1.806 0.838 1.00 0.910 H ATOM 647 2HG1 VAL A 39 -3.347 0.178 0.887 1.00 0.910 H ATOM 648 3HG1 VAL A 39 -2.828 0.966 2.392 1.00 0.910 H ATOM 649 1HG2 VAL A 39 -0.196 2.077 1.249 1.00 0.910 H ATOM 650 2HG2 VAL A 39 -0.349 1.217 2.773 1.00 0.910 H ATOM 651 3HG2 VAL A 39 0.792 0.650 1.569 1.00 0.910 H ATOM 652 N CYS A 40 0.247 -2.309 0.234 1.00 0.440 N ATOM 653 CA CYS A 40 1.426 -2.963 -0.309 1.00 0.420 C ATOM 654 C CYS A 40 2.561 -1.984 -0.508 1.00 0.430 C ATOM 655 O CYS A 40 2.329 -0.786 -0.662 1.00 0.410 O ATOM 656 CB CYS A 40 1.096 -3.624 -1.644 1.00 0.600 C ATOM 657 SG CYS A 40 0.856 -2.474 -3.055 1.00 0.600 S ATOM 658 H CYS A 40 -0.550 -2.187 -0.378 1.00 0.530 H ATOM 659 HA CYS A 40 1.746 -3.728 0.373 1.00 0.500 H ATOM 660 1HB CYS A 40 1.897 -4.317 -1.905 1.00 0.720 H ATOM 661 2HB CYS A 40 0.195 -4.217 -1.536 1.00 0.720 H ATOM 662 N ARG A 41 3.785 -2.484 -0.592 1.00 0.550 N ATOM 663 CA ARG A 41 4.902 -1.589 -0.842 1.00 0.660 C ATOM 664 C ARG A 41 4.782 -0.812 -2.160 1.00 0.690 C ATOM 665 O ARG A 41 5.166 0.355 -2.222 1.00 0.720 O ATOM 666 CB ARG A 41 6.239 -2.318 -0.795 1.00 0.880 C ATOM 667 CG ARG A 41 6.685 -2.727 0.611 1.00 0.880 C ATOM 668 CD ARG A 41 8.145 -3.112 0.675 1.00 0.880 C ATOM 669 NE ARG A 41 8.485 -4.327 -0.075 1.00 0.880 N ATOM 670 CZ ARG A 41 8.464 -5.594 0.415 1.00 0.880 C ATOM 671 NH1 ARG A 41 8.116 -5.834 1.665 1.00 0.880 N ATOM 672 NH2 ARG A 41 8.805 -6.601 -0.374 1.00 0.880 N ATOM 673 H ARG A 41 3.917 -3.482 -0.394 1.00 0.660 H ATOM 674 HA ARG A 41 4.918 -0.864 -0.029 1.00 0.790 H ATOM 675 1HB ARG A 41 6.179 -3.221 -1.400 1.00 1.060 H ATOM 676 2HB ARG A 41 7.012 -1.685 -1.224 1.00 1.060 H ATOM 677 1HG ARG A 41 6.539 -1.880 1.268 1.00 1.060 H ATOM 678 2HG ARG A 41 6.078 -3.563 0.963 1.00 1.060 H ATOM 679 1HD ARG A 41 8.732 -2.293 0.259 1.00 1.060 H ATOM 680 2HD ARG A 41 8.433 -3.250 1.714 1.00 1.060 H ATOM 681 HE ARG A 41 8.768 -4.211 -1.038 1.00 1.060 H ATOM 682 1HH1 ARG A 41 7.861 -5.076 2.278 1.00 1.060 H ATOM 683 2HH1 ARG A 41 8.112 -6.782 2.014 1.00 1.060 H ATOM 684 1HH2 ARG A 41 9.078 -6.423 -1.332 1.00 1.060 H ATOM 685 2HH2 ARG A 41 8.800 -7.545 -0.020 1.00 1.060 H ATOM 686 N LEU A 42 4.282 -1.432 -3.228 1.00 0.750 N ATOM 687 CA LEU A 42 4.210 -0.690 -4.492 1.00 0.880 C ATOM 688 C LEU A 42 3.257 0.505 -4.429 1.00 0.790 C ATOM 689 O LEU A 42 3.607 1.625 -4.812 1.00 0.800 O ATOM 690 CB LEU A 42 3.813 -1.624 -5.645 1.00 1.180 C ATOM 691 CG LEU A 42 3.617 -0.968 -7.051 1.00 1.180 C ATOM 692 CD1 LEU A 42 4.901 -0.292 -7.516 1.00 1.180 C ATOM 693 CD2 LEU A 42 3.217 -2.054 -8.039 1.00 1.180 C ATOM 694 H LEU A 42 4.007 -2.404 -3.152 1.00 0.900 H ATOM 695 HA LEU A 42 5.206 -0.306 -4.692 1.00 1.060 H ATOM 696 1HB LEU A 42 4.575 -2.393 -5.740 1.00 1.420 H ATOM 697 2HB LEU A 42 2.873 -2.112 -5.385 1.00 1.420 H ATOM 698 HG LEU A 42 2.831 -0.212 -6.998 1.00 1.420 H ATOM 699 1HD1 LEU A 42 4.733 0.151 -8.499 1.00 1.420 H ATOM 700 2HD1 LEU A 42 5.187 0.497 -6.822 1.00 1.420 H ATOM 701 3HD1 LEU A 42 5.695 -1.028 -7.582 1.00 1.420 H ATOM 702 1HD2 LEU A 42 3.061 -1.608 -9.024 1.00 1.420 H ATOM 703 2HD2 LEU A 42 4.003 -2.803 -8.100 1.00 1.420 H ATOM 704 3HD2 LEU A 42 2.305 -2.521 -7.711 1.00 1.420 H ATOM 705 N CYS A 43 2.064 0.261 -3.958 1.00 0.740 N ATOM 706 CA CYS A 43 1.049 1.262 -3.817 1.00 0.690 C ATOM 707 C CYS A 43 1.394 2.233 -2.686 1.00 0.570 C ATOM 708 O CYS A 43 1.034 3.408 -2.760 1.00 0.610 O ATOM 709 CB CYS A 43 -0.265 0.542 -3.679 1.00 0.990 C ATOM 710 SG CYS A 43 -0.259 -0.600 -2.375 1.00 0.990 S ATOM 711 H CYS A 43 1.863 -0.678 -3.678 1.00 0.890 H ATOM 712 HA CYS A 43 1.003 1.829 -4.748 1.00 0.830 H ATOM 713 1HB CYS A 43 -1.064 1.261 -3.496 1.00 1.180 H ATOM 714 2HB CYS A 43 -0.497 0.012 -4.594 1.00 1.180 H ATOM 715 N PHE A 44 2.147 1.772 -1.678 1.00 0.470 N ATOM 716 CA PHE A 44 2.636 2.654 -0.641 1.00 0.380 C ATOM 717 C PHE A 44 3.529 3.681 -1.281 1.00 0.440 C ATOM 718 O PHE A 44 3.405 4.867 -0.994 1.00 0.420 O ATOM 719 CB PHE A 44 3.396 1.950 0.452 1.00 0.570 C ATOM 720 CG PHE A 44 3.931 2.922 1.416 1.00 0.570 C ATOM 721 CD1 PHE A 44 3.095 3.585 2.295 1.00 0.570 C ATOM 722 CD2 PHE A 44 5.285 3.186 1.449 1.00 0.570 C ATOM 723 CE1 PHE A 44 3.608 4.490 3.168 1.00 0.570 C ATOM 724 CE2 PHE A 44 5.791 4.085 2.332 1.00 0.570 C ATOM 725 CZ PHE A 44 4.955 4.733 3.188 1.00 0.570 C ATOM 726 H PHE A 44 2.366 0.778 -1.602 1.00 0.560 H ATOM 727 HA PHE A 44 1.791 3.163 -0.194 1.00 0.460 H ATOM 728 1HB PHE A 44 2.778 1.248 0.958 1.00 0.680 H ATOM 729 2HB PHE A 44 4.222 1.406 0.021 1.00 0.680 H ATOM 730 HD1 PHE A 44 2.023 3.386 2.283 1.00 0.680 H ATOM 731 HD2 PHE A 44 5.951 2.668 0.757 1.00 0.680 H ATOM 732 HE1 PHE A 44 2.954 5.013 3.858 1.00 0.680 H ATOM 733 HE2 PHE A 44 6.860 4.290 2.356 1.00 0.680 H ATOM 734 HZ PHE A 44 5.366 5.438 3.889 1.00 0.680 H ATOM 735 N ARG A 45 4.476 3.232 -2.117 1.00 0.560 N ATOM 736 CA ARG A 45 5.364 4.169 -2.775 1.00 0.670 C ATOM 737 C ARG A 45 4.586 5.177 -3.616 1.00 0.710 C ATOM 738 O ARG A 45 4.863 6.375 -3.540 1.00 0.730 O ATOM 739 CB ARG A 45 6.389 3.461 -3.642 1.00 0.890 C ATOM 740 CG ARG A 45 7.494 2.752 -2.877 1.00 0.890 C ATOM 741 CD ARG A 45 8.624 2.346 -3.768 1.00 0.890 C ATOM 742 NE ARG A 45 8.235 1.334 -4.766 1.00 0.890 N ATOM 743 CZ ARG A 45 8.250 -0.011 -4.577 1.00 0.890 C ATOM 744 NH1 ARG A 45 8.620 -0.525 -3.424 1.00 0.890 N ATOM 745 NH2 ARG A 45 7.898 -0.814 -5.567 1.00 0.890 N ATOM 746 H ARG A 45 4.586 2.223 -2.271 1.00 0.670 H ATOM 747 HA ARG A 45 5.908 4.708 -2.005 1.00 0.800 H ATOM 748 1HB ARG A 45 5.884 2.709 -4.247 1.00 1.070 H ATOM 749 2HB ARG A 45 6.845 4.167 -4.315 1.00 1.070 H ATOM 750 1HG ARG A 45 7.887 3.427 -2.117 1.00 1.070 H ATOM 751 2HG ARG A 45 7.098 1.868 -2.395 1.00 1.070 H ATOM 752 1HD ARG A 45 8.975 3.230 -4.307 1.00 1.070 H ATOM 753 2HD ARG A 45 9.443 1.954 -3.171 1.00 1.070 H ATOM 754 HE ARG A 45 7.950 1.670 -5.677 1.00 1.070 H ATOM 755 1HH1 ARG A 45 8.891 0.077 -2.663 1.00 1.070 H ATOM 756 2HH1 ARG A 45 8.637 -1.525 -3.300 1.00 1.070 H ATOM 757 1HH2 ARG A 45 7.616 -0.424 -6.455 1.00 1.070 H ATOM 758 2HH2 ARG A 45 7.914 -1.815 -5.439 1.00 1.070 H ATOM 759 N GLU A 46 3.546 4.741 -4.342 1.00 0.750 N ATOM 760 CA GLU A 46 2.785 5.714 -5.127 1.00 0.840 C ATOM 761 C GLU A 46 2.176 6.786 -4.212 1.00 0.740 C ATOM 762 O GLU A 46 2.246 7.988 -4.509 1.00 0.770 O ATOM 763 CB GLU A 46 1.635 5.022 -5.876 1.00 1.140 C ATOM 764 CG GLU A 46 2.033 4.094 -7.021 1.00 1.140 C ATOM 765 CD GLU A 46 0.833 3.365 -7.622 1.00 1.140 C ATOM 766 OE1 GLU A 46 -0.235 3.452 -7.052 1.00 1.140 O ATOM 767 OE2 GLU A 46 0.989 2.731 -8.638 1.00 1.140 O ATOM 768 H GLU A 46 3.349 3.736 -4.399 1.00 0.900 H ATOM 769 HA GLU A 46 3.453 6.194 -5.839 1.00 1.010 H ATOM 770 1HB GLU A 46 1.055 4.435 -5.168 1.00 1.370 H ATOM 771 2HB GLU A 46 0.968 5.780 -6.284 1.00 1.370 H ATOM 772 1HG GLU A 46 2.524 4.678 -7.797 1.00 1.370 H ATOM 773 2HG GLU A 46 2.749 3.361 -6.646 1.00 1.370 H ATOM 774 N LEU A 47 1.633 6.355 -3.069 1.00 0.620 N ATOM 775 CA LEU A 47 1.060 7.268 -2.094 1.00 0.560 C ATOM 776 C LEU A 47 2.127 8.174 -1.490 1.00 0.460 C ATOM 777 O LEU A 47 1.899 9.375 -1.264 1.00 0.480 O ATOM 778 CB LEU A 47 0.415 6.450 -0.975 1.00 0.810 C ATOM 779 CG LEU A 47 -0.856 5.677 -1.291 1.00 0.810 C ATOM 780 CD1 LEU A 47 -1.102 4.718 -0.148 1.00 0.810 C ATOM 781 CD2 LEU A 47 -2.022 6.650 -1.414 1.00 0.810 C ATOM 782 H LEU A 47 1.575 5.341 -2.907 1.00 0.740 H ATOM 783 HA LEU A 47 0.321 7.885 -2.594 1.00 0.670 H ATOM 784 1HB LEU A 47 1.141 5.736 -0.612 1.00 0.970 H ATOM 785 2HB LEU A 47 0.185 7.104 -0.186 1.00 0.970 H ATOM 786 HG LEU A 47 -0.743 5.116 -2.217 1.00 0.970 H ATOM 787 1HD1 LEU A 47 -1.985 4.157 -0.309 1.00 0.970 H ATOM 788 2HD1 LEU A 47 -0.268 4.044 -0.073 1.00 0.970 H ATOM 789 3HD1 LEU A 47 -1.200 5.265 0.758 1.00 0.970 H ATOM 790 1HD2 LEU A 47 -2.924 6.106 -1.611 1.00 0.970 H ATOM 791 2HD2 LEU A 47 -2.135 7.193 -0.481 1.00 0.970 H ATOM 792 3HD2 LEU A 47 -1.849 7.349 -2.225 1.00 0.970 H ATOM 793 N ALA A 48 3.293 7.596 -1.204 1.00 0.410 N ATOM 794 CA ALA A 48 4.393 8.320 -0.605 1.00 0.390 C ATOM 795 C ALA A 48 4.850 9.452 -1.501 1.00 0.470 C ATOM 796 O ALA A 48 5.025 10.578 -1.030 1.00 0.450 O ATOM 797 CB ALA A 48 5.553 7.374 -0.353 1.00 0.550 C ATOM 798 H ALA A 48 3.395 6.595 -1.368 1.00 0.490 H ATOM 799 HA ALA A 48 4.053 8.739 0.342 1.00 0.470 H ATOM 800 1HB ALA A 48 6.370 7.915 0.108 1.00 0.660 H ATOM 801 2HB ALA A 48 5.224 6.562 0.298 1.00 0.660 H ATOM 802 3HB ALA A 48 5.886 6.966 -1.295 1.00 0.660 H ATOM 803 N TYR A 49 4.931 9.185 -2.809 1.00 0.590 N ATOM 804 CA TYR A 49 5.358 10.195 -3.766 1.00 0.730 C ATOM 805 C TYR A 49 4.285 11.257 -3.924 1.00 0.710 C ATOM 806 O TYR A 49 4.592 12.443 -4.056 1.00 0.760 O ATOM 807 CB TYR A 49 5.699 9.567 -5.121 1.00 0.970 C ATOM 808 CG TYR A 49 6.983 8.728 -5.118 1.00 0.970 C ATOM 809 CD1 TYR A 49 6.937 7.381 -5.451 1.00 0.970 C ATOM 810 CD2 TYR A 49 8.199 9.310 -4.769 1.00 0.970 C ATOM 811 CE1 TYR A 49 8.087 6.622 -5.437 1.00 0.970 C ATOM 812 CE2 TYR A 49 9.351 8.546 -4.755 1.00 0.970 C ATOM 813 CZ TYR A 49 9.294 7.206 -5.088 1.00 0.970 C ATOM 814 OH TYR A 49 10.439 6.443 -5.077 1.00 0.970 O ATOM 815 H TYR A 49 4.779 8.221 -3.121 1.00 0.710 H ATOM 816 HA TYR A 49 6.245 10.686 -3.372 1.00 0.880 H ATOM 817 1HB TYR A 49 4.872 8.917 -5.427 1.00 1.160 H ATOM 818 2HB TYR A 49 5.800 10.347 -5.870 1.00 1.160 H ATOM 819 HD1 TYR A 49 5.988 6.919 -5.725 1.00 1.160 H ATOM 820 HD2 TYR A 49 8.249 10.365 -4.506 1.00 1.160 H ATOM 821 HE1 TYR A 49 8.049 5.570 -5.702 1.00 1.160 H ATOM 822 HE2 TYR A 49 10.303 9.001 -4.481 1.00 1.160 H ATOM 823 HH TYR A 49 11.189 6.992 -4.836 1.00 1.160 H ATOM 824 N ALA A 50 3.017 10.828 -3.896 1.00 0.690 N ATOM 825 CA ALA A 50 1.873 11.723 -3.965 1.00 0.760 C ATOM 826 C ALA A 50 1.855 12.681 -2.773 1.00 0.620 C ATOM 827 O ALA A 50 1.370 13.809 -2.879 1.00 0.640 O ATOM 828 CB ALA A 50 0.576 10.930 -4.001 1.00 1.040 C ATOM 829 H ALA A 50 2.835 9.821 -3.854 1.00 0.830 H ATOM 830 HA ALA A 50 1.960 12.312 -4.876 1.00 0.910 H ATOM 831 1HB ALA A 50 -0.266 11.615 -4.077 1.00 1.240 H ATOM 832 2HB ALA A 50 0.586 10.262 -4.861 1.00 1.240 H ATOM 833 3HB ALA A 50 0.483 10.347 -3.100 1.00 1.240 H ATOM 834 N GLY A 51 2.353 12.211 -1.618 1.00 0.550 N ATOM 835 CA GLY A 51 2.350 12.988 -0.391 1.00 0.470 C ATOM 836 C GLY A 51 1.085 12.669 0.388 1.00 0.530 C ATOM 837 O GLY A 51 0.699 13.391 1.307 1.00 0.580 O ATOM 838 H GLY A 51 2.710 11.252 -1.569 1.00 0.660 H ATOM 839 1HA GLY A 51 3.232 12.734 0.200 1.00 0.560 H ATOM 840 2HA GLY A 51 2.396 14.050 -0.623 1.00 0.560 H ATOM 841 N ALA A 52 0.415 11.596 -0.044 1.00 0.570 N ATOM 842 CA ALA A 52 -0.825 11.097 0.522 1.00 0.650 C ATOM 843 C ALA A 52 -0.706 10.643 1.977 1.00 0.610 C ATOM 844 O ALA A 52 -1.682 10.729 2.720 1.00 0.720 O ATOM 845 CB ALA A 52 -1.330 9.953 -0.321 1.00 0.880 C ATOM 846 H ALA A 52 0.842 11.050 -0.792 1.00 0.680 H ATOM 847 HA ALA A 52 -1.551 11.908 0.487 1.00 0.780 H ATOM 848 1HB ALA A 52 -2.283 9.605 0.074 1.00 1.050 H ATOM 849 2HB ALA A 52 -1.457 10.284 -1.350 1.00 1.050 H ATOM 850 3HB ALA A 52 -0.612 9.168 -0.282 1.00 1.050 H ATOM 851 N ILE A 53 0.449 10.100 2.379 1.00 0.500 N ATOM 852 CA ILE A 53 0.588 9.606 3.744 1.00 0.510 C ATOM 853 C ILE A 53 1.438 10.543 4.611 1.00 0.530 C ATOM 854 O ILE A 53 2.620 10.752 4.315 1.00 0.460 O ATOM 855 CB ILE A 53 1.210 8.198 3.763 1.00 0.710 C ATOM 856 CG1 ILE A 53 0.389 7.229 2.873 1.00 0.710 C ATOM 857 CG2 ILE A 53 1.303 7.673 5.195 1.00 0.710 C ATOM 858 CD1 ILE A 53 -1.092 7.041 3.256 1.00 0.710 C ATOM 859 H ILE A 53 1.230 10.035 1.740 1.00 0.600 H ATOM 860 HA ILE A 53 -0.394 9.501 4.158 1.00 0.610 H ATOM 861 HB ILE A 53 2.210 8.249 3.335 1.00 0.850 H ATOM 862 1HG1 ILE A 53 0.429 7.605 1.878 1.00 0.850 H ATOM 863 2HG1 ILE A 53 0.872 6.251 2.892 1.00 0.850 H ATOM 864 1HG2 ILE A 53 1.758 6.700 5.173 1.00 0.850 H ATOM 865 2HG2 ILE A 53 1.909 8.337 5.805 1.00 0.850 H ATOM 866 3HG2 ILE A 53 0.320 7.605 5.643 1.00 0.850 H ATOM 867 1HD1 ILE A 53 -1.563 6.362 2.576 1.00 0.850 H ATOM 868 2HD1 ILE A 53 -1.176 6.632 4.258 1.00 0.850 H ATOM 869 3HD1 ILE A 53 -1.626 7.983 3.207 1.00 0.850 H ATOM 870 N PRO A 54 0.872 11.124 5.685 1.00 0.680 N ATOM 871 CA PRO A 54 1.543 12.037 6.578 1.00 0.750 C ATOM 872 C PRO A 54 2.780 11.404 7.163 1.00 0.740 C ATOM 873 O PRO A 54 2.782 10.218 7.492 1.00 0.740 O ATOM 874 CB PRO A 54 0.495 12.276 7.673 1.00 1.120 C ATOM 875 CG PRO A 54 -0.824 12.042 6.995 1.00 1.120 C ATOM 876 CD PRO A 54 -0.566 10.927 6.013 1.00 1.120 C ATOM 877 HA PRO A 54 1.785 12.965 6.038 1.00 0.900 H ATOM 878 1HB PRO A 54 0.672 11.590 8.516 1.00 1.350 H ATOM 879 2HB PRO A 54 0.594 13.297 8.069 1.00 1.350 H ATOM 880 1HG PRO A 54 -1.591 11.778 7.740 1.00 1.350 H ATOM 881 2HG PRO A 54 -1.166 12.963 6.502 1.00 1.350 H ATOM 882 1HD PRO A 54 -0.744 9.938 6.462 1.00 1.350 H ATOM 883 2HD PRO A 54 -1.217 11.139 5.150 1.00 1.350 H ATOM 884 N GLY A 55 3.829 12.199 7.295 1.00 0.760 N ATOM 885 CA GLY A 55 5.074 11.730 7.880 1.00 0.820 C ATOM 886 C GLY A 55 6.001 11.006 6.906 1.00 0.730 C ATOM 887 O GLY A 55 7.166 10.772 7.230 1.00 0.820 O ATOM 888 H GLY A 55 3.762 13.160 6.994 1.00 0.910 H ATOM 889 1HA GLY A 55 5.604 12.580 8.310 1.00 0.980 H ATOM 890 2HA GLY A 55 4.843 11.062 8.708 1.00 0.980 H ATOM 891 N VAL A 56 5.514 10.635 5.722 1.00 0.590 N ATOM 892 CA VAL A 56 6.367 9.888 4.818 1.00 0.560 C ATOM 893 C VAL A 56 7.168 10.807 3.907 1.00 0.600 C ATOM 894 O VAL A 56 6.618 11.545 3.091 1.00 0.680 O ATOM 895 CB VAL A 56 5.504 8.910 4.011 1.00 0.800 C ATOM 896 CG1 VAL A 56 6.345 8.136 3.020 1.00 0.800 C ATOM 897 CG2 VAL A 56 4.804 7.967 4.989 1.00 0.800 C ATOM 898 H VAL A 56 4.550 10.852 5.434 1.00 0.710 H ATOM 899 HA VAL A 56 7.067 9.304 5.415 1.00 0.670 H ATOM 900 HB VAL A 56 4.755 9.472 3.448 1.00 0.960 H ATOM 901 1HG1 VAL A 56 5.700 7.465 2.476 1.00 0.960 H ATOM 902 2HG1 VAL A 56 6.826 8.822 2.322 1.00 0.960 H ATOM 903 3HG1 VAL A 56 7.106 7.563 3.548 1.00 0.960 H ATOM 904 1HG2 VAL A 56 4.169 7.287 4.445 1.00 0.960 H ATOM 905 2HG2 VAL A 56 5.545 7.407 5.552 1.00 0.960 H ATOM 906 3HG2 VAL A 56 4.198 8.550 5.678 1.00 0.960 H ATOM 907 N LYS A 57 8.489 10.712 4.012 1.00 0.650 N ATOM 908 CA LYS A 57 9.399 11.558 3.251 1.00 0.720 C ATOM 909 C LYS A 57 10.433 10.735 2.496 1.00 0.730 C ATOM 910 O LYS A 57 10.805 9.645 2.932 1.00 0.800 O ATOM 911 CB LYS A 57 10.130 12.524 4.192 1.00 0.980 C ATOM 912 CG LYS A 57 9.235 13.479 5.013 1.00 0.980 C ATOM 913 CD LYS A 57 8.557 14.536 4.141 1.00 0.980 C ATOM 914 CE LYS A 57 7.767 15.526 4.984 1.00 0.980 C ATOM 915 NZ LYS A 57 7.062 16.542 4.140 1.00 0.980 N ATOM 916 H LYS A 57 8.869 10.059 4.685 1.00 0.780 H ATOM 917 HA LYS A 57 8.826 12.119 2.516 1.00 0.860 H ATOM 918 1HB LYS A 57 10.725 11.947 4.899 1.00 1.180 H ATOM 919 2HB LYS A 57 10.827 13.131 3.611 1.00 1.180 H ATOM 920 1HG LYS A 57 8.467 12.900 5.531 1.00 1.180 H ATOM 921 2HG LYS A 57 9.845 13.979 5.763 1.00 1.180 H ATOM 922 1HD LYS A 57 9.306 15.073 3.559 1.00 1.180 H ATOM 923 2HD LYS A 57 7.863 14.050 3.456 1.00 1.180 H ATOM 924 1HE LYS A 57 7.028 14.979 5.570 1.00 1.180 H ATOM 925 2HE LYS A 57 8.447 16.041 5.662 1.00 1.180 H ATOM 926 1HZ LYS A 57 6.549 17.179 4.735 1.00 1.180 H ATOM 927 2HZ LYS A 57 7.740 17.062 3.599 1.00 1.180 H ATOM 928 3HZ LYS A 57 6.420 16.074 3.514 1.00 1.180 H ATOM 929 N LYS A 58 10.892 11.270 1.364 1.00 0.760 N ATOM 930 CA LYS A 58 11.955 10.664 0.564 1.00 0.810 C ATOM 931 C LYS A 58 13.280 10.682 1.348 1.00 1.130 C ATOM 932 O LYS A 58 13.617 11.675 1.993 1.00 1.690 O ATOM 933 CB LYS A 58 12.095 11.395 -0.780 1.00 1.110 C ATOM 934 CG LYS A 58 13.049 10.735 -1.790 1.00 1.110 C ATOM 935 CD LYS A 58 13.120 11.527 -3.115 1.00 1.110 C ATOM 936 CE LYS A 58 14.166 10.926 -4.067 1.00 1.110 C ATOM 937 NZ LYS A 58 14.331 11.729 -5.319 1.00 1.110 N ATOM 938 H LYS A 58 10.505 12.153 1.064 1.00 0.910 H ATOM 939 HA LYS A 58 11.695 9.624 0.370 1.00 0.970 H ATOM 940 1HB LYS A 58 11.118 11.487 -1.250 1.00 1.340 H ATOM 941 2HB LYS A 58 12.471 12.406 -0.601 1.00 1.340 H ATOM 942 1HG LYS A 58 14.042 10.675 -1.377 1.00 1.340 H ATOM 943 2HG LYS A 58 12.703 9.725 -2.001 1.00 1.340 H ATOM 944 1HD LYS A 58 12.145 11.532 -3.603 1.00 1.340 H ATOM 945 2HD LYS A 58 13.412 12.561 -2.903 1.00 1.340 H ATOM 946 1HE LYS A 58 15.130 10.886 -3.551 1.00 1.340 H ATOM 947 2HE LYS A 58 13.863 9.916 -4.333 1.00 1.340 H ATOM 948 1HZ LYS A 58 15.032 11.303 -5.898 1.00 1.340 H ATOM 949 2HZ LYS A 58 13.465 11.783 -5.820 1.00 1.340 H ATOM 950 3HZ LYS A 58 14.645 12.684 -5.074 1.00 1.340 H ATOM 951 N ALA A 59 14.035 9.581 1.266 1.00 1.240 N ATOM 952 CA ALA A 59 15.337 9.390 1.944 1.00 1.910 C ATOM 953 C ALA A 59 16.437 10.395 1.566 1.00 2.550 C ATOM 954 O ALA A 59 17.319 10.695 2.374 1.00 3.200 O ATOM 955 CB ALA A 59 15.854 7.993 1.655 1.00 2.410 C ATOM 956 H ALA A 59 13.671 8.815 0.717 1.00 1.490 H ATOM 957 HA ALA A 59 15.159 9.488 3.015 1.00 2.290 H ATOM 958 1HB ALA A 59 16.785 7.833 2.200 1.00 2.890 H ATOM 959 2HB ALA A 59 15.115 7.258 1.973 1.00 2.890 H ATOM 960 3HB ALA A 59 16.038 7.889 0.587 1.00 2.890 H ATOM 961 N SER A 60 16.416 10.871 0.334 1.00 2.900 N ATOM 962 CA SER A 60 17.413 11.790 -0.180 1.00 3.720 C ATOM 963 C SER A 60 16.732 12.734 -1.157 1.00 4.420 C ATOM 964 O SER A 60 15.516 12.674 -1.320 1.00 4.850 O ATOM 965 CB SER A 60 18.541 11.027 -0.845 1.00 4.880 C ATOM 966 OG SER A 60 18.108 10.402 -2.021 1.00 4.880 O ATOM 967 H SER A 60 15.694 10.580 -0.303 1.00 3.480 H ATOM 968 HA SER A 60 17.816 12.379 0.645 1.00 4.460 H ATOM 969 1HB SER A 60 19.360 11.707 -1.073 1.00 5.860 H ATOM 970 2HB SER A 60 18.924 10.278 -0.153 1.00 5.860 H ATOM 971 HG SER A 60 18.870 9.927 -2.365 1.00 5.860 H ATOM 972 N TRP A 61 17.488 13.645 -1.749 1.00 4.830 N ATOM 973 CA TRP A 61 16.899 14.590 -2.684 1.00 5.780 C ATOM 974 C TRP A 61 16.601 13.901 -4.009 1.00 6.100 C ATOM 975 O TRP A 61 15.525 14.085 -4.586 1.00 6.960 O ATOM 976 OXT TRP A 61 17.404 13.090 -4.470 1.00 8.670 O ATOM 977 CB TRP A 61 17.830 15.778 -2.905 1.00 7.230 C ATOM 978 CG TRP A 61 17.936 16.659 -1.710 1.00 7.230 C ATOM 979 CD1 TRP A 61 18.969 16.726 -0.824 1.00 7.230 C ATOM 980 CD2 TRP A 61 16.951 17.607 -1.250 1.00 7.230 C ATOM 981 NE1 TRP A 61 18.696 17.652 0.148 1.00 7.230 N ATOM 982 CE2 TRP A 61 17.463 18.199 -0.096 1.00 7.230 C ATOM 983 CE3 TRP A 61 15.690 17.994 -1.718 1.00 7.230 C ATOM 984 CZ2 TRP A 61 16.763 19.165 0.602 1.00 7.230 C ATOM 985 CZ3 TRP A 61 14.987 18.960 -1.017 1.00 7.230 C ATOM 986 CH2 TRP A 61 15.510 19.531 0.114 1.00 7.230 C ATOM 987 H TRP A 61 18.480 13.662 -1.570 1.00 5.800 H ATOM 988 HA TRP A 61 15.963 14.955 -2.263 1.00 6.940 H ATOM 989 1HB TRP A 61 18.826 15.420 -3.161 1.00 8.680 H ATOM 990 2HB TRP A 61 17.470 16.374 -3.742 1.00 8.680 H ATOM 991 HD1 TRP A 61 19.880 16.134 -0.880 1.00 8.680 H ATOM 992 HE1 TRP A 61 19.301 17.892 0.921 1.00 8.680 H ATOM 993 HE3 TRP A 61 15.270 17.542 -2.616 1.00 8.680 H ATOM 994 HZ2 TRP A 61 17.161 19.630 1.504 1.00 8.680 H ATOM 995 HZ3 TRP A 61 14.006 19.255 -1.388 1.00 8.680 H ATOM 996 HH2 TRP A 61 14.932 20.289 0.641 1.00 8.680 H TER 997 ENDMDL REMARK ID 14032 MODEL 5 SSGCID - MygeA.18852.a 30S ribosomal protein S14 type Z MG_164 PFRMAT TS TARGET SSGCID - MygeA.18852.a 30S ribosomal protein S14 type Z MG_164 AUTHOR BAKER-ROSETTASERVER METHOD ROSETTA provides both ab initio and METHOD comparative models of protein domains. METHOD Comparative models are built from structures METHOD detected and aligned by HHSEARCH, SPARKS, and METHOD Raptor. Loop regions are assembled from fragments and METHOD optimized to fit the aligned template structures. METHOD De novo models are built using the Rosetta de METHOD novo protocol. The procedure is fully automated. MODEL 5 PARENT 3j9mAK_305 REMARK PARENT 3j9mAK_305 REMARK PARSRC alignment REMARK SCORE 0.81 ATOM 1 N MET A 1 -5.531 -13.904 -8.613 1.00 5.570 N ATOM 2 CA MET A 1 -5.358 -12.851 -9.606 1.00 5.010 C ATOM 3 C MET A 1 -6.503 -11.855 -9.598 1.00 3.800 C ATOM 4 O MET A 1 -6.286 -10.654 -9.751 1.00 3.460 O ATOM 5 CB MET A 1 -5.211 -13.449 -11.007 1.00 7.240 C ATOM 6 CG MET A 1 -3.926 -14.265 -11.243 1.00 7.240 C ATOM 7 SD MET A 1 -2.403 -13.322 -10.944 1.00 7.240 S ATOM 8 CE MET A 1 -2.399 -12.131 -12.288 1.00 7.240 C ATOM 9 1H MET A 1 -4.654 -14.046 -8.133 1.00 6.680 H ATOM 10 2H MET A 1 -6.235 -13.642 -7.937 1.00 6.680 H ATOM 11 3H MET A 1 -5.804 -14.762 -9.068 1.00 6.680 H ATOM 12 HA MET A 1 -4.452 -12.298 -9.361 1.00 6.010 H ATOM 13 1HB MET A 1 -6.053 -14.113 -11.200 1.00 8.690 H ATOM 14 2HB MET A 1 -5.263 -12.656 -11.747 1.00 8.690 H ATOM 15 1HG MET A 1 -3.916 -15.145 -10.602 1.00 8.690 H ATOM 16 2HG MET A 1 -3.911 -14.609 -12.279 1.00 8.690 H ATOM 17 1HE MET A 1 -1.508 -11.506 -12.213 1.00 8.690 H ATOM 18 2HE MET A 1 -2.391 -12.658 -13.243 1.00 8.690 H ATOM 19 3HE MET A 1 -3.282 -11.498 -12.228 1.00 8.690 H ATOM 20 N ALA A 2 -7.735 -12.339 -9.442 1.00 3.550 N ATOM 21 CA ALA A 2 -8.853 -11.416 -9.441 1.00 2.710 C ATOM 22 C ALA A 2 -8.704 -10.402 -8.340 1.00 1.920 C ATOM 23 O ALA A 2 -8.441 -10.757 -7.185 1.00 2.220 O ATOM 24 CB ALA A 2 -10.161 -12.164 -9.252 1.00 4.130 C ATOM 25 H ALA A 2 -7.911 -13.326 -9.336 1.00 4.260 H ATOM 26 HA ALA A 2 -8.864 -10.889 -10.397 1.00 3.250 H ATOM 27 1HB ALA A 2 -10.989 -11.457 -9.269 1.00 4.960 H ATOM 28 2HB ALA A 2 -10.286 -12.886 -10.056 1.00 4.960 H ATOM 29 3HB ALA A 2 -10.151 -12.685 -8.297 1.00 4.960 H ATOM 30 N LYS A 3 -8.956 -9.150 -8.671 1.00 1.310 N ATOM 31 CA LYS A 3 -8.869 -8.145 -7.654 1.00 1.160 C ATOM 32 C LYS A 3 -9.921 -8.366 -6.603 1.00 0.980 C ATOM 33 O LYS A 3 -9.651 -8.178 -5.426 1.00 1.010 O ATOM 34 CB LYS A 3 -8.950 -6.746 -8.234 1.00 1.680 C ATOM 35 CG LYS A 3 -7.712 -6.368 -9.023 1.00 1.680 C ATOM 36 CD LYS A 3 -7.788 -4.954 -9.534 1.00 1.680 C ATOM 37 CE LYS A 3 -6.550 -4.590 -10.343 1.00 1.680 C ATOM 38 NZ LYS A 3 -6.561 -3.168 -10.737 1.00 1.680 N ATOM 39 H LYS A 3 -9.162 -8.909 -9.631 1.00 1.570 H ATOM 40 HA LYS A 3 -7.899 -8.237 -7.168 1.00 1.390 H ATOM 41 1HB LYS A 3 -9.819 -6.663 -8.884 1.00 2.020 H ATOM 42 2HB LYS A 3 -9.066 -6.029 -7.428 1.00 2.020 H ATOM 43 1HG LYS A 3 -6.837 -6.466 -8.377 1.00 2.020 H ATOM 44 2HG LYS A 3 -7.593 -7.051 -9.863 1.00 2.020 H ATOM 45 1HD LYS A 3 -8.670 -4.837 -10.163 1.00 2.020 H ATOM 46 2HD LYS A 3 -7.870 -4.269 -8.691 1.00 2.020 H ATOM 47 1HE LYS A 3 -5.657 -4.782 -9.749 1.00 2.020 H ATOM 48 2HE LYS A 3 -6.520 -5.204 -11.241 1.00 2.020 H ATOM 49 1HZ LYS A 3 -5.733 -2.953 -11.265 1.00 2.020 H ATOM 50 2HZ LYS A 3 -7.379 -2.960 -11.287 1.00 2.020 H ATOM 51 3HZ LYS A 3 -6.568 -2.618 -9.851 1.00 2.020 H ATOM 52 N LYS A 4 -11.122 -8.793 -6.997 1.00 0.940 N ATOM 53 CA LYS A 4 -12.164 -8.981 -5.998 1.00 0.940 C ATOM 54 C LYS A 4 -11.726 -9.942 -4.909 1.00 0.820 C ATOM 55 O LYS A 4 -11.911 -9.657 -3.725 1.00 0.790 O ATOM 56 CB LYS A 4 -13.460 -9.490 -6.626 1.00 1.320 C ATOM 57 CG LYS A 4 -14.603 -9.675 -5.614 1.00 1.320 C ATOM 58 CD LYS A 4 -15.889 -10.132 -6.288 1.00 1.320 C ATOM 59 CE LYS A 4 -16.998 -10.357 -5.263 1.00 1.320 C ATOM 60 NZ LYS A 4 -18.268 -10.806 -5.903 1.00 1.320 N ATOM 61 H LYS A 4 -11.308 -8.940 -7.977 1.00 1.130 H ATOM 62 HA LYS A 4 -12.365 -8.018 -5.527 1.00 1.130 H ATOM 63 1HB LYS A 4 -13.792 -8.791 -7.392 1.00 1.580 H ATOM 64 2HB LYS A 4 -13.278 -10.450 -7.109 1.00 1.580 H ATOM 65 1HG LYS A 4 -14.319 -10.423 -4.869 1.00 1.580 H ATOM 66 2HG LYS A 4 -14.782 -8.732 -5.098 1.00 1.580 H ATOM 67 1HD LYS A 4 -16.215 -9.377 -7.005 1.00 1.580 H ATOM 68 2HD LYS A 4 -15.708 -11.064 -6.822 1.00 1.580 H ATOM 69 1HE LYS A 4 -16.674 -11.113 -4.549 1.00 1.580 H ATOM 70 2HE LYS A 4 -17.183 -9.425 -4.728 1.00 1.580 H ATOM 71 1HZ LYS A 4 -18.974 -10.943 -5.192 1.00 1.580 H ATOM 72 2HZ LYS A 4 -18.584 -10.105 -6.559 1.00 1.580 H ATOM 73 3HZ LYS A 4 -18.112 -11.676 -6.392 1.00 1.580 H ATOM 74 N SER A 5 -11.150 -11.078 -5.299 1.00 0.840 N ATOM 75 CA SER A 5 -10.726 -12.070 -4.332 1.00 0.850 C ATOM 76 C SER A 5 -9.657 -11.502 -3.420 1.00 0.750 C ATOM 77 O SER A 5 -9.691 -11.714 -2.203 1.00 0.790 O ATOM 78 CB SER A 5 -10.169 -13.287 -5.050 1.00 1.190 C ATOM 79 OG SER A 5 -11.160 -13.947 -5.796 1.00 1.190 O ATOM 80 H SER A 5 -11.037 -11.270 -6.284 1.00 1.010 H ATOM 81 HA SER A 5 -11.585 -12.361 -3.729 1.00 1.020 H ATOM 82 1HB SER A 5 -9.360 -12.972 -5.714 1.00 1.420 H ATOM 83 2HB SER A 5 -9.744 -13.971 -4.319 1.00 1.420 H ATOM 84 HG SER A 5 -10.736 -14.724 -6.168 1.00 1.420 H ATOM 85 N LEU A 6 -8.720 -10.751 -4.000 1.00 0.750 N ATOM 86 CA LEU A 6 -7.652 -10.168 -3.212 1.00 0.780 C ATOM 87 C LEU A 6 -8.194 -9.137 -2.220 1.00 0.700 C ATOM 88 O LEU A 6 -7.778 -9.124 -1.057 1.00 0.750 O ATOM 89 CB LEU A 6 -6.644 -9.527 -4.174 1.00 1.080 C ATOM 90 CG LEU A 6 -5.844 -10.523 -5.097 1.00 1.080 C ATOM 91 CD1 LEU A 6 -5.087 -9.731 -6.164 1.00 1.080 C ATOM 92 CD2 LEU A 6 -4.871 -11.360 -4.271 1.00 1.080 C ATOM 93 H LEU A 6 -8.725 -10.634 -5.022 1.00 0.900 H ATOM 94 HA LEU A 6 -7.176 -10.956 -2.641 1.00 0.940 H ATOM 95 1HB LEU A 6 -7.182 -8.839 -4.820 1.00 1.300 H ATOM 96 2HB LEU A 6 -5.936 -8.958 -3.594 1.00 1.300 H ATOM 97 HG LEU A 6 -6.545 -11.184 -5.601 1.00 1.300 H ATOM 98 1HD1 LEU A 6 -4.552 -10.419 -6.817 1.00 1.300 H ATOM 99 2HD1 LEU A 6 -5.793 -9.156 -6.760 1.00 1.300 H ATOM 100 3HD1 LEU A 6 -4.382 -9.057 -5.693 1.00 1.300 H ATOM 101 1HD2 LEU A 6 -4.334 -12.038 -4.933 1.00 1.300 H ATOM 102 2HD2 LEU A 6 -4.166 -10.710 -3.777 1.00 1.300 H ATOM 103 3HD2 LEU A 6 -5.403 -11.943 -3.529 1.00 1.300 H ATOM 104 N LYS A 7 -9.151 -8.308 -2.660 1.00 0.690 N ATOM 105 CA LYS A 7 -9.757 -7.296 -1.802 1.00 0.800 C ATOM 106 C LYS A 7 -10.506 -7.946 -0.642 1.00 0.770 C ATOM 107 O LYS A 7 -10.453 -7.460 0.484 1.00 0.910 O ATOM 108 CB LYS A 7 -10.692 -6.374 -2.601 1.00 1.080 C ATOM 109 CG LYS A 7 -9.978 -5.381 -3.578 1.00 1.080 C ATOM 110 CD LYS A 7 -11.001 -4.534 -4.364 1.00 1.080 C ATOM 111 CE LYS A 7 -10.326 -3.592 -5.384 1.00 1.080 C ATOM 112 NZ LYS A 7 -11.336 -2.809 -6.183 1.00 1.080 N ATOM 113 H LYS A 7 -9.429 -8.360 -3.641 1.00 0.830 H ATOM 114 HA LYS A 7 -8.960 -6.685 -1.381 1.00 0.960 H ATOM 115 1HB LYS A 7 -11.368 -6.992 -3.197 1.00 1.290 H ATOM 116 2HB LYS A 7 -11.302 -5.794 -1.912 1.00 1.290 H ATOM 117 1HG LYS A 7 -9.332 -4.715 -3.003 1.00 1.290 H ATOM 118 2HG LYS A 7 -9.358 -5.939 -4.275 1.00 1.290 H ATOM 119 1HD LYS A 7 -11.676 -5.204 -4.901 1.00 1.290 H ATOM 120 2HD LYS A 7 -11.589 -3.936 -3.669 1.00 1.290 H ATOM 121 1HE LYS A 7 -9.670 -2.894 -4.862 1.00 1.290 H ATOM 122 2HE LYS A 7 -9.728 -4.189 -6.068 1.00 1.290 H ATOM 123 1HZ LYS A 7 -10.858 -2.215 -6.859 1.00 1.290 H ATOM 124 2HZ LYS A 7 -11.941 -3.445 -6.679 1.00 1.290 H ATOM 125 3HZ LYS A 7 -11.891 -2.234 -5.563 1.00 1.290 H ATOM 126 N VAL A 8 -11.193 -9.058 -0.901 1.00 0.690 N ATOM 127 CA VAL A 8 -11.892 -9.755 0.172 1.00 0.750 C ATOM 128 C VAL A 8 -10.910 -10.364 1.170 1.00 0.700 C ATOM 129 O VAL A 8 -11.070 -10.205 2.381 1.00 0.780 O ATOM 130 CB VAL A 8 -12.822 -10.855 -0.385 1.00 1.030 C ATOM 131 CG1 VAL A 8 -13.402 -11.714 0.771 1.00 1.030 C ATOM 132 CG2 VAL A 8 -13.967 -10.197 -1.165 1.00 1.030 C ATOM 133 H VAL A 8 -11.260 -9.380 -1.872 1.00 0.830 H ATOM 134 HA VAL A 8 -12.508 -9.029 0.699 1.00 0.900 H ATOM 135 HB VAL A 8 -12.250 -11.508 -1.049 1.00 1.230 H ATOM 136 1HG1 VAL A 8 -14.055 -12.480 0.357 1.00 1.230 H ATOM 137 2HG1 VAL A 8 -12.602 -12.200 1.329 1.00 1.230 H ATOM 138 3HG1 VAL A 8 -13.973 -11.076 1.445 1.00 1.230 H ATOM 139 1HG2 VAL A 8 -14.621 -10.966 -1.573 1.00 1.230 H ATOM 140 2HG2 VAL A 8 -14.534 -9.552 -0.496 1.00 1.230 H ATOM 141 3HG2 VAL A 8 -13.568 -9.602 -1.974 1.00 1.230 H ATOM 142 N LYS A 9 -9.880 -11.063 0.676 1.00 0.660 N ATOM 143 CA LYS A 9 -8.893 -11.691 1.555 1.00 0.740 C ATOM 144 C LYS A 9 -8.208 -10.655 2.432 1.00 0.760 C ATOM 145 O LYS A 9 -7.940 -10.892 3.610 1.00 0.830 O ATOM 146 CB LYS A 9 -7.853 -12.463 0.744 1.00 1.000 C ATOM 147 CG LYS A 9 -8.372 -13.748 0.106 1.00 1.000 C ATOM 148 CD LYS A 9 -7.286 -14.435 -0.716 1.00 1.000 C ATOM 149 CE LYS A 9 -7.800 -15.716 -1.365 1.00 1.000 C ATOM 150 NZ LYS A 9 -6.746 -16.392 -2.180 1.00 1.000 N ATOM 151 H LYS A 9 -9.790 -11.172 -0.339 1.00 0.790 H ATOM 152 HA LYS A 9 -9.412 -12.392 2.208 1.00 0.890 H ATOM 153 1HB LYS A 9 -7.485 -11.822 -0.061 1.00 1.200 H ATOM 154 2HB LYS A 9 -7.005 -12.713 1.380 1.00 1.200 H ATOM 155 1HG LYS A 9 -8.706 -14.425 0.892 1.00 1.200 H ATOM 156 2HG LYS A 9 -9.222 -13.521 -0.531 1.00 1.200 H ATOM 157 1HD LYS A 9 -6.947 -13.754 -1.500 1.00 1.200 H ATOM 158 2HD LYS A 9 -6.439 -14.676 -0.075 1.00 1.200 H ATOM 159 1HE LYS A 9 -8.139 -16.399 -0.588 1.00 1.200 H ATOM 160 2HE LYS A 9 -8.643 -15.470 -2.012 1.00 1.200 H ATOM 161 1HZ LYS A 9 -7.126 -17.233 -2.593 1.00 1.200 H ATOM 162 2HZ LYS A 9 -6.432 -15.770 -2.912 1.00 1.200 H ATOM 163 3HZ LYS A 9 -5.964 -16.634 -1.588 1.00 1.200 H ATOM 164 N GLN A 10 -7.998 -9.475 1.872 1.00 0.760 N ATOM 165 CA GLN A 10 -7.381 -8.339 2.528 1.00 0.880 C ATOM 166 C GLN A 10 -8.104 -7.909 3.798 1.00 0.930 C ATOM 167 O GLN A 10 -7.484 -7.354 4.708 1.00 1.100 O ATOM 168 CB GLN A 10 -7.335 -7.173 1.538 1.00 1.180 C ATOM 169 CG GLN A 10 -6.698 -5.936 2.005 1.00 1.180 C ATOM 170 CD GLN A 10 -5.311 -6.126 2.322 1.00 1.180 C ATOM 171 OE1 GLN A 10 -4.542 -6.815 1.615 1.00 1.180 O ATOM 172 NE2 GLN A 10 -4.938 -5.500 3.404 1.00 1.180 N ATOM 173 H GLN A 10 -8.218 -9.371 0.876 1.00 0.910 H ATOM 174 HA GLN A 10 -6.364 -8.618 2.796 1.00 1.060 H ATOM 175 1HB GLN A 10 -6.841 -7.496 0.629 1.00 1.420 H ATOM 176 2HB GLN A 10 -8.330 -6.900 1.277 1.00 1.420 H ATOM 177 1HG GLN A 10 -6.772 -5.190 1.226 1.00 1.420 H ATOM 178 2HG GLN A 10 -7.207 -5.576 2.896 1.00 1.420 H ATOM 179 1HE2 GLN A 10 -3.982 -5.556 3.707 1.00 1.420 H ATOM 180 2HE2 GLN A 10 -5.597 -4.977 3.943 1.00 1.420 H ATOM 181 N SER A 11 -9.413 -8.119 3.874 1.00 0.870 N ATOM 182 CA SER A 11 -10.179 -7.688 5.029 1.00 1.010 C ATOM 183 C SER A 11 -10.212 -8.738 6.137 1.00 1.030 C ATOM 184 O SER A 11 -10.812 -8.505 7.189 1.00 1.170 O ATOM 185 CB SER A 11 -11.608 -7.359 4.627 1.00 1.360 C ATOM 186 OG SER A 11 -11.665 -6.260 3.756 1.00 1.360 O ATOM 187 H SER A 11 -9.924 -8.624 3.144 1.00 1.040 H ATOM 188 HA SER A 11 -9.714 -6.788 5.426 1.00 1.210 H ATOM 189 1HB SER A 11 -12.046 -8.234 4.137 1.00 1.630 H ATOM 190 2HB SER A 11 -12.197 -7.154 5.517 1.00 1.630 H ATOM 191 HG SER A 11 -12.596 -6.117 3.574 1.00 1.630 H ATOM 192 N ARG A 12 -9.606 -9.909 5.898 1.00 0.970 N ATOM 193 CA ARG A 12 -9.642 -11.026 6.839 1.00 1.100 C ATOM 194 C ARG A 12 -8.306 -11.611 7.435 1.00 1.160 C ATOM 195 O ARG A 12 -8.378 -12.655 8.100 1.00 1.630 O ATOM 196 CB ARG A 12 -10.342 -12.172 6.118 1.00 1.490 C ATOM 197 CG ARG A 12 -11.768 -11.866 5.668 1.00 1.490 C ATOM 198 CD ARG A 12 -12.367 -12.986 4.906 1.00 1.490 C ATOM 199 NE ARG A 12 -13.719 -12.665 4.462 1.00 1.490 N ATOM 200 CZ ARG A 12 -14.513 -13.473 3.727 1.00 1.490 C ATOM 201 NH1 ARG A 12 -14.088 -14.660 3.343 1.00 1.490 N ATOM 202 NH2 ARG A 12 -15.728 -13.066 3.391 1.00 1.490 N ATOM 203 H ARG A 12 -9.106 -10.044 5.014 1.00 1.160 H ATOM 204 HA ARG A 12 -10.263 -10.714 7.676 1.00 1.320 H ATOM 205 1HB ARG A 12 -9.768 -12.433 5.224 1.00 1.790 H ATOM 206 2HB ARG A 12 -10.373 -13.050 6.759 1.00 1.790 H ATOM 207 1HG ARG A 12 -12.391 -11.661 6.538 1.00 1.790 H ATOM 208 2HG ARG A 12 -11.765 -10.996 5.011 1.00 1.790 H ATOM 209 1HD ARG A 12 -11.753 -13.178 4.022 1.00 1.790 H ATOM 210 2HD ARG A 12 -12.406 -13.874 5.532 1.00 1.790 H ATOM 211 HE ARG A 12 -14.092 -11.764 4.733 1.00 1.790 H ATOM 212 1HH1 ARG A 12 -13.164 -14.975 3.595 1.00 1.790 H ATOM 213 2HH1 ARG A 12 -14.687 -15.259 2.793 1.00 1.790 H ATOM 214 1HH2 ARG A 12 -16.056 -12.156 3.686 1.00 1.790 H ATOM 215 2HH2 ARG A 12 -16.329 -13.663 2.842 1.00 1.790 H ATOM 216 N PRO A 13 -7.091 -11.007 7.309 1.00 1.650 N ATOM 217 CA PRO A 13 -5.809 -11.605 7.710 1.00 1.910 C ATOM 218 C PRO A 13 -5.538 -11.622 9.209 1.00 1.610 C ATOM 219 O PRO A 13 -4.628 -10.947 9.682 1.00 2.120 O ATOM 220 CB PRO A 13 -4.798 -10.686 7.014 1.00 2.860 C ATOM 221 CG PRO A 13 -5.470 -9.338 7.021 1.00 2.860 C ATOM 222 CD PRO A 13 -6.944 -9.642 6.790 1.00 2.860 C ATOM 223 HA PRO A 13 -5.751 -12.623 7.298 1.00 2.290 H ATOM 224 1HB PRO A 13 -3.831 -10.690 7.544 1.00 3.440 H ATOM 225 2HB PRO A 13 -4.598 -11.050 5.995 1.00 3.440 H ATOM 226 1HG PRO A 13 -5.272 -8.820 7.980 1.00 3.440 H ATOM 227 2HG PRO A 13 -5.048 -8.692 6.226 1.00 3.440 H ATOM 228 1HD PRO A 13 -7.573 -8.921 7.333 1.00 3.440 H ATOM 229 2HD PRO A 13 -7.091 -9.633 5.717 1.00 3.440 H ATOM 230 N ASN A 14 -6.309 -12.404 9.951 1.00 1.900 N ATOM 231 CA ASN A 14 -6.131 -12.428 11.399 1.00 2.480 C ATOM 232 C ASN A 14 -5.939 -13.834 11.961 1.00 2.760 C ATOM 233 O ASN A 14 -6.666 -14.269 12.855 1.00 3.200 O ATOM 234 CB ASN A 14 -7.314 -11.756 12.066 1.00 3.240 C ATOM 235 CG ASN A 14 -7.456 -10.313 11.662 1.00 3.240 C ATOM 236 OD1 ASN A 14 -6.669 -9.449 12.069 1.00 3.240 O ATOM 237 ND2 ASN A 14 -8.462 -10.031 10.872 1.00 3.240 N ATOM 238 H ASN A 14 -7.054 -12.926 9.484 1.00 2.280 H ATOM 239 HA ASN A 14 -5.233 -11.862 11.646 1.00 2.980 H ATOM 240 1HB ASN A 14 -8.229 -12.288 11.800 1.00 3.890 H ATOM 241 2HB ASN A 14 -7.204 -11.810 13.148 1.00 3.890 H ATOM 242 1HD2 ASN A 14 -8.614 -9.090 10.570 1.00 3.890 H ATOM 243 2HD2 ASN A 14 -9.088 -10.756 10.583 1.00 3.890 H ATOM 244 N LYS A 15 -4.933 -14.538 11.431 1.00 3.190 N ATOM 245 CA LYS A 15 -4.556 -15.866 11.887 1.00 3.800 C ATOM 246 C LYS A 15 -3.056 -15.837 12.069 1.00 3.610 C ATOM 247 O LYS A 15 -2.464 -16.632 12.799 1.00 4.090 O ATOM 248 CB LYS A 15 -4.967 -16.942 10.882 1.00 5.080 C ATOM 249 CG LYS A 15 -6.473 -17.081 10.694 1.00 5.080 C ATOM 250 CD LYS A 15 -6.817 -18.190 9.708 1.00 5.080 C ATOM 251 CE LYS A 15 -8.326 -18.325 9.530 1.00 5.080 C ATOM 252 NZ LYS A 15 -8.680 -19.384 8.540 1.00 5.080 N ATOM 253 H LYS A 15 -4.373 -14.129 10.691 1.00 3.830 H ATOM 254 HA LYS A 15 -5.018 -16.071 12.853 1.00 4.560 H ATOM 255 1HB LYS A 15 -4.522 -16.722 9.912 1.00 6.090 H ATOM 256 2HB LYS A 15 -4.579 -17.907 11.208 1.00 6.090 H ATOM 257 1HG LYS A 15 -6.936 -17.293 11.660 1.00 6.090 H ATOM 258 2HG LYS A 15 -6.879 -16.141 10.322 1.00 6.090 H ATOM 259 1HD LYS A 15 -6.363 -17.973 8.740 1.00 6.090 H ATOM 260 2HD LYS A 15 -6.418 -19.136 10.073 1.00 6.090 H ATOM 261 1HE LYS A 15 -8.776 -18.575 10.490 1.00 6.090 H ATOM 262 2HE LYS A 15 -8.730 -17.372 9.188 1.00 6.090 H ATOM 263 1HZ LYS A 15 -9.685 -19.440 8.452 1.00 6.090 H ATOM 264 2HZ LYS A 15 -8.277 -19.156 7.641 1.00 6.090 H ATOM 265 3HZ LYS A 15 -8.320 -20.274 8.853 1.00 6.090 H ATOM 266 N PHE A 16 -2.456 -14.919 11.321 1.00 3.250 N ATOM 267 CA PHE A 16 -1.009 -14.764 11.214 1.00 3.220 C ATOM 268 C PHE A 16 -0.705 -13.309 10.839 1.00 2.480 C ATOM 269 O PHE A 16 -0.959 -12.896 9.703 1.00 2.950 O ATOM 270 CB PHE A 16 -0.539 -15.777 10.152 1.00 4.520 C ATOM 271 CG PHE A 16 0.931 -15.963 9.894 1.00 4.520 C ATOM 272 CD1 PHE A 16 1.837 -16.212 10.909 1.00 4.520 C ATOM 273 CD2 PHE A 16 1.385 -15.968 8.586 1.00 4.520 C ATOM 274 CE1 PHE A 16 3.167 -16.443 10.616 1.00 4.520 C ATOM 275 CE2 PHE A 16 2.705 -16.202 8.288 1.00 4.520 C ATOM 276 CZ PHE A 16 3.599 -16.439 9.305 1.00 4.520 C ATOM 277 H PHE A 16 -3.070 -14.309 10.795 1.00 3.900 H ATOM 278 HA PHE A 16 -0.553 -14.990 12.178 1.00 3.860 H ATOM 279 1HB PHE A 16 -0.941 -16.757 10.420 1.00 5.420 H ATOM 280 2HB PHE A 16 -1.000 -15.507 9.204 1.00 5.420 H ATOM 281 HD1 PHE A 16 1.497 -16.233 11.944 1.00 5.420 H ATOM 282 HD2 PHE A 16 0.671 -15.795 7.792 1.00 5.420 H ATOM 283 HE1 PHE A 16 3.877 -16.638 11.421 1.00 5.420 H ATOM 284 HE2 PHE A 16 3.045 -16.204 7.250 1.00 5.420 H ATOM 285 HZ PHE A 16 4.647 -16.627 9.076 1.00 5.420 H ATOM 286 N SER A 17 -0.153 -12.542 11.800 1.00 1.980 N ATOM 287 CA SER A 17 0.072 -11.084 11.693 1.00 2.130 C ATOM 288 C SER A 17 1.054 -10.679 10.609 1.00 2.070 C ATOM 289 O SER A 17 1.045 -9.552 10.107 1.00 2.480 O ATOM 290 CB SER A 17 0.569 -10.563 13.023 1.00 2.920 C ATOM 291 OG SER A 17 1.850 -11.060 13.300 1.00 2.920 O ATOM 292 H SER A 17 0.074 -12.977 12.686 1.00 2.380 H ATOM 293 HA SER A 17 -0.888 -10.612 11.471 1.00 2.560 H ATOM 294 1HB SER A 17 0.595 -9.473 13.002 1.00 3.510 H ATOM 295 2HB SER A 17 -0.119 -10.861 13.811 1.00 3.510 H ATOM 296 HG SER A 17 2.079 -10.729 14.176 1.00 3.510 H ATOM 297 N VAL A 18 1.849 -11.636 10.214 1.00 1.830 N ATOM 298 CA VAL A 18 2.871 -11.516 9.202 1.00 2.030 C ATOM 299 C VAL A 18 2.279 -11.112 7.877 1.00 1.550 C ATOM 300 O VAL A 18 2.901 -10.403 7.094 1.00 1.970 O ATOM 301 CB VAL A 18 3.631 -12.836 9.078 1.00 2.760 C ATOM 302 CG1 VAL A 18 4.577 -12.829 7.876 1.00 2.760 C ATOM 303 CG2 VAL A 18 4.406 -13.070 10.365 1.00 2.760 C ATOM 304 H VAL A 18 1.733 -12.512 10.698 1.00 2.200 H ATOM 305 HA VAL A 18 3.573 -10.743 9.516 1.00 2.440 H ATOM 306 HB VAL A 18 2.928 -13.614 8.935 1.00 3.310 H ATOM 307 1HG1 VAL A 18 5.093 -13.788 7.825 1.00 3.310 H ATOM 308 2HG1 VAL A 18 4.025 -12.681 6.950 1.00 3.310 H ATOM 309 3HG1 VAL A 18 5.308 -12.029 7.992 1.00 3.310 H ATOM 310 1HG2 VAL A 18 4.939 -14.013 10.306 1.00 3.310 H ATOM 311 2HG2 VAL A 18 5.120 -12.261 10.507 1.00 3.310 H ATOM 312 3HG2 VAL A 18 3.720 -13.095 11.209 1.00 3.310 H ATOM 313 N ARG A 19 1.110 -11.617 7.572 1.00 1.250 N ATOM 314 CA ARG A 19 0.541 -11.323 6.292 1.00 1.340 C ATOM 315 C ARG A 19 -0.304 -10.060 6.281 1.00 1.000 C ATOM 316 O ARG A 19 -1.006 -9.802 5.301 1.00 1.120 O ATOM 317 CB ARG A 19 -0.269 -12.503 5.803 1.00 1.840 C ATOM 318 CG ARG A 19 0.578 -13.724 5.484 1.00 1.840 C ATOM 319 CD ARG A 19 -0.246 -14.862 4.991 1.00 1.840 C ATOM 320 NE ARG A 19 0.554 -16.073 4.778 1.00 1.840 N ATOM 321 CZ ARG A 19 1.289 -16.351 3.676 1.00 1.840 C ATOM 322 NH1 ARG A 19 1.352 -15.499 2.671 1.00 1.840 N ATOM 323 NH2 ARG A 19 1.953 -17.495 3.609 1.00 1.840 N ATOM 324 H ARG A 19 0.573 -12.182 8.241 1.00 1.500 H ATOM 325 HA ARG A 19 1.358 -11.187 5.593 1.00 1.610 H ATOM 326 1HB ARG A 19 -0.996 -12.786 6.567 1.00 2.210 H ATOM 327 2HB ARG A 19 -0.818 -12.229 4.903 1.00 2.210 H ATOM 328 1HG ARG A 19 1.300 -13.457 4.716 1.00 2.210 H ATOM 329 2HG ARG A 19 1.113 -14.029 6.376 1.00 2.210 H ATOM 330 1HD ARG A 19 -1.009 -15.091 5.738 1.00 2.210 H ATOM 331 2HD ARG A 19 -0.734 -14.593 4.057 1.00 2.210 H ATOM 332 HE ARG A 19 0.532 -16.777 5.506 1.00 2.210 H ATOM 333 1HH1 ARG A 19 0.849 -14.627 2.709 1.00 2.210 H ATOM 334 2HH1 ARG A 19 1.904 -15.720 1.854 1.00 2.210 H ATOM 335 1HH2 ARG A 19 1.907 -18.152 4.376 1.00 2.210 H ATOM 336 2HH2 ARG A 19 2.504 -17.715 2.792 1.00 2.210 H ATOM 337 N ASP A 20 -0.254 -9.245 7.336 1.00 0.830 N ATOM 338 CA ASP A 20 -1.078 -8.046 7.356 1.00 0.770 C ATOM 339 C ASP A 20 -0.473 -6.923 6.505 1.00 0.720 C ATOM 340 O ASP A 20 0.102 -5.957 7.004 1.00 1.120 O ATOM 341 CB ASP A 20 -1.288 -7.560 8.799 1.00 1.100 C ATOM 342 CG ASP A 20 -2.353 -6.443 8.928 1.00 1.100 C ATOM 343 OD1 ASP A 20 -3.067 -6.224 7.977 1.00 1.100 O ATOM 344 OD2 ASP A 20 -2.461 -5.851 9.985 1.00 1.100 O ATOM 345 H ASP A 20 0.337 -9.453 8.146 1.00 1.000 H ATOM 346 HA ASP A 20 -2.055 -8.294 6.940 1.00 0.920 H ATOM 347 1HB ASP A 20 -1.589 -8.407 9.420 1.00 1.320 H ATOM 348 2HB ASP A 20 -0.338 -7.195 9.197 1.00 1.320 H ATOM 349 N TYR A 21 -0.602 -7.076 5.201 1.00 0.600 N ATOM 350 CA TYR A 21 -0.103 -6.111 4.230 1.00 0.660 C ATOM 351 C TYR A 21 -1.261 -5.229 3.843 1.00 0.580 C ATOM 352 O TYR A 21 -2.399 -5.671 3.945 1.00 0.710 O ATOM 353 CB TYR A 21 0.486 -6.802 3.003 1.00 0.900 C ATOM 354 CG TYR A 21 1.764 -7.540 3.284 1.00 0.900 C ATOM 355 CD1 TYR A 21 1.743 -8.897 3.545 1.00 0.900 C ATOM 356 CD2 TYR A 21 2.965 -6.851 3.289 1.00 0.900 C ATOM 357 CE1 TYR A 21 2.921 -9.563 3.810 1.00 0.900 C ATOM 358 CE2 TYR A 21 4.140 -7.517 3.555 1.00 0.900 C ATOM 359 CZ TYR A 21 4.119 -8.868 3.816 1.00 0.900 C ATOM 360 OH TYR A 21 5.291 -9.535 4.084 1.00 0.900 O ATOM 361 H TYR A 21 -1.058 -7.939 4.900 1.00 0.720 H ATOM 362 HA TYR A 21 0.659 -5.487 4.697 1.00 0.790 H ATOM 363 1HB TYR A 21 -0.241 -7.515 2.610 1.00 1.080 H ATOM 364 2HB TYR A 21 0.676 -6.064 2.222 1.00 1.080 H ATOM 365 HD1 TYR A 21 0.799 -9.438 3.542 1.00 1.080 H ATOM 366 HD2 TYR A 21 2.982 -5.781 3.085 1.00 1.080 H ATOM 367 HE1 TYR A 21 2.912 -10.629 4.016 1.00 1.080 H ATOM 368 HE2 TYR A 21 5.086 -6.976 3.560 1.00 1.080 H ATOM 369 HH TYR A 21 5.102 -10.463 4.240 1.00 1.080 H ATOM 370 N THR A 22 -1.001 -3.993 3.442 1.00 0.640 N ATOM 371 CA THR A 22 -2.082 -3.122 3.017 1.00 0.630 C ATOM 372 C THR A 22 -2.257 -3.108 1.510 1.00 0.580 C ATOM 373 O THR A 22 -1.349 -3.463 0.759 1.00 0.630 O ATOM 374 CB THR A 22 -1.831 -1.696 3.521 1.00 0.890 C ATOM 375 OG1 THR A 22 -0.614 -1.197 2.944 1.00 0.890 O ATOM 376 CG2 THR A 22 -1.699 -1.715 5.039 1.00 0.890 C ATOM 377 H THR A 22 -0.051 -3.650 3.402 1.00 0.770 H ATOM 378 HA THR A 22 -3.010 -3.477 3.458 1.00 0.760 H ATOM 379 HB THR A 22 -2.658 -1.048 3.230 1.00 1.060 H ATOM 380 HG1 THR A 22 -0.740 -1.038 2.001 1.00 1.060 H ATOM 381 1HG2 THR A 22 -1.517 -0.704 5.400 1.00 1.060 H ATOM 382 2HG2 THR A 22 -2.621 -2.098 5.477 1.00 1.060 H ATOM 383 3HG2 THR A 22 -0.870 -2.356 5.334 1.00 1.060 H ATOM 384 N ARG A 23 -3.419 -2.630 1.080 1.00 0.580 N ATOM 385 CA ARG A 23 -3.731 -2.459 -0.326 1.00 0.540 C ATOM 386 C ARG A 23 -4.386 -1.145 -0.598 1.00 0.510 C ATOM 387 O ARG A 23 -4.995 -0.523 0.269 1.00 0.510 O ATOM 388 CB ARG A 23 -4.643 -3.541 -0.882 1.00 0.770 C ATOM 389 CG ARG A 23 -4.031 -4.861 -0.969 1.00 0.770 C ATOM 390 CD ARG A 23 -4.956 -5.883 -1.462 1.00 0.770 C ATOM 391 NE ARG A 23 -4.345 -7.158 -1.321 1.00 0.770 N ATOM 392 CZ ARG A 23 -3.635 -7.819 -2.270 1.00 0.770 C ATOM 393 NH1 ARG A 23 -3.498 -7.347 -3.518 1.00 0.770 N ATOM 394 NH2 ARG A 23 -3.053 -8.961 -1.945 1.00 0.770 N ATOM 395 H ARG A 23 -4.114 -2.366 1.764 1.00 0.700 H ATOM 396 HA ARG A 23 -2.798 -2.489 -0.886 1.00 0.650 H ATOM 397 1HB ARG A 23 -5.532 -3.620 -0.265 1.00 0.930 H ATOM 398 2HB ARG A 23 -4.964 -3.267 -1.890 1.00 0.930 H ATOM 399 1HG ARG A 23 -3.216 -4.798 -1.677 1.00 0.930 H ATOM 400 2HG ARG A 23 -3.640 -5.160 -0.011 1.00 0.930 H ATOM 401 1HD ARG A 23 -5.873 -5.877 -0.891 1.00 0.930 H ATOM 402 2HD ARG A 23 -5.185 -5.707 -2.509 1.00 0.930 H ATOM 403 HE ARG A 23 -4.381 -7.543 -0.364 1.00 0.930 H ATOM 404 1HH1 ARG A 23 -3.945 -6.460 -3.833 1.00 0.930 H ATOM 405 2HH1 ARG A 23 -2.946 -7.868 -4.185 1.00 0.930 H ATOM 406 1HH2 ARG A 23 -3.146 -9.324 -1.004 1.00 0.930 H ATOM 407 2HH2 ARG A 23 -2.514 -9.471 -2.629 1.00 0.930 H ATOM 408 N CYS A 24 -4.271 -0.787 -1.836 1.00 0.520 N ATOM 409 CA CYS A 24 -4.852 0.356 -2.492 1.00 0.500 C ATOM 410 C CYS A 24 -6.380 0.326 -2.528 1.00 0.530 C ATOM 411 O CYS A 24 -6.992 -0.490 -3.222 1.00 0.600 O ATOM 412 CB CYS A 24 -4.303 0.346 -3.893 1.00 0.710 C ATOM 413 SG CYS A 24 -4.878 1.552 -4.959 1.00 0.710 S ATOM 414 H CYS A 24 -3.691 -1.400 -2.402 1.00 0.620 H ATOM 415 HA CYS A 24 -4.523 1.252 -1.968 1.00 0.600 H ATOM 416 1HB CYS A 24 -3.222 0.427 -3.848 1.00 0.850 H ATOM 417 2HB CYS A 24 -4.525 -0.610 -4.327 1.00 0.850 H ATOM 418 N LEU A 25 -6.998 1.332 -1.925 1.00 0.520 N ATOM 419 CA LEU A 25 -8.459 1.420 -1.858 1.00 0.590 C ATOM 420 C LEU A 25 -9.152 1.489 -3.220 1.00 0.690 C ATOM 421 O LEU A 25 -10.259 0.973 -3.384 1.00 0.810 O ATOM 422 CB LEU A 25 -8.854 2.681 -1.072 1.00 0.800 C ATOM 423 CG LEU A 25 -8.553 2.695 0.448 1.00 0.800 C ATOM 424 CD1 LEU A 25 -8.765 4.109 0.970 1.00 0.800 C ATOM 425 CD2 LEU A 25 -9.473 1.716 1.182 1.00 0.800 C ATOM 426 H LEU A 25 -6.417 1.980 -1.382 1.00 0.620 H ATOM 427 HA LEU A 25 -8.821 0.532 -1.349 1.00 0.710 H ATOM 428 1HB LEU A 25 -8.341 3.527 -1.505 1.00 0.960 H ATOM 429 2HB LEU A 25 -9.923 2.838 -1.200 1.00 0.960 H ATOM 430 HG LEU A 25 -7.520 2.412 0.624 1.00 0.960 H ATOM 431 1HD1 LEU A 25 -8.547 4.141 2.037 1.00 0.960 H ATOM 432 2HD1 LEU A 25 -8.091 4.796 0.447 1.00 0.960 H ATOM 433 3HD1 LEU A 25 -9.795 4.413 0.801 1.00 0.960 H ATOM 434 1HD2 LEU A 25 -9.251 1.750 2.247 1.00 0.960 H ATOM 435 2HD2 LEU A 25 -10.513 1.998 1.017 1.00 0.960 H ATOM 436 3HD2 LEU A 25 -9.312 0.706 0.821 1.00 0.960 H ATOM 437 N ARG A 26 -8.524 2.150 -4.187 1.00 0.670 N ATOM 438 CA ARG A 26 -9.126 2.338 -5.500 1.00 0.790 C ATOM 439 C ARG A 26 -8.749 1.274 -6.523 1.00 0.850 C ATOM 440 O ARG A 26 -9.568 0.839 -7.330 1.00 1.140 O ATOM 441 CB ARG A 26 -8.660 3.668 -6.081 1.00 1.060 C ATOM 442 CG ARG A 26 -9.009 4.925 -5.297 1.00 1.060 C ATOM 443 CD ARG A 26 -10.455 5.227 -5.260 1.00 1.060 C ATOM 444 NE ARG A 26 -10.710 6.492 -4.569 1.00 1.060 N ATOM 445 CZ ARG A 26 -11.929 7.017 -4.324 1.00 1.060 C ATOM 446 NH1 ARG A 26 -13.020 6.391 -4.721 1.00 1.060 N ATOM 447 NH2 ARG A 26 -12.030 8.169 -3.678 1.00 1.060 N ATOM 448 H ARG A 26 -7.617 2.553 -3.995 1.00 0.800 H ATOM 449 HA ARG A 26 -10.208 2.334 -5.386 1.00 0.950 H ATOM 450 1HB ARG A 26 -7.572 3.648 -6.176 1.00 1.270 H ATOM 451 2HB ARG A 26 -9.065 3.782 -7.085 1.00 1.270 H ATOM 452 1HG ARG A 26 -8.666 4.820 -4.273 1.00 1.270 H ATOM 453 2HG ARG A 26 -8.506 5.761 -5.765 1.00 1.270 H ATOM 454 1HD ARG A 26 -10.839 5.302 -6.277 1.00 1.270 H ATOM 455 2HD ARG A 26 -10.976 4.436 -4.722 1.00 1.270 H ATOM 456 HE ARG A 26 -9.906 7.009 -4.239 1.00 1.270 H ATOM 457 1HH1 ARG A 26 -12.955 5.514 -5.213 1.00 1.270 H ATOM 458 2HH1 ARG A 26 -13.929 6.791 -4.532 1.00 1.270 H ATOM 459 1HH2 ARG A 26 -11.200 8.653 -3.365 1.00 1.270 H ATOM 460 2HH2 ARG A 26 -12.939 8.566 -3.492 1.00 1.270 H ATOM 461 N CYS A 27 -7.496 0.907 -6.525 1.00 0.820 N ATOM 462 CA CYS A 27 -6.939 0.061 -7.544 1.00 0.880 C ATOM 463 C CYS A 27 -6.680 -1.409 -7.189 1.00 0.850 C ATOM 464 O CYS A 27 -6.422 -2.207 -8.095 1.00 0.950 O ATOM 465 CB CYS A 27 -5.639 0.681 -7.956 1.00 1.210 C ATOM 466 SG CYS A 27 -4.395 0.542 -6.724 1.00 1.210 S ATOM 467 H CYS A 27 -6.894 1.269 -5.811 1.00 0.980 H ATOM 468 HA CYS A 27 -7.619 0.085 -8.393 1.00 1.060 H ATOM 469 1HB CYS A 27 -5.272 0.209 -8.863 1.00 1.450 H ATOM 470 2HB CYS A 27 -5.785 1.740 -8.170 1.00 1.450 H ATOM 471 N GLY A 28 -6.695 -1.791 -5.899 1.00 0.730 N ATOM 472 CA GLY A 28 -6.445 -3.179 -5.483 1.00 0.720 C ATOM 473 C GLY A 28 -4.971 -3.623 -5.392 1.00 0.700 C ATOM 474 O GLY A 28 -4.692 -4.782 -5.050 1.00 0.730 O ATOM 475 H GLY A 28 -6.934 -1.143 -5.142 1.00 0.880 H ATOM 476 1HA GLY A 28 -6.907 -3.321 -4.505 1.00 0.860 H ATOM 477 2HA GLY A 28 -6.970 -3.847 -6.163 1.00 0.860 H ATOM 478 N ARG A 29 -4.044 -2.723 -5.708 1.00 0.700 N ATOM 479 CA ARG A 29 -2.611 -3.003 -5.703 1.00 0.720 C ATOM 480 C ARG A 29 -2.055 -3.112 -4.288 1.00 0.700 C ATOM 481 O ARG A 29 -2.476 -2.409 -3.367 1.00 0.650 O ATOM 482 CB ARG A 29 -1.849 -1.921 -6.461 1.00 1.000 C ATOM 483 CG ARG A 29 -2.140 -1.860 -7.978 1.00 1.000 C ATOM 484 CD ARG A 29 -1.428 -0.718 -8.649 1.00 1.000 C ATOM 485 NE ARG A 29 -1.762 -0.626 -10.080 1.00 1.000 N ATOM 486 CZ ARG A 29 -1.113 -1.257 -11.090 1.00 1.000 C ATOM 487 NH1 ARG A 29 -0.068 -2.026 -10.849 1.00 1.000 N ATOM 488 NH2 ARG A 29 -1.534 -1.102 -12.337 1.00 1.000 N ATOM 489 H ARG A 29 -4.369 -1.804 -5.984 1.00 0.840 H ATOM 490 HA ARG A 29 -2.451 -3.954 -6.213 1.00 0.860 H ATOM 491 1HB ARG A 29 -2.051 -0.951 -6.022 1.00 1.200 H ATOM 492 2HB ARG A 29 -0.780 -2.095 -6.350 1.00 1.200 H ATOM 493 1HG ARG A 29 -1.803 -2.787 -8.438 1.00 1.200 H ATOM 494 2HG ARG A 29 -3.210 -1.755 -8.148 1.00 1.200 H ATOM 495 1HD ARG A 29 -1.732 0.214 -8.176 1.00 1.200 H ATOM 496 2HD ARG A 29 -0.353 -0.829 -8.541 1.00 1.200 H ATOM 497 HE ARG A 29 -2.553 -0.047 -10.330 1.00 1.200 H ATOM 498 1HH1 ARG A 29 0.264 -2.155 -9.908 1.00 1.200 H ATOM 499 2HH1 ARG A 29 0.405 -2.490 -11.612 1.00 1.200 H ATOM 500 1HH2 ARG A 29 -2.346 -0.531 -12.536 1.00 1.200 H ATOM 501 2HH2 ARG A 29 -1.056 -1.567 -13.096 1.00 1.200 H ATOM 502 N ALA A 30 -1.074 -3.996 -4.106 1.00 0.770 N ATOM 503 CA ALA A 30 -0.419 -4.150 -2.798 1.00 0.840 C ATOM 504 C ALA A 30 0.974 -3.530 -2.764 1.00 0.810 C ATOM 505 O ALA A 30 1.734 -3.744 -1.816 1.00 1.020 O ATOM 506 CB ALA A 30 -0.319 -5.617 -2.423 1.00 1.150 C ATOM 507 H ALA A 30 -0.775 -4.572 -4.882 1.00 0.920 H ATOM 508 HA ALA A 30 -1.026 -3.641 -2.052 1.00 1.010 H ATOM 509 1HB ALA A 30 0.134 -5.700 -1.434 1.00 1.380 H ATOM 510 2HB ALA A 30 -1.302 -6.051 -2.400 1.00 1.380 H ATOM 511 3HB ALA A 30 0.294 -6.139 -3.153 1.00 1.380 H ATOM 512 N ARG A 31 1.327 -2.780 -3.793 1.00 0.730 N ATOM 513 CA ARG A 31 2.654 -2.198 -3.865 1.00 0.770 C ATOM 514 C ARG A 31 2.558 -0.720 -4.148 1.00 0.750 C ATOM 515 O ARG A 31 1.643 -0.271 -4.830 1.00 1.260 O ATOM 516 CB ARG A 31 3.476 -2.897 -4.939 1.00 1.060 C ATOM 517 CG ARG A 31 3.718 -4.395 -4.675 1.00 1.060 C ATOM 518 CD ARG A 31 4.648 -4.645 -3.535 1.00 1.060 C ATOM 519 NE ARG A 31 4.881 -6.060 -3.346 1.00 1.060 N ATOM 520 CZ ARG A 31 4.132 -6.874 -2.559 1.00 1.060 C ATOM 521 NH1 ARG A 31 3.100 -6.410 -1.864 1.00 1.060 N ATOM 522 NH2 ARG A 31 4.442 -8.161 -2.483 1.00 1.060 N ATOM 523 H ARG A 31 0.659 -2.615 -4.529 1.00 0.880 H ATOM 524 HA ARG A 31 3.145 -2.314 -2.902 1.00 0.920 H ATOM 525 1HB ARG A 31 2.970 -2.805 -5.898 1.00 1.270 H ATOM 526 2HB ARG A 31 4.446 -2.411 -5.033 1.00 1.270 H ATOM 527 1HG ARG A 31 2.778 -4.897 -4.468 1.00 1.270 H ATOM 528 2HG ARG A 31 4.165 -4.840 -5.563 1.00 1.270 H ATOM 529 1HD ARG A 31 5.606 -4.172 -3.751 1.00 1.270 H ATOM 530 2HD ARG A 31 4.254 -4.239 -2.613 1.00 1.270 H ATOM 531 HE ARG A 31 5.655 -6.475 -3.849 1.00 1.270 H ATOM 532 1HH1 ARG A 31 2.833 -5.409 -1.889 1.00 1.270 H ATOM 533 2HH1 ARG A 31 2.563 -7.035 -1.284 1.00 1.270 H ATOM 534 1HH2 ARG A 31 5.227 -8.524 -3.007 1.00 1.270 H ATOM 535 2HH2 ARG A 31 3.898 -8.782 -1.902 1.00 1.270 H ATOM 536 N ALA A 32 3.521 0.038 -3.626 1.00 0.600 N ATOM 537 CA ALA A 32 3.580 1.490 -3.796 1.00 0.590 C ATOM 538 C ALA A 32 2.342 2.178 -3.240 1.00 0.490 C ATOM 539 O ALA A 32 1.824 3.109 -3.858 1.00 0.540 O ATOM 540 CB ALA A 32 3.729 1.857 -5.269 1.00 0.830 C ATOM 541 H ALA A 32 4.241 -0.414 -3.081 1.00 0.720 H ATOM 542 HA ALA A 32 4.447 1.856 -3.246 1.00 0.710 H ATOM 543 1HB ALA A 32 3.797 2.930 -5.363 1.00 1.000 H ATOM 544 2HB ALA A 32 4.631 1.399 -5.668 1.00 1.000 H ATOM 545 3HB ALA A 32 2.875 1.515 -5.840 1.00 1.000 H ATOM 546 N VAL A 33 1.877 1.723 -2.072 1.00 0.450 N ATOM 547 CA VAL A 33 0.707 2.302 -1.415 1.00 0.400 C ATOM 548 C VAL A 33 1.122 3.290 -0.347 1.00 0.400 C ATOM 549 O VAL A 33 1.953 2.994 0.514 1.00 0.450 O ATOM 550 CB VAL A 33 -0.227 1.186 -0.903 1.00 0.580 C ATOM 551 CG1 VAL A 33 -1.460 1.771 -0.160 1.00 0.580 C ATOM 552 CG2 VAL A 33 -0.690 0.372 -2.125 1.00 0.580 C ATOM 553 H VAL A 33 2.366 0.957 -1.631 1.00 0.540 H ATOM 554 HA VAL A 33 0.146 2.871 -2.118 1.00 0.480 H ATOM 555 HB VAL A 33 0.313 0.547 -0.209 1.00 0.700 H ATOM 556 1HG1 VAL A 33 -2.104 0.955 0.175 1.00 0.700 H ATOM 557 2HG1 VAL A 33 -1.141 2.353 0.705 1.00 0.700 H ATOM 558 3HG1 VAL A 33 -2.023 2.411 -0.829 1.00 0.700 H ATOM 559 1HG2 VAL A 33 -1.342 -0.438 -1.805 1.00 0.700 H ATOM 560 2HG2 VAL A 33 -1.224 1.025 -2.805 1.00 0.700 H ATOM 561 3HG2 VAL A 33 0.167 -0.049 -2.637 1.00 0.700 H ATOM 562 N LEU A 34 0.547 4.483 -0.438 1.00 0.360 N ATOM 563 CA LEU A 34 0.858 5.582 0.448 1.00 0.380 C ATOM 564 C LEU A 34 -0.019 5.506 1.683 1.00 0.380 C ATOM 565 O LEU A 34 -1.237 5.709 1.606 1.00 0.360 O ATOM 566 CB LEU A 34 0.577 6.902 -0.289 1.00 0.520 C ATOM 567 CG LEU A 34 1.334 7.144 -1.628 1.00 0.520 C ATOM 568 CD1 LEU A 34 0.775 8.415 -2.286 1.00 0.520 C ATOM 569 CD2 LEU A 34 2.836 7.286 -1.370 1.00 0.520 C ATOM 570 H LEU A 34 -0.143 4.631 -1.178 1.00 0.430 H ATOM 571 HA LEU A 34 1.900 5.515 0.753 1.00 0.460 H ATOM 572 1HB LEU A 34 -0.487 6.930 -0.522 1.00 0.630 H ATOM 573 2HB LEU A 34 0.810 7.727 0.380 1.00 0.630 H ATOM 574 HG LEU A 34 1.155 6.303 -2.308 1.00 0.630 H ATOM 575 1HD1 LEU A 34 1.276 8.592 -3.236 1.00 0.630 H ATOM 576 2HD1 LEU A 34 -0.289 8.279 -2.461 1.00 0.630 H ATOM 577 3HD1 LEU A 34 0.930 9.272 -1.637 1.00 0.630 H ATOM 578 1HD2 LEU A 34 3.351 7.460 -2.309 1.00 0.630 H ATOM 579 2HD2 LEU A 34 3.015 8.128 -0.701 1.00 0.630 H ATOM 580 3HD2 LEU A 34 3.221 6.374 -0.920 1.00 0.630 H ATOM 581 N SER A 35 0.618 5.317 2.839 1.00 0.430 N ATOM 582 CA SER A 35 -0.051 5.141 4.133 1.00 0.470 C ATOM 583 C SER A 35 -0.854 6.358 4.579 1.00 0.480 C ATOM 584 O SER A 35 -1.746 6.257 5.421 1.00 0.530 O ATOM 585 CB SER A 35 0.981 4.803 5.186 1.00 0.640 C ATOM 586 OG SER A 35 1.838 5.886 5.406 1.00 0.640 O ATOM 587 H SER A 35 1.626 5.206 2.816 1.00 0.520 H ATOM 588 HA SER A 35 -0.738 4.299 4.042 1.00 0.560 H ATOM 589 1HB SER A 35 0.478 4.538 6.116 1.00 0.770 H ATOM 590 2HB SER A 35 1.558 3.936 4.865 1.00 0.770 H ATOM 591 HG SER A 35 2.465 5.596 6.078 1.00 0.770 H ATOM 592 N HIS A 36 -0.559 7.499 3.977 1.00 0.470 N ATOM 593 CA HIS A 36 -1.226 8.756 4.271 1.00 0.510 C ATOM 594 C HIS A 36 -2.585 8.851 3.592 1.00 0.490 C ATOM 595 O HIS A 36 -3.443 9.633 4.009 1.00 0.540 O ATOM 596 CB HIS A 36 -0.377 9.925 3.767 1.00 0.700 C ATOM 597 CG HIS A 36 0.909 10.111 4.483 1.00 0.700 C ATOM 598 ND1 HIS A 36 0.985 10.553 5.788 1.00 0.700 N ATOM 599 CD2 HIS A 36 2.183 9.913 4.076 1.00 0.700 C ATOM 600 CE1 HIS A 36 2.254 10.620 6.151 1.00 0.700 C ATOM 601 NE2 HIS A 36 3.000 10.238 5.131 1.00 0.700 N ATOM 602 H HIS A 36 0.191 7.480 3.306 1.00 0.560 H ATOM 603 HA HIS A 36 -1.370 8.854 5.346 1.00 0.610 H ATOM 604 1HB HIS A 36 -0.147 9.762 2.720 1.00 0.840 H ATOM 605 2HB HIS A 36 -0.953 10.849 3.831 1.00 0.840 H ATOM 606 HD2 HIS A 36 2.503 9.562 3.094 1.00 0.840 H ATOM 607 HE1 HIS A 36 2.622 10.935 7.127 1.00 0.840 H ATOM 608 HE2 HIS A 36 4.010 10.188 5.124 1.00 0.840 H ATOM 609 N PHE A 37 -2.768 8.098 2.502 1.00 0.430 N ATOM 610 CA PHE A 37 -3.992 8.208 1.727 1.00 0.420 C ATOM 611 C PHE A 37 -4.747 6.880 1.586 1.00 0.410 C ATOM 612 O PHE A 37 -5.949 6.870 1.320 1.00 0.470 O ATOM 613 CB PHE A 37 -3.636 8.773 0.356 1.00 0.590 C ATOM 614 CG PHE A 37 -2.915 10.081 0.437 1.00 0.590 C ATOM 615 CD1 PHE A 37 -1.560 10.122 0.181 1.00 0.590 C ATOM 616 CD2 PHE A 37 -3.557 11.250 0.791 1.00 0.590 C ATOM 617 CE1 PHE A 37 -0.854 11.299 0.271 1.00 0.590 C ATOM 618 CE2 PHE A 37 -2.854 12.436 0.885 1.00 0.590 C ATOM 619 CZ PHE A 37 -1.502 12.458 0.624 1.00 0.590 C ATOM 620 H PHE A 37 -2.056 7.433 2.208 1.00 0.520 H ATOM 621 HA PHE A 37 -4.653 8.913 2.231 1.00 0.500 H ATOM 622 1HB PHE A 37 -2.987 8.071 -0.157 1.00 0.710 H ATOM 623 2HB PHE A 37 -4.539 8.911 -0.235 1.00 0.710 H ATOM 624 HD1 PHE A 37 -1.053 9.211 -0.093 1.00 0.710 H ATOM 625 HD2 PHE A 37 -4.628 11.233 1.004 1.00 0.710 H ATOM 626 HE1 PHE A 37 0.217 11.311 0.061 1.00 0.710 H ATOM 627 HE2 PHE A 37 -3.369 13.357 1.169 1.00 0.710 H ATOM 628 HZ PHE A 37 -0.949 13.392 0.699 1.00 0.710 H ATOM 629 N GLY A 38 -4.042 5.755 1.733 1.00 0.380 N ATOM 630 CA GLY A 38 -4.644 4.441 1.535 1.00 0.410 C ATOM 631 C GLY A 38 -4.679 4.026 0.068 1.00 0.360 C ATOM 632 O GLY A 38 -5.331 3.040 -0.281 1.00 0.450 O ATOM 633 H GLY A 38 -3.051 5.797 1.957 1.00 0.460 H ATOM 634 1HA GLY A 38 -4.076 3.704 2.106 1.00 0.490 H ATOM 635 2HA GLY A 38 -5.656 4.442 1.937 1.00 0.490 H ATOM 636 N VAL A 39 -3.998 4.782 -0.787 1.00 0.340 N ATOM 637 CA VAL A 39 -3.978 4.494 -2.213 1.00 0.360 C ATOM 638 C VAL A 39 -2.568 4.415 -2.782 1.00 0.290 C ATOM 639 O VAL A 39 -1.614 4.957 -2.221 1.00 0.340 O ATOM 640 CB VAL A 39 -4.799 5.549 -2.994 1.00 0.500 C ATOM 641 CG1 VAL A 39 -6.249 5.526 -2.542 1.00 0.500 C ATOM 642 CG2 VAL A 39 -4.195 6.916 -2.813 1.00 0.500 C ATOM 643 H VAL A 39 -3.491 5.569 -0.409 1.00 0.410 H ATOM 644 HA VAL A 39 -4.454 3.532 -2.376 1.00 0.430 H ATOM 645 HB VAL A 39 -4.789 5.302 -4.015 1.00 0.600 H ATOM 646 1HG1 VAL A 39 -6.819 6.250 -3.116 1.00 0.600 H ATOM 647 2HG1 VAL A 39 -6.646 4.534 -2.707 1.00 0.600 H ATOM 648 3HG1 VAL A 39 -6.317 5.777 -1.482 1.00 0.600 H ATOM 649 1HG2 VAL A 39 -4.763 7.649 -3.378 1.00 0.600 H ATOM 650 2HG2 VAL A 39 -4.227 7.157 -1.784 1.00 0.600 H ATOM 651 3HG2 VAL A 39 -3.173 6.903 -3.157 1.00 0.600 H ATOM 652 N CYS A 40 -2.468 3.753 -3.918 1.00 0.290 N ATOM 653 CA CYS A 40 -1.232 3.570 -4.654 1.00 0.330 C ATOM 654 C CYS A 40 -0.763 4.864 -5.274 1.00 0.270 C ATOM 655 O CYS A 40 -1.569 5.753 -5.534 1.00 0.250 O ATOM 656 CB CYS A 40 -1.422 2.542 -5.756 1.00 0.450 C ATOM 657 SG CYS A 40 -2.413 3.123 -7.173 1.00 0.450 S ATOM 658 H CYS A 40 -3.315 3.354 -4.306 1.00 0.350 H ATOM 659 HA CYS A 40 -0.474 3.209 -3.985 1.00 0.400 H ATOM 660 1HB CYS A 40 -0.447 2.234 -6.130 1.00 0.540 H ATOM 661 2HB CYS A 40 -1.897 1.657 -5.347 1.00 0.540 H ATOM 662 N ARG A 41 0.517 4.944 -5.606 1.00 0.360 N ATOM 663 CA ARG A 41 0.996 6.147 -6.261 1.00 0.400 C ATOM 664 C ARG A 41 0.283 6.427 -7.589 1.00 0.390 C ATOM 665 O ARG A 41 -0.032 7.575 -7.886 1.00 0.400 O ATOM 666 CB ARG A 41 2.504 6.108 -6.478 1.00 0.540 C ATOM 667 CG ARG A 41 3.328 6.280 -5.195 1.00 0.540 C ATOM 668 CD ARG A 41 4.780 6.587 -5.466 1.00 0.540 C ATOM 669 NE ARG A 41 5.516 5.489 -6.109 1.00 0.540 N ATOM 670 CZ ARG A 41 6.171 4.491 -5.465 1.00 0.540 C ATOM 671 NH1 ARG A 41 6.188 4.430 -4.146 1.00 0.540 N ATOM 672 NH2 ARG A 41 6.804 3.567 -6.172 1.00 0.540 N ATOM 673 H ARG A 41 1.148 4.189 -5.314 1.00 0.430 H ATOM 674 HA ARG A 41 0.803 6.980 -5.589 1.00 0.480 H ATOM 675 1HB ARG A 41 2.783 5.155 -6.925 1.00 0.650 H ATOM 676 2HB ARG A 41 2.794 6.895 -7.175 1.00 0.650 H ATOM 677 1HG ARG A 41 2.910 7.106 -4.629 1.00 0.650 H ATOM 678 2HG ARG A 41 3.266 5.369 -4.596 1.00 0.650 H ATOM 679 1HD ARG A 41 4.827 7.451 -6.131 1.00 0.650 H ATOM 680 2HD ARG A 41 5.274 6.842 -4.532 1.00 0.650 H ATOM 681 HE ARG A 41 5.546 5.485 -7.120 1.00 0.650 H ATOM 682 1HH1 ARG A 41 5.713 5.129 -3.596 1.00 0.650 H ATOM 683 2HH1 ARG A 41 6.684 3.682 -3.682 1.00 0.650 H ATOM 684 1HH2 ARG A 41 6.796 3.611 -7.184 1.00 0.650 H ATOM 685 2HH2 ARG A 41 7.297 2.819 -5.707 1.00 0.650 H ATOM 686 N LEU A 42 -0.003 5.408 -8.391 1.00 0.400 N ATOM 687 CA LEU A 42 -0.651 5.675 -9.681 1.00 0.460 C ATOM 688 C LEU A 42 -2.026 6.348 -9.546 1.00 0.400 C ATOM 689 O LEU A 42 -2.295 7.388 -10.155 1.00 0.440 O ATOM 690 CB LEU A 42 -0.788 4.354 -10.456 1.00 0.620 C ATOM 691 CG LEU A 42 -1.532 4.381 -11.809 1.00 0.620 C ATOM 692 CD1 LEU A 42 -0.807 5.292 -12.801 1.00 0.620 C ATOM 693 CD2 LEU A 42 -1.613 2.942 -12.331 1.00 0.620 C ATOM 694 H LEU A 42 0.284 4.475 -8.127 1.00 0.480 H ATOM 695 HA LEU A 42 0.000 6.345 -10.237 1.00 0.550 H ATOM 696 1HB LEU A 42 0.211 3.971 -10.642 1.00 0.740 H ATOM 697 2HB LEU A 42 -1.303 3.641 -9.828 1.00 0.740 H ATOM 698 HG LEU A 42 -2.544 4.772 -11.672 1.00 0.740 H ATOM 699 1HD1 LEU A 42 -1.347 5.290 -13.748 1.00 0.740 H ATOM 700 2HD1 LEU A 42 -0.772 6.310 -12.419 1.00 0.740 H ATOM 701 3HD1 LEU A 42 0.206 4.927 -12.960 1.00 0.740 H ATOM 702 1HD2 LEU A 42 -2.145 2.932 -13.283 1.00 0.740 H ATOM 703 2HD2 LEU A 42 -0.606 2.545 -12.474 1.00 0.740 H ATOM 704 3HD2 LEU A 42 -2.146 2.325 -11.609 1.00 0.740 H ATOM 705 N CYS A 43 -2.878 5.752 -8.754 1.00 0.350 N ATOM 706 CA CYS A 43 -4.202 6.234 -8.487 1.00 0.340 C ATOM 707 C CYS A 43 -4.170 7.495 -7.628 1.00 0.290 C ATOM 708 O CYS A 43 -5.025 8.365 -7.796 1.00 0.330 O ATOM 709 CB CYS A 43 -4.976 5.080 -7.904 1.00 0.480 C ATOM 710 SG CYS A 43 -4.204 4.397 -6.485 1.00 0.480 S ATOM 711 H CYS A 43 -2.579 4.909 -8.313 1.00 0.420 H ATOM 712 HA CYS A 43 -4.669 6.485 -9.441 1.00 0.410 H ATOM 713 1HB CYS A 43 -5.975 5.413 -7.621 1.00 0.580 H ATOM 714 2HB CYS A 43 -5.082 4.294 -8.646 1.00 0.580 H ATOM 715 N PHE A 44 -3.144 7.646 -6.776 1.00 0.230 N ATOM 716 CA PHE A 44 -2.964 8.860 -6.005 1.00 0.220 C ATOM 717 C PHE A 44 -2.812 9.999 -6.958 1.00 0.260 C ATOM 718 O PHE A 44 -3.464 11.023 -6.807 1.00 0.270 O ATOM 719 CB PHE A 44 -1.714 8.841 -5.143 1.00 0.310 C ATOM 720 CG PHE A 44 -1.447 10.158 -4.520 1.00 0.310 C ATOM 721 CD1 PHE A 44 -2.146 10.575 -3.427 1.00 0.310 C ATOM 722 CD2 PHE A 44 -0.478 11.007 -5.060 1.00 0.310 C ATOM 723 CE1 PHE A 44 -1.900 11.801 -2.883 1.00 0.310 C ATOM 724 CE2 PHE A 44 -0.235 12.230 -4.507 1.00 0.310 C ATOM 725 CZ PHE A 44 -0.952 12.621 -3.411 1.00 0.310 C ATOM 726 H PHE A 44 -2.487 6.880 -6.624 1.00 0.280 H ATOM 727 HA PHE A 44 -3.841 9.026 -5.383 1.00 0.260 H ATOM 728 1HB PHE A 44 -1.789 8.094 -4.382 1.00 0.370 H ATOM 729 2HB PHE A 44 -0.871 8.588 -5.752 1.00 0.370 H ATOM 730 HD1 PHE A 44 -2.907 9.925 -2.993 1.00 0.370 H ATOM 731 HD2 PHE A 44 0.088 10.688 -5.936 1.00 0.370 H ATOM 732 HE1 PHE A 44 -2.466 12.125 -2.019 1.00 0.370 H ATOM 733 HE2 PHE A 44 0.524 12.891 -4.938 1.00 0.370 H ATOM 734 HZ PHE A 44 -0.771 13.587 -2.960 1.00 0.370 H ATOM 735 N ARG A 45 -1.913 9.829 -7.929 1.00 0.310 N ATOM 736 CA ARG A 45 -1.646 10.847 -8.913 1.00 0.380 C ATOM 737 C ARG A 45 -2.900 11.224 -9.692 1.00 0.410 C ATOM 738 O ARG A 45 -3.159 12.412 -9.897 1.00 0.460 O ATOM 739 CB ARG A 45 -0.552 10.360 -9.839 1.00 0.500 C ATOM 740 CG ARG A 45 0.825 10.325 -9.201 1.00 0.500 C ATOM 741 CD ARG A 45 1.826 9.728 -10.084 1.00 0.500 C ATOM 742 NE ARG A 45 3.145 9.798 -9.495 1.00 0.500 N ATOM 743 CZ ARG A 45 4.260 9.261 -10.016 1.00 0.500 C ATOM 744 NH1 ARG A 45 4.213 8.594 -11.151 1.00 0.500 N ATOM 745 NH2 ARG A 45 5.412 9.413 -9.381 1.00 0.500 N ATOM 746 H ARG A 45 -1.377 8.956 -7.961 1.00 0.370 H ATOM 747 HA ARG A 45 -1.279 11.730 -8.393 1.00 0.460 H ATOM 748 1HB ARG A 45 -0.774 9.348 -10.152 1.00 0.600 H ATOM 749 2HB ARG A 45 -0.514 10.965 -10.728 1.00 0.600 H ATOM 750 1HG ARG A 45 1.140 11.319 -8.965 1.00 0.600 H ATOM 751 2HG ARG A 45 0.796 9.763 -8.286 1.00 0.600 H ATOM 752 1HD ARG A 45 1.572 8.678 -10.238 1.00 0.600 H ATOM 753 2HD ARG A 45 1.836 10.247 -11.035 1.00 0.600 H ATOM 754 HE ARG A 45 3.237 10.309 -8.624 1.00 0.600 H ATOM 755 1HH1 ARG A 45 3.336 8.481 -11.636 1.00 0.600 H ATOM 756 2HH1 ARG A 45 5.055 8.194 -11.541 1.00 0.600 H ATOM 757 1HH2 ARG A 45 5.445 9.933 -8.512 1.00 0.600 H ATOM 758 2HH2 ARG A 45 6.259 9.017 -9.763 1.00 0.600 H ATOM 759 N GLU A 46 -3.719 10.245 -10.098 1.00 0.410 N ATOM 760 CA GLU A 46 -4.941 10.611 -10.811 1.00 0.480 C ATOM 761 C GLU A 46 -5.888 11.421 -9.914 1.00 0.430 C ATOM 762 O GLU A 46 -6.458 12.434 -10.345 1.00 0.470 O ATOM 763 CB GLU A 46 -5.682 9.364 -11.307 1.00 0.640 C ATOM 764 CG GLU A 46 -5.000 8.600 -12.438 1.00 0.640 C ATOM 765 CD GLU A 46 -5.774 7.363 -12.843 1.00 0.640 C ATOM 766 OE1 GLU A 46 -6.692 7.012 -12.137 1.00 0.640 O ATOM 767 OE2 GLU A 46 -5.459 6.784 -13.857 1.00 0.640 O ATOM 768 H GLU A 46 -3.454 9.263 -9.959 1.00 0.490 H ATOM 769 HA GLU A 46 -4.669 11.225 -11.668 1.00 0.580 H ATOM 770 1HB GLU A 46 -5.807 8.672 -10.471 1.00 0.770 H ATOM 771 2HB GLU A 46 -6.676 9.646 -11.646 1.00 0.770 H ATOM 772 1HG GLU A 46 -4.897 9.257 -13.300 1.00 0.770 H ATOM 773 2HG GLU A 46 -3.999 8.309 -12.113 1.00 0.770 H ATOM 774 N LEU A 47 -6.021 10.998 -8.652 1.00 0.370 N ATOM 775 CA LEU A 47 -6.875 11.690 -7.702 1.00 0.370 C ATOM 776 C LEU A 47 -6.336 13.086 -7.410 1.00 0.370 C ATOM 777 O LEU A 47 -7.094 14.060 -7.321 1.00 0.390 O ATOM 778 CB LEU A 47 -6.937 10.874 -6.399 1.00 0.520 C ATOM 779 CG LEU A 47 -7.702 9.518 -6.411 1.00 0.520 C ATOM 780 CD1 LEU A 47 -7.387 8.764 -5.107 1.00 0.520 C ATOM 781 CD2 LEU A 47 -9.207 9.763 -6.508 1.00 0.520 C ATOM 782 H LEU A 47 -5.543 10.138 -8.361 1.00 0.440 H ATOM 783 HA LEU A 47 -7.865 11.787 -8.135 1.00 0.440 H ATOM 784 1HB LEU A 47 -5.914 10.651 -6.109 1.00 0.620 H ATOM 785 2HB LEU A 47 -7.371 11.474 -5.640 1.00 0.620 H ATOM 786 HG LEU A 47 -7.378 8.917 -7.256 1.00 0.620 H ATOM 787 1HD1 LEU A 47 -7.902 7.825 -5.098 1.00 0.620 H ATOM 788 2HD1 LEU A 47 -6.313 8.586 -5.052 1.00 0.620 H ATOM 789 3HD1 LEU A 47 -7.704 9.359 -4.253 1.00 0.620 H ATOM 790 1HD2 LEU A 47 -9.727 8.807 -6.504 1.00 0.620 H ATOM 791 2HD2 LEU A 47 -9.534 10.357 -5.656 1.00 0.620 H ATOM 792 3HD2 LEU A 47 -9.442 10.291 -7.427 1.00 0.620 H ATOM 793 N ALA A 48 -5.014 13.198 -7.276 1.00 0.380 N ATOM 794 CA ALA A 48 -4.371 14.465 -6.997 1.00 0.450 C ATOM 795 C ALA A 48 -4.622 15.444 -8.129 1.00 0.450 C ATOM 796 O ALA A 48 -5.058 16.573 -7.903 1.00 0.460 O ATOM 797 CB ALA A 48 -2.880 14.245 -6.839 1.00 0.600 C ATOM 798 H ALA A 48 -4.440 12.363 -7.334 1.00 0.460 H ATOM 799 HA ALA A 48 -4.785 14.878 -6.079 1.00 0.540 H ATOM 800 1HB ALA A 48 -2.390 15.193 -6.643 1.00 0.720 H ATOM 801 2HB ALA A 48 -2.699 13.546 -6.022 1.00 0.720 H ATOM 802 3HB ALA A 48 -2.482 13.831 -7.756 1.00 0.720 H ATOM 803 N TYR A 49 -4.451 14.969 -9.363 1.00 0.470 N ATOM 804 CA TYR A 49 -4.648 15.764 -10.564 1.00 0.520 C ATOM 805 C TYR A 49 -6.045 16.337 -10.596 1.00 0.540 C ATOM 806 O TYR A 49 -6.255 17.526 -10.837 1.00 0.620 O ATOM 807 CB TYR A 49 -4.405 14.920 -11.808 1.00 0.710 C ATOM 808 CG TYR A 49 -4.664 15.648 -13.082 1.00 0.710 C ATOM 809 CD1 TYR A 49 -3.708 16.511 -13.587 1.00 0.710 C ATOM 810 CD2 TYR A 49 -5.865 15.464 -13.753 1.00 0.710 C ATOM 811 CE1 TYR A 49 -3.950 17.189 -14.761 1.00 0.710 C ATOM 812 CE2 TYR A 49 -6.106 16.141 -14.923 1.00 0.710 C ATOM 813 CZ TYR A 49 -5.155 17.001 -15.429 1.00 0.710 C ATOM 814 OH TYR A 49 -5.398 17.679 -16.602 1.00 0.710 O ATOM 815 H TYR A 49 -4.102 14.014 -9.479 1.00 0.560 H ATOM 816 HA TYR A 49 -3.939 16.591 -10.549 1.00 0.620 H ATOM 817 1HB TYR A 49 -3.374 14.573 -11.812 1.00 0.850 H ATOM 818 2HB TYR A 49 -5.040 14.038 -11.781 1.00 0.850 H ATOM 819 HD1 TYR A 49 -2.766 16.654 -13.053 1.00 0.850 H ATOM 820 HD2 TYR A 49 -6.617 14.784 -13.351 1.00 0.850 H ATOM 821 HE1 TYR A 49 -3.200 17.870 -15.160 1.00 0.850 H ATOM 822 HE2 TYR A 49 -7.048 15.998 -15.452 1.00 0.850 H ATOM 823 HH TYR A 49 -4.643 18.231 -16.816 1.00 0.850 H ATOM 824 N ALA A 50 -7.009 15.462 -10.344 1.00 0.530 N ATOM 825 CA ALA A 50 -8.425 15.760 -10.329 1.00 0.580 C ATOM 826 C ALA A 50 -8.832 16.760 -9.242 1.00 0.540 C ATOM 827 O ALA A 50 -9.959 17.258 -9.264 1.00 0.600 O ATOM 828 CB ALA A 50 -9.207 14.474 -10.127 1.00 0.790 C ATOM 829 H ALA A 50 -6.740 14.485 -10.180 1.00 0.640 H ATOM 830 HA ALA A 50 -8.681 16.191 -11.295 1.00 0.700 H ATOM 831 1HB ALA A 50 -10.273 14.685 -10.157 1.00 0.950 H ATOM 832 2HB ALA A 50 -8.948 13.769 -10.916 1.00 0.950 H ATOM 833 3HB ALA A 50 -8.946 14.045 -9.164 1.00 0.950 H ATOM 834 N GLY A 51 -7.981 16.973 -8.230 1.00 0.490 N ATOM 835 CA GLY A 51 -8.315 17.831 -7.104 1.00 0.490 C ATOM 836 C GLY A 51 -9.108 17.067 -6.046 1.00 0.470 C ATOM 837 O GLY A 51 -9.690 17.666 -5.141 1.00 0.500 O ATOM 838 H GLY A 51 -7.023 16.616 -8.276 1.00 0.590 H ATOM 839 1HA GLY A 51 -7.391 18.215 -6.668 1.00 0.590 H ATOM 840 2HA GLY A 51 -8.888 18.686 -7.456 1.00 0.590 H ATOM 841 N ALA A 52 -9.169 15.740 -6.201 1.00 0.470 N ATOM 842 CA ALA A 52 -9.899 14.838 -5.318 1.00 0.500 C ATOM 843 C ALA A 52 -9.361 14.809 -3.886 1.00 0.460 C ATOM 844 O ALA A 52 -10.119 14.546 -2.952 1.00 0.520 O ATOM 845 CB ALA A 52 -9.881 13.433 -5.883 1.00 0.690 C ATOM 846 H ALA A 52 -8.626 15.322 -6.959 1.00 0.560 H ATOM 847 HA ALA A 52 -10.930 15.186 -5.279 1.00 0.600 H ATOM 848 1HB ALA A 52 -10.468 12.777 -5.244 1.00 0.830 H ATOM 849 2HB ALA A 52 -10.297 13.437 -6.889 1.00 0.830 H ATOM 850 3HB ALA A 52 -8.878 13.094 -5.912 1.00 0.830 H ATOM 851 N ILE A 53 -8.049 15.003 -3.710 1.00 0.410 N ATOM 852 CA ILE A 53 -7.455 14.915 -2.386 1.00 0.420 C ATOM 853 C ILE A 53 -7.073 16.312 -1.867 1.00 0.420 C ATOM 854 O ILE A 53 -6.179 16.953 -2.435 1.00 0.400 O ATOM 855 CB ILE A 53 -6.189 14.043 -2.423 1.00 0.580 C ATOM 856 CG1 ILE A 53 -6.542 12.642 -2.960 1.00 0.580 C ATOM 857 CG2 ILE A 53 -5.626 13.932 -1.004 1.00 0.580 C ATOM 858 CD1 ILE A 53 -5.346 11.761 -3.284 1.00 0.580 C ATOM 859 H ILE A 53 -7.456 15.212 -4.502 1.00 0.490 H ATOM 860 HA ILE A 53 -8.154 14.416 -1.732 1.00 0.500 H ATOM 861 HB ILE A 53 -5.450 14.491 -3.087 1.00 0.700 H ATOM 862 1HG1 ILE A 53 -7.162 12.132 -2.226 1.00 0.700 H ATOM 863 2HG1 ILE A 53 -7.118 12.766 -3.859 1.00 0.700 H ATOM 864 1HG2 ILE A 53 -4.738 13.332 -1.012 1.00 0.700 H ATOM 865 2HG2 ILE A 53 -5.381 14.914 -0.612 1.00 0.700 H ATOM 866 3HG2 ILE A 53 -6.369 13.472 -0.354 1.00 0.700 H ATOM 867 1HD1 ILE A 53 -5.689 10.805 -3.663 1.00 0.700 H ATOM 868 2HD1 ILE A 53 -4.725 12.248 -4.047 1.00 0.700 H ATOM 869 3HD1 ILE A 53 -4.764 11.587 -2.396 1.00 0.700 H ATOM 870 N PRO A 54 -7.720 16.816 -0.803 1.00 0.460 N ATOM 871 CA PRO A 54 -7.488 18.128 -0.245 1.00 0.490 C ATOM 872 C PRO A 54 -6.039 18.306 0.143 1.00 0.490 C ATOM 873 O PRO A 54 -5.415 17.388 0.673 1.00 0.500 O ATOM 874 CB PRO A 54 -8.382 18.126 1.002 1.00 0.730 C ATOM 875 CG PRO A 54 -9.477 17.149 0.684 1.00 0.730 C ATOM 876 CD PRO A 54 -8.808 16.068 -0.132 1.00 0.730 C ATOM 877 HA PRO A 54 -7.805 18.894 -0.969 1.00 0.590 H ATOM 878 1HB PRO A 54 -7.792 17.835 1.886 1.00 0.880 H ATOM 879 2HB PRO A 54 -8.759 19.141 1.194 1.00 0.880 H ATOM 880 1HG PRO A 54 -9.925 16.762 1.613 1.00 0.880 H ATOM 881 2HG PRO A 54 -10.285 17.651 0.129 1.00 0.880 H ATOM 882 1HD PRO A 54 -8.407 15.266 0.506 1.00 0.880 H ATOM 883 2HD PRO A 54 -9.564 15.716 -0.847 1.00 0.880 H ATOM 884 N GLY A 55 -5.513 19.495 -0.107 1.00 0.510 N ATOM 885 CA GLY A 55 -4.143 19.820 0.258 1.00 0.560 C ATOM 886 C GLY A 55 -3.075 19.348 -0.728 1.00 0.480 C ATOM 887 O GLY A 55 -1.914 19.742 -0.597 1.00 0.520 O ATOM 888 H GLY A 55 -6.078 20.201 -0.557 1.00 0.610 H ATOM 889 1HA GLY A 55 -4.060 20.900 0.379 1.00 0.670 H ATOM 890 2HA GLY A 55 -3.934 19.388 1.235 1.00 0.670 H ATOM 891 N VAL A 56 -3.426 18.502 -1.701 1.00 0.400 N ATOM 892 CA VAL A 56 -2.398 18.013 -2.608 1.00 0.360 C ATOM 893 C VAL A 56 -2.187 18.951 -3.792 1.00 0.410 C ATOM 894 O VAL A 56 -3.106 19.238 -4.556 1.00 0.630 O ATOM 895 CB VAL A 56 -2.743 16.595 -3.080 1.00 0.520 C ATOM 896 CG1 VAL A 56 -1.729 16.114 -4.065 1.00 0.520 C ATOM 897 CG2 VAL A 56 -2.763 15.670 -1.874 1.00 0.520 C ATOM 898 H VAL A 56 -4.397 18.184 -1.820 1.00 0.480 H ATOM 899 HA VAL A 56 -1.460 17.954 -2.056 1.00 0.430 H ATOM 900 HB VAL A 56 -3.726 16.598 -3.561 1.00 0.620 H ATOM 901 1HG1 VAL A 56 -1.987 15.119 -4.363 1.00 0.620 H ATOM 902 2HG1 VAL A 56 -1.701 16.761 -4.946 1.00 0.620 H ATOM 903 3HG1 VAL A 56 -0.765 16.114 -3.595 1.00 0.620 H ATOM 904 1HG2 VAL A 56 -3.014 14.664 -2.194 1.00 0.620 H ATOM 905 2HG2 VAL A 56 -1.786 15.668 -1.399 1.00 0.620 H ATOM 906 3HG2 VAL A 56 -3.505 16.029 -1.166 1.00 0.620 H ATOM 907 N LYS A 57 -0.944 19.407 -3.944 1.00 0.490 N ATOM 908 CA LYS A 57 -0.524 20.350 -4.976 1.00 0.670 C ATOM 909 C LYS A 57 0.533 19.725 -5.883 1.00 0.560 C ATOM 910 O LYS A 57 1.055 18.650 -5.559 1.00 0.710 O ATOM 911 CB LYS A 57 0.029 21.624 -4.328 1.00 0.870 C ATOM 912 CG LYS A 57 -0.949 22.353 -3.383 1.00 0.870 C ATOM 913 CD LYS A 57 -2.152 22.946 -4.124 1.00 0.870 C ATOM 914 CE LYS A 57 -3.041 23.745 -3.182 1.00 0.870 C ATOM 915 NZ LYS A 57 -4.238 24.308 -3.884 1.00 0.870 N ATOM 916 H LYS A 57 -0.244 19.088 -3.289 1.00 0.590 H ATOM 917 HA LYS A 57 -1.384 20.596 -5.599 1.00 0.800 H ATOM 918 1HB LYS A 57 0.920 21.375 -3.750 1.00 1.040 H ATOM 919 2HB LYS A 57 0.328 22.331 -5.099 1.00 1.040 H ATOM 920 1HG LYS A 57 -1.315 21.649 -2.629 1.00 1.040 H ATOM 921 2HG LYS A 57 -0.420 23.154 -2.870 1.00 1.040 H ATOM 922 1HD LYS A 57 -1.809 23.592 -4.934 1.00 1.040 H ATOM 923 2HD LYS A 57 -2.754 22.142 -4.548 1.00 1.040 H ATOM 924 1HE LYS A 57 -3.378 23.091 -2.378 1.00 1.040 H ATOM 925 2HE LYS A 57 -2.465 24.565 -2.754 1.00 1.040 H ATOM 926 1HZ LYS A 57 -4.803 24.827 -3.225 1.00 1.040 H ATOM 927 2HZ LYS A 57 -3.937 24.926 -4.626 1.00 1.040 H ATOM 928 3HZ LYS A 57 -4.786 23.555 -4.276 1.00 1.040 H ATOM 929 N LYS A 58 0.950 20.486 -6.910 1.00 0.730 N ATOM 930 CA LYS A 58 1.941 20.082 -7.929 1.00 0.720 C ATOM 931 C LYS A 58 3.270 19.549 -7.366 1.00 1.060 C ATOM 932 O LYS A 58 4.037 18.885 -8.063 1.00 1.980 O ATOM 933 CB LYS A 58 2.231 21.263 -8.861 1.00 1.010 C ATOM 934 CG LYS A 58 2.967 22.448 -8.211 1.00 1.010 C ATOM 935 CD LYS A 58 3.156 23.595 -9.208 1.00 1.010 C ATOM 936 CE LYS A 58 3.923 24.763 -8.586 1.00 1.010 C ATOM 937 NZ LYS A 58 4.085 25.898 -9.541 1.00 1.010 N ATOM 938 H LYS A 58 0.474 21.367 -7.051 1.00 0.880 H ATOM 939 HA LYS A 58 1.496 19.301 -8.524 1.00 0.860 H ATOM 940 1HB LYS A 58 2.836 20.913 -9.699 1.00 1.210 H ATOM 941 2HB LYS A 58 1.293 21.633 -9.273 1.00 1.210 H ATOM 942 1HG LYS A 58 2.407 22.805 -7.348 1.00 1.210 H ATOM 943 2HG LYS A 58 3.952 22.126 -7.874 1.00 1.210 H ATOM 944 1HD LYS A 58 3.710 23.232 -10.074 1.00 1.210 H ATOM 945 2HD LYS A 58 2.182 23.953 -9.544 1.00 1.210 H ATOM 946 1HE LYS A 58 3.383 25.115 -7.707 1.00 1.210 H ATOM 947 2HE LYS A 58 4.910 24.417 -8.278 1.00 1.210 H ATOM 948 1HZ LYS A 58 4.596 26.647 -9.092 1.00 1.210 H ATOM 949 2HZ LYS A 58 4.596 25.585 -10.355 1.00 1.210 H ATOM 950 3HZ LYS A 58 3.176 26.236 -9.824 1.00 1.210 H ATOM 951 N ALA A 59 3.560 19.868 -6.111 1.00 1.080 N ATOM 952 CA ALA A 59 4.762 19.427 -5.396 1.00 1.610 C ATOM 953 C ALA A 59 4.829 17.889 -5.307 1.00 2.370 C ATOM 954 O ALA A 59 5.921 17.309 -5.301 1.00 2.930 O ATOM 955 CB ALA A 59 4.770 20.019 -4.000 1.00 2.040 C ATOM 956 H ALA A 59 2.881 20.426 -5.618 1.00 1.300 H ATOM 957 HA ALA A 59 5.635 19.774 -5.947 1.00 1.930 H ATOM 958 1HB ALA A 59 5.674 19.706 -3.481 1.00 2.450 H ATOM 959 2HB ALA A 59 4.745 21.105 -4.068 1.00 2.450 H ATOM 960 3HB ALA A 59 3.895 19.665 -3.456 1.00 2.450 H ATOM 961 N SER A 60 3.663 17.224 -5.185 1.00 2.890 N ATOM 962 CA SER A 60 3.650 15.766 -5.135 1.00 4.070 C ATOM 963 C SER A 60 3.060 15.204 -6.430 1.00 4.750 C ATOM 964 O SER A 60 3.393 14.079 -6.821 1.00 5.340 O ATOM 965 CB SER A 60 2.909 15.250 -3.916 1.00 5.230 C ATOM 966 OG SER A 60 1.572 15.624 -3.919 1.00 5.230 O ATOM 967 H SER A 60 2.773 17.724 -5.161 1.00 3.470 H ATOM 968 HA SER A 60 4.677 15.413 -5.062 1.00 4.880 H ATOM 969 1HB SER A 60 2.977 14.162 -3.896 1.00 6.270 H ATOM 970 2HB SER A 60 3.390 15.623 -3.016 1.00 6.270 H ATOM 971 HG SER A 60 1.160 15.103 -3.228 1.00 6.270 H ATOM 972 N TRP A 61 2.240 16.017 -7.117 1.00 4.920 N ATOM 973 CA TRP A 61 1.625 15.677 -8.407 1.00 5.800 C ATOM 974 C TRP A 61 0.615 16.741 -8.826 1.00 6.230 C ATOM 975 O TRP A 61 -0.567 16.625 -8.505 1.00 6.790 O ATOM 976 OXT TRP A 61 0.908 17.503 -9.745 1.00 8.700 O ATOM 977 CB TRP A 61 0.895 14.336 -8.425 1.00 7.300 C ATOM 978 CG TRP A 61 0.573 13.951 -9.826 1.00 7.300 C ATOM 979 CD1 TRP A 61 -0.611 14.014 -10.477 1.00 7.300 C ATOM 980 CD2 TRP A 61 1.529 13.426 -10.777 1.00 7.300 C ATOM 981 NE1 TRP A 61 -0.458 13.550 -11.774 1.00 7.300 N ATOM 982 CE2 TRP A 61 0.843 13.191 -11.962 1.00 7.300 C ATOM 983 CE3 TRP A 61 2.899 13.136 -10.708 1.00 7.300 C ATOM 984 CZ2 TRP A 61 1.471 12.677 -13.077 1.00 7.300 C ATOM 985 CZ3 TRP A 61 3.529 12.623 -11.826 1.00 7.300 C ATOM 986 CH2 TRP A 61 2.833 12.398 -12.981 1.00 7.300 C ATOM 987 H TRP A 61 2.006 16.919 -6.698 1.00 5.900 H ATOM 988 HA TRP A 61 2.410 15.651 -9.161 1.00 6.960 H ATOM 989 1HB TRP A 61 1.475 13.544 -7.995 1.00 8.760 H ATOM 990 2HB TRP A 61 -0.028 14.409 -7.860 1.00 8.760 H ATOM 991 HD1 TRP A 61 -1.539 14.374 -10.037 1.00 8.760 H ATOM 992 HE1 TRP A 61 -1.176 13.479 -12.479 1.00 8.760 H ATOM 993 HE3 TRP A 61 3.455 13.312 -9.785 1.00 8.760 H ATOM 994 HZ2 TRP A 61 0.935 12.491 -14.008 1.00 8.760 H ATOM 995 HZ3 TRP A 61 4.593 12.400 -11.762 1.00 8.760 H ATOM 996 HH2 TRP A 61 3.358 11.992 -13.844 1.00 8.760 H TER 997 ENDMDL