Browse entries in the PDBbind-CN Database
HEADER 5W7U_COMPLEX COMPND 5W7U_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 123 ARG GLY SER HIS MET GLU ASP PHE VAL ARG GLN CYS PHE SEQRES 2 A 123 ASN PRO MET ILE VAL GLU LEU ALA GLU LYS ALA MET LYS SEQRES 3 A 123 GLU TYR GLY GLU ASP PRO LYS ILE GLU THR ASN LYS PHE SEQRES 4 A 123 ALA ALA ILE CYS THR HIS LEU GLU VAL CYS PHE MET TYR SEQRES 5 A 123 SER ASP GLY GLY SER LYS HIS ARG PHE GLU ILE ILE GLU SEQRES 6 A 123 GLY ARG ASP ARG ILE MET ALA TRP THR VAL VAL ASN SER SEQRES 7 A 123 ILE CYS ASN THR THR GLY VAL GLU LYS PRO LYS PHE LEU SEQRES 8 A 123 PRO ASP LEU TYR ASP TYR LYS GLU ASN ARG PHE ILE GLU SEQRES 9 A 123 ILE GLY VAL THR ARG ARG GLU VAL HIS ILE TYR TYR LEU SEQRES 10 A 123 GLU LYS ALA ASN LYS ILE SEQRES 1 A 55 GLU LYS THR HIS ILE HIS ILE PHE SER PHE THR GLY GLU SEQRES 2 A 55 GLU MET ALA THR LYS ALA ASP TYR THR LEU ASP GLU GLU SEQRES 3 A 55 SER ARG ALA ARG ILE LYS THR ARG LEU PHE THR ILE ARG SEQRES 4 A 55 GLN GLU MET ALA SER ARG SER LEU TRP ASP SER PHE ARG SEQRES 5 A 55 GLN SER GLU HET MN A 1 1 HET MN A 2 1 HET GY A 8 56 ATOM 1 N ARG A -3 118.732 103.177 264.764 1.00134.31 N ATOM 2 CA ARG A -3 119.366 104.374 265.311 1.00136.09 C ATOM 3 C ARG A -3 118.336 105.469 265.616 1.00138.23 C ATOM 4 O ARG A -3 117.139 105.277 265.402 1.00145.21 O ATOM 5 CB ARG A -3 120.429 104.899 264.341 1.00132.11 C ATOM 6 HN3 ARG A -3 118.239 103.420 263.881 1.00 0.00 H ATOM 7 HN2 ARG A -3 118.048 102.803 265.453 1.00 0.00 H ATOM 8 HN1 ARG A -3 119.459 102.459 264.570 1.00 0.00 H ATOM 9 N GLY A -2 118.809 106.604 266.135 1.00130.19 N ATOM 10 CA GLY A -2 117.990 107.794 266.318 1.00123.30 C ATOM 11 C GLY A -2 116.816 107.686 267.276 1.00118.28 C ATOM 12 O GLY A -2 115.664 107.588 266.842 1.00122.37 O ATOM 13 H GLY A -2 119.808 106.640 266.422 1.00 0.00 H ATOM 14 N SER A -1 117.088 107.735 268.576 1.00106.22 N ATOM 15 CA SER A -1 116.061 107.670 269.608 1.00102.03 C ATOM 16 C SER A -1 115.708 109.060 270.131 1.00 96.67 C ATOM 17 O SER A -1 116.475 110.017 270.001 1.00 95.24 O ATOM 18 CB SER A -1 116.533 106.801 270.774 1.00100.13 C ATOM 19 OG SER A -1 117.642 107.415 271.414 1.00 95.41 O ATOM 20 HG SER A -1 117.942 106.847 272.168 1.00 0.00 H ATOM 21 H SER A -1 118.081 107.824 268.871 1.00 0.00 H ATOM 22 N HIS A 0 114.530 109.156 270.755 1.00 93.06 N ATOM 23 CA HIS A 0 114.159 110.411 271.403 1.00 78.40 C ATOM 24 C HIS A 0 115.092 110.713 272.570 1.00 80.75 C ATOM 25 O HIS A 0 115.478 111.869 272.785 1.00 81.31 O ATOM 26 CB HIS A 0 112.700 110.364 271.869 1.00 76.42 C ATOM 27 CG HIS A 0 112.160 111.689 272.329 1.00 81.32 C ATOM 28 ND1 HIS A 0 110.873 111.848 272.796 1.00 77.54 N ATOM 29 CD2 HIS A 0 112.734 112.918 272.391 1.00 76.75 C ATOM 30 CE1 HIS A 0 110.676 113.114 273.124 1.00 77.30 C ATOM 31 NE2 HIS A 0 111.789 113.785 272.884 1.00 74.23 N ATOM 32 H HIS A 0 113.882 108.343 270.779 1.00 0.00 H ATOM 33 N MET A 1 115.481 109.686 273.323 1.00 83.29 N ATOM 34 CA MET A 1 116.340 109.918 274.477 1.00 84.45 C ATOM 35 C MET A 1 117.664 110.541 274.056 1.00 80.28 C ATOM 36 O MET A 1 118.154 111.483 274.696 1.00 78.29 O ATOM 37 CB MET A 1 116.574 108.607 275.225 1.00 85.79 C ATOM 38 CG MET A 1 117.478 108.760 276.424 1.00 84.61 C ATOM 39 SD MET A 1 116.955 110.156 277.437 1.00 81.98 S ATOM 40 CE MET A 1 116.064 109.268 278.711 1.00 86.60 C ATOM 41 H MET A 1 115.173 108.721 273.088 1.00 0.00 H ATOM 42 N GLU A 2 118.250 110.033 272.973 1.00 70.51 N ATOM 43 CA GLU A 2 119.513 110.573 272.488 1.00 79.04 C ATOM 44 C GLU A 2 119.370 112.022 272.035 1.00 77.44 C ATOM 45 O GLU A 2 120.258 112.843 272.287 1.00 72.92 O ATOM 46 CB GLU A 2 120.047 109.702 271.347 1.00 71.67 C ATOM 47 CG GLU A 2 120.877 110.453 270.326 1.00 83.11 C ATOM 48 CD GLU A 2 121.584 109.523 269.362 1.00 89.69 C ATOM 49 OE1 GLU A 2 122.833 109.486 269.383 1.00 91.57 O ATOM 50 OE2 GLU A 2 120.884 108.818 268.603 1.00 95.68 O ATOM 51 H GLU A 2 117.801 109.242 272.468 1.00 0.00 H ATOM 52 N ASP A 3 118.281 112.357 271.337 1.00 75.80 N ATOM 53 CA ASP A 3 118.104 113.750 270.939 1.00 71.06 C ATOM 54 C ASP A 3 117.826 114.634 272.153 1.00 74.99 C ATOM 55 O ASP A 3 118.210 115.809 272.174 1.00 74.92 O ATOM 56 CB ASP A 3 116.968 113.878 269.922 1.00 69.33 C ATOM 57 CG ASP A 3 117.328 113.322 268.513 1.00 73.90 C ATOM 58 OD1 ASP A 3 118.519 113.120 268.170 1.00 67.75 O ATOM 59 OD2 ASP A 3 116.379 113.105 267.731 1.00 71.51 O ATOM 60 H ASP A 3 117.573 111.639 271.082 1.00 0.00 H ATOM 61 N PHE A 4 117.160 114.091 273.171 1.00 71.26 N ATOM 62 CA PHE A 4 116.933 114.879 274.371 1.00 71.88 C ATOM 63 C PHE A 4 118.242 115.134 275.106 1.00 66.81 C ATOM 64 O PHE A 4 118.508 116.267 275.529 1.00 64.77 O ATOM 65 CB PHE A 4 115.921 114.190 275.287 1.00 78.95 C ATOM 66 CG PHE A 4 115.928 114.736 276.676 1.00 81.24 C ATOM 67 CD1 PHE A 4 115.335 115.957 276.958 1.00 82.09 C ATOM 68 CD2 PHE A 4 116.571 114.059 277.697 1.00 77.58 C ATOM 69 CE1 PHE A 4 115.360 116.476 278.240 1.00 76.19 C ATOM 70 CE2 PHE A 4 116.608 114.582 278.981 1.00 70.27 C ATOM 71 CZ PHE A 4 116.002 115.787 279.248 1.00 73.18 C ATOM 72 H PHE A 4 116.807 113.115 273.108 1.00 0.00 H ATOM 73 N VAL A 5 119.088 114.104 275.240 1.00 67.04 N ATOM 74 CA VAL A 5 120.377 114.290 275.909 1.00 69.55 C ATOM 75 C VAL A 5 121.179 115.399 275.238 1.00 75.03 C ATOM 76 O VAL A 5 121.782 116.241 275.915 1.00 66.05 O ATOM 77 CB VAL A 5 121.172 112.973 275.945 1.00 73.70 C ATOM 78 CG1 VAL A 5 122.640 113.242 276.286 1.00 79.33 C ATOM 79 CG2 VAL A 5 120.571 112.021 276.944 1.00 71.23 C ATOM 80 H VAL A 5 118.828 113.168 274.867 1.00 0.00 H ATOM 81 N ARG A 6 121.188 115.427 273.897 1.00 72.05 N ATOM 82 CA ARG A 6 122.007 116.397 273.171 1.00 70.97 C ATOM 83 C ARG A 6 121.478 117.817 273.292 1.00 72.42 C ATOM 84 O ARG A 6 122.249 118.771 273.174 1.00 79.87 O ATOM 85 CB ARG A 6 122.095 116.013 271.698 1.00 64.65 C ATOM 86 CG ARG A 6 122.745 114.673 271.490 1.00 59.93 C ATOM 87 CD ARG A 6 123.082 114.421 270.005 1.00 70.06 C ATOM 88 NE ARG A 6 123.516 113.035 269.855 1.00 75.26 N ATOM 89 CZ ARG A 6 124.759 112.610 270.073 1.00 74.43 C ATOM 90 NH1 ARG A 6 125.716 113.479 270.406 1.00 64.24 N ATOM 91 NH2 ARG A 6 125.054 111.318 269.935 1.00 77.67 N ATOM 92 HE ARG A 6 122.808 112.334 269.558 1.00 0.00 H ATOM 93 HH12 ARG A 6 126.686 113.145 270.576 1.00 0.00 H ATOM 94 HH11 ARG A 6 125.492 114.491 270.496 1.00 0.00 H ATOM 95 HH22 ARG A 6 126.025 110.985 270.105 1.00 0.00 H ATOM 96 HH21 ARG A 6 124.314 110.642 269.657 1.00 0.00 H ATOM 97 H ARG A 6 120.604 114.749 273.366 1.00 0.00 H ATOM 98 N GLN A 7 120.177 117.977 273.500 1.00 76.17 N ATOM 99 CA GLN A 7 119.582 119.294 273.655 1.00 78.51 C ATOM 100 C GLN A 7 119.563 119.750 275.116 1.00 83.68 C ATOM 101 O GLN A 7 119.472 120.954 275.374 1.00 87.13 O ATOM 102 CB GLN A 7 118.166 119.266 273.053 1.00 79.51 C ATOM 103 CG GLN A 7 117.401 120.581 273.006 1.00 89.93 C ATOM 104 CD GLN A 7 116.145 120.533 273.881 1.00104.10 C ATOM 105 OE1 GLN A 7 115.999 119.649 274.727 1.00105.33 O ATOM 106 NE2 GLN A 7 115.234 121.479 273.673 1.00110.63 N ATOM 107 HE22 GLN A 7 115.397 122.207 272.948 1.00 0.00 H ATOM 108 HE21 GLN A 7 114.359 121.491 274.235 1.00 0.00 H ATOM 109 H GLN A 7 119.566 117.137 273.554 1.00 0.00 H ATOM 110 N CYS A 8 119.699 118.823 276.070 1.00 78.35 N ATOM 111 CA CYS A 8 119.584 119.120 277.495 1.00 74.71 C ATOM 112 C CYS A 8 120.927 119.456 278.147 1.00 79.52 C ATOM 113 O CYS A 8 120.992 120.372 278.971 1.00 87.35 O ATOM 114 CB CYS A 8 118.927 117.942 278.227 1.00 72.56 C ATOM 115 SG CYS A 8 118.876 118.081 280.061 1.00 79.67 S ATOM 116 H CYS A 8 119.896 117.843 275.783 1.00 0.00 H ATOM 117 N PHE A 9 121.999 118.745 277.809 1.00 75.41 N ATOM 118 CA PHE A 9 123.309 118.983 278.406 1.00 68.65 C ATOM 119 C PHE A 9 124.186 119.792 277.464 1.00 71.37 C ATOM 120 O PHE A 9 123.937 119.864 276.261 1.00 64.71 O ATOM 121 CB PHE A 9 123.996 117.664 278.763 1.00 67.21 C ATOM 122 CG PHE A 9 123.220 116.843 279.757 1.00 70.57 C ATOM 123 CD1 PHE A 9 122.305 115.895 279.332 1.00 65.99 C ATOM 124 CD2 PHE A 9 123.353 117.081 281.118 1.00 61.91 C ATOM 125 CE1 PHE A 9 121.575 115.158 280.250 1.00 71.61 C ATOM 126 CE2 PHE A 9 122.624 116.349 282.044 1.00 61.70 C ATOM 127 CZ PHE A 9 121.732 115.387 281.604 1.00 63.87 C ATOM 128 H PHE A 9 121.900 117.995 277.096 1.00 0.00 H ATOM 129 N ASN A 10 125.216 120.422 278.026 1.00 70.15 N ATOM 130 CA ASN A 10 126.021 121.279 277.184 1.00 76.35 C ATOM 131 C ASN A 10 127.001 120.445 276.363 1.00 70.70 C ATOM 132 O ASN A 10 127.300 119.293 276.709 1.00 55.63 O ATOM 133 CB ASN A 10 126.712 122.363 278.021 1.00 84.46 C ATOM 134 CG ASN A 10 127.877 121.855 278.841 1.00 93.45 C ATOM 135 OD1 ASN A 10 128.901 121.419 278.313 1.00 97.52 O ATOM 136 ND2 ASN A 10 127.744 121.966 280.158 1.00 99.15 N ATOM 137 HD22 ASN A 10 126.861 122.340 280.562 1.00 0.00 H ATOM 138 HD21 ASN A 10 128.522 121.679 280.785 1.00 0.00 H ATOM 139 H ASN A 10 125.434 120.302 279.036 1.00 0.00 H ATOM 140 N PRO A 11 127.465 120.991 275.233 1.00 64.72 N ATOM 141 CA PRO A 11 128.287 120.191 274.307 1.00 66.46 C ATOM 142 C PRO A 11 129.522 119.580 274.932 1.00 68.15 C ATOM 143 O PRO A 11 129.882 118.456 274.560 1.00 69.06 O ATOM 144 CB PRO A 11 128.682 121.201 273.218 1.00 57.71 C ATOM 145 CG PRO A 11 127.599 122.231 273.247 1.00 65.60 C ATOM 146 CD PRO A 11 127.129 122.321 274.684 1.00 62.87 C ATOM 147 N MET A 12 130.220 120.298 275.820 1.00 60.26 N ATOM 148 CA MET A 12 131.412 119.711 276.425 1.00 63.44 C ATOM 149 C MET A 12 131.052 118.451 277.218 1.00 62.86 C ATOM 150 O MET A 12 131.777 117.447 277.170 1.00 57.53 O ATOM 151 CB MET A 12 132.116 120.732 277.320 1.00 75.14 C ATOM 152 CG MET A 12 133.354 120.176 278.032 1.00 92.55 C ATOM 153 SD MET A 12 133.531 120.751 279.737 1.00107.95 S ATOM 154 CE MET A 12 135.121 120.074 280.226 1.00104.19 C ATOM 155 H MET A 12 129.918 121.260 276.075 1.00 0.00 H ATOM 156 N ILE A 13 129.911 118.468 277.920 1.00 57.67 N ATOM 157 CA ILE A 13 129.483 117.295 278.688 1.00 61.01 C ATOM 158 C ILE A 13 129.160 116.151 277.753 1.00 61.85 C ATOM 159 O ILE A 13 129.536 114.995 277.995 1.00 60.91 O ATOM 160 CB ILE A 13 128.247 117.613 279.547 1.00 58.17 C ATOM 161 CG1 ILE A 13 128.455 118.827 280.456 1.00 67.70 C ATOM 162 CG2 ILE A 13 127.789 116.336 280.274 1.00 59.89 C ATOM 163 CD1 ILE A 13 129.123 118.532 281.708 1.00 74.56 C ATOM 164 H ILE A 13 129.321 119.325 277.920 1.00 0.00 H ATOM 165 N VAL A 14 128.413 116.455 276.685 1.00 65.68 N ATOM 166 CA VAL A 14 127.939 115.411 275.782 1.00 69.62 C ATOM 167 C VAL A 14 129.119 114.694 275.145 1.00 67.46 C ATOM 168 O VAL A 14 129.144 113.458 275.070 1.00 70.26 O ATOM 169 CB VAL A 14 126.977 116.008 274.736 1.00 65.28 C ATOM 170 CG1 VAL A 14 126.817 115.072 273.527 1.00 60.12 C ATOM 171 CG2 VAL A 14 125.627 116.265 275.388 1.00 64.35 C ATOM 172 H VAL A 14 128.167 117.448 276.496 1.00 0.00 H ATOM 173 N GLU A 15 130.141 115.440 274.726 1.00 63.51 N ATOM 174 CA GLU A 15 131.241 114.766 274.040 1.00 63.67 C ATOM 175 C GLU A 15 132.215 114.100 275.007 1.00 71.04 C ATOM 176 O GLU A 15 132.822 113.073 274.655 1.00 57.11 O ATOM 177 CB GLU A 15 131.970 115.729 273.117 1.00 73.08 C ATOM 178 CG GLU A 15 131.554 115.487 271.639 1.00 96.84 C ATOM 179 CD GLU A 15 132.012 114.115 271.082 1.00113.05 C ATOM 180 OE1 GLU A 15 133.013 113.538 271.575 1.00116.88 O ATOM 181 OE2 GLU A 15 131.339 113.594 270.164 1.00119.90 O ATOM 182 H GLU A 15 130.155 116.468 274.882 1.00 0.00 H ATOM 183 N LEU A 16 132.381 114.647 276.219 1.00 53.66 N ATOM 184 CA LEU A 16 133.122 113.911 277.246 1.00 71.91 C ATOM 185 C LEU A 16 132.442 112.577 277.552 1.00 68.23 C ATOM 186 O LEU A 16 133.113 111.557 277.762 1.00 76.18 O ATOM 187 CB LEU A 16 133.253 114.758 278.518 1.00 66.05 C ATOM 188 CG LEU A 16 134.323 115.858 278.436 1.00 68.12 C ATOM 189 CD1 LEU A 16 134.495 116.558 279.768 1.00 60.02 C ATOM 190 CD2 LEU A 16 135.648 115.288 277.981 1.00 57.59 C ATOM 191 H LEU A 16 131.987 115.586 276.429 1.00 0.00 H ATOM 192 N ALA A 17 131.107 112.562 277.578 1.00 73.08 N ATOM 193 CA ALA A 17 130.376 111.329 277.876 1.00 67.96 C ATOM 194 C ALA A 17 130.460 110.329 276.719 1.00 70.05 C ATOM 195 O ALA A 17 130.696 109.129 276.933 1.00 71.89 O ATOM 196 CB ALA A 17 128.915 111.661 278.178 1.00 67.14 C ATOM 197 H ALA A 17 130.580 113.437 277.384 1.00 0.00 H ATOM 198 N GLU A 18 130.228 110.804 275.494 1.00 67.28 N ATOM 199 CA GLU A 18 130.380 109.958 274.312 1.00 74.85 C ATOM 200 C GLU A 18 131.749 109.301 274.281 1.00 67.24 C ATOM 201 O GLU A 18 131.867 108.077 274.119 1.00 69.98 O ATOM 202 CB GLU A 18 130.192 110.800 273.060 1.00 80.61 C ATOM 203 CG GLU A 18 128.767 111.009 272.653 1.00 89.57 C ATOM 204 CD GLU A 18 128.690 111.508 271.234 1.00 95.52 C ATOM 205 OE1 GLU A 18 127.644 112.064 270.846 1.00 95.79 O ATOM 206 OE2 GLU A 18 129.691 111.341 270.508 1.00101.39 O ATOM 207 H GLU A 18 129.934 111.795 275.378 1.00 0.00 H ATOM 208 N LYS A 19 132.804 110.115 274.422 1.00 73.15 N ATOM 209 CA LYS A 19 134.169 109.595 274.412 1.00 72.81 C ATOM 210 C LYS A 19 134.355 108.511 275.472 1.00 77.22 C ATOM 211 O LYS A 19 134.934 107.458 275.192 1.00 70.76 O ATOM 212 CB LYS A 19 135.161 110.741 274.633 1.00 76.22 C ATOM 213 CG LYS A 19 135.936 111.209 273.460 1.00 92.54 C ATOM 214 CD LYS A 19 137.000 110.247 273.231 1.00110.98 C ATOM 215 CE LYS A 19 137.150 110.076 271.780 1.00123.34 C ATOM 216 NZ LYS A 19 137.815 108.690 271.650 1.00132.13 N ATOM 217 HZ1 LYS A 19 138.729 108.698 272.145 1.00 0.00 H ATOM 218 HZ2 LYS A 19 137.196 107.969 272.073 1.00 0.00 H ATOM 219 HZ3 LYS A 19 137.966 108.472 270.644 1.00 0.00 H ATOM 220 H LYS A 19 132.648 111.136 274.541 1.00 0.00 H ATOM 221 N ALA A 20 133.824 108.721 276.685 1.00 77.31 N ATOM 222 CA ALA A 20 133.959 107.713 277.742 1.00 72.42 C ATOM 223 C ALA A 20 133.214 106.425 277.389 1.00 77.91 C ATOM 224 O ALA A 20 133.740 105.324 277.592 1.00 87.39 O ATOM 225 CB ALA A 20 133.474 108.273 279.085 1.00 77.93 C ATOM 226 H ALA A 20 133.312 109.606 276.878 1.00 0.00 H ATOM 227 N MET A 21 131.986 106.534 276.864 1.00 73.18 N ATOM 228 CA MET A 21 131.231 105.324 276.534 1.00 78.96 C ATOM 229 C MET A 21 131.946 104.527 275.460 1.00 85.14 C ATOM 230 O MET A 21 132.114 103.306 275.584 1.00 83.68 O ATOM 231 CB MET A 21 129.816 105.665 276.072 1.00 81.19 C ATOM 232 CG MET A 21 128.952 106.274 277.149 1.00 82.62 C ATOM 233 SD MET A 21 127.212 106.415 276.689 1.00 83.82 S ATOM 234 CE MET A 21 126.662 104.691 276.592 1.00 73.02 C ATOM 235 H MET A 21 131.572 107.472 276.692 1.00 0.00 H ATOM 236 N LYS A 22 132.389 105.208 274.398 1.00 78.99 N ATOM 237 CA LYS A 22 133.092 104.509 273.328 1.00 78.95 C ATOM 238 C LYS A 22 134.411 103.942 273.836 1.00 75.99 C ATOM 239 O LYS A 22 134.753 102.787 273.544 1.00 71.15 O ATOM 240 CB LYS A 22 133.311 105.444 272.136 1.00 77.19 C ATOM 241 CG LYS A 22 132.006 105.934 271.465 1.00 80.56 C ATOM 242 CD LYS A 22 132.289 106.862 270.261 1.00 77.09 C ATOM 243 CE LYS A 22 131.006 107.383 269.601 1.00 75.77 C ATOM 244 NZ LYS A 22 131.215 108.744 269.023 1.00 82.11 N ATOM 245 HZ1 LYS A 22 131.492 109.402 269.779 1.00 0.00 H ATOM 246 HZ2 LYS A 22 131.967 108.703 268.305 1.00 0.00 H ATOM 247 HZ3 LYS A 22 130.331 109.072 268.583 1.00 0.00 H ATOM 248 H LYS A 22 132.233 106.234 274.335 1.00 0.00 H ATOM 249 N GLU A 23 135.137 104.723 274.649 1.00 73.99 N ATOM 250 CA GLU A 23 136.380 104.230 275.237 1.00 81.81 C ATOM 251 C GLU A 23 136.153 102.909 275.965 1.00 93.11 C ATOM 252 O GLU A 23 136.954 101.976 275.838 1.00101.19 O ATOM 253 CB GLU A 23 136.968 105.287 276.182 1.00 86.44 C ATOM 254 CG GLU A 23 138.299 104.907 276.849 1.00 95.80 C ATOM 255 CD GLU A 23 138.620 105.737 278.101 1.00102.09 C ATOM 256 OE1 GLU A 23 137.754 106.523 278.562 1.00100.16 O ATOM 257 OE2 GLU A 23 139.751 105.599 278.623 1.00107.18 O ATOM 258 H GLU A 23 134.812 105.688 274.863 1.00 0.00 H ATOM 259 N TYR A 24 135.052 102.802 276.714 1.00 86.90 N ATOM 260 CA TYR A 24 134.712 101.577 277.427 1.00 92.59 C ATOM 261 C TYR A 24 133.818 100.648 276.601 1.00 97.72 C ATOM 262 O TYR A 24 133.203 99.730 277.155 1.00 94.09 O ATOM 263 CB TYR A 24 134.063 101.914 278.780 1.00 87.31 C ATOM 264 CG TYR A 24 135.054 102.426 279.831 1.00 87.70 C ATOM 265 CD1 TYR A 24 135.717 101.544 280.691 1.00 92.82 C ATOM 266 CD2 TYR A 24 135.326 103.791 279.961 1.00 81.34 C ATOM 267 CE1 TYR A 24 136.627 102.007 281.645 1.00 92.05 C ATOM 268 CE2 TYR A 24 136.236 104.259 280.903 1.00 88.48 C ATOM 269 CZ TYR A 24 136.879 103.365 281.743 1.00 95.74 C ATOM 270 OH TYR A 24 137.775 103.841 282.677 1.00102.77 O ATOM 271 HH TYR A 24 138.145 103.082 283.194 1.00 0.00 H ATOM 272 H TYR A 24 134.416 103.621 276.791 1.00 0.00 H ATOM 273 N GLY A 25 133.734 100.870 275.290 1.00102.97 N ATOM 274 CA GLY A 25 133.083 99.925 274.402 1.00105.98 C ATOM 275 C GLY A 25 131.571 99.962 274.378 1.00108.56 C ATOM 276 O GLY A 25 130.947 98.948 274.054 1.00111.78 O ATOM 277 H GLY A 25 134.144 101.740 274.894 1.00 0.00 H ATOM 278 N GLU A 26 130.957 101.102 274.698 1.00104.99 N ATOM 279 CA GLU A 26 129.509 101.247 274.637 1.00104.06 C ATOM 280 C GLU A 26 129.104 102.340 273.651 1.00102.27 C ATOM 281 O GLU A 26 129.868 103.267 273.367 1.00103.98 O ATOM 282 CB GLU A 26 128.934 101.552 276.014 1.00105.72 C ATOM 283 CG GLU A 26 128.520 100.314 276.748 1.00120.04 C ATOM 284 CD GLU A 26 128.382 100.568 278.220 1.00130.34 C ATOM 285 OE1 GLU A 26 127.811 99.700 278.916 1.00137.08 O ATOM 286 OE2 GLU A 26 128.841 101.644 278.672 1.00128.96 O ATOM 287 H GLU A 26 131.531 101.914 275.001 1.00 0.00 H ATOM 288 N ASP A 27 127.869 102.230 273.146 1.00100.39 N ATOM 289 CA ASP A 27 127.360 103.087 272.074 1.00101.17 C ATOM 290 C ASP A 27 126.235 103.979 272.583 1.00 93.83 C ATOM 291 O ASP A 27 125.152 103.476 272.929 1.00 90.22 O ATOM 292 CB ASP A 27 126.873 102.234 270.896 1.00105.35 C ATOM 293 CG ASP A 27 126.239 103.061 269.776 1.00107.80 C ATOM 294 OD1 ASP A 27 126.395 104.299 269.746 1.00104.69 O ATOM 295 OD2 ASP A 27 125.575 102.456 268.910 1.00114.53 O ATOM 296 H ASP A 27 127.240 101.499 273.535 1.00 0.00 H ATOM 297 N PRO A 28 126.439 105.300 272.595 1.00 85.73 N ATOM 298 CA PRO A 28 125.386 106.215 273.068 1.00 84.74 C ATOM 299 C PRO A 28 124.098 106.153 272.261 1.00 92.23 C ATOM 300 O PRO A 28 123.049 106.572 272.771 1.00 96.64 O ATOM 301 CB PRO A 28 126.044 107.601 272.944 1.00 85.14 C ATOM 302 CG PRO A 28 127.525 107.336 272.886 1.00 82.71 C ATOM 303 CD PRO A 28 127.662 106.018 272.189 1.00 86.82 C ATOM 304 N LYS A 29 124.144 105.671 271.015 1.00 96.98 N ATOM 305 CA LYS A 29 122.944 105.593 270.187 1.00 96.05 C ATOM 306 C LYS A 29 122.039 104.439 270.591 1.00 90.71 C ATOM 307 O LYS A 29 120.820 104.532 270.417 1.00 93.28 O ATOM 308 CB LYS A 29 123.320 105.450 268.704 1.00 99.16 C ATOM 309 CG LYS A 29 124.117 106.610 268.136 1.00102.41 C ATOM 310 CD LYS A 29 123.336 107.356 267.066 1.00106.05 C ATOM 311 CE LYS A 29 124.091 108.601 266.612 1.00105.64 C ATOM 312 NZ LYS A 29 123.178 109.745 266.333 1.00104.84 N ATOM 313 HZ1 LYS A 29 122.511 109.479 265.580 1.00 0.00 H ATOM 314 HZ2 LYS A 29 122.650 109.984 267.197 1.00 0.00 H ATOM 315 HZ3 LYS A 29 123.737 110.567 266.028 1.00 0.00 H ATOM 316 H LYS A 29 125.053 105.345 270.628 1.00 0.00 H ATOM 317 N ILE A 30 122.599 103.348 271.102 1.00 87.39 N ATOM 318 CA ILE A 30 121.812 102.189 271.502 1.00 90.75 C ATOM 319 C ILE A 30 121.497 102.221 272.991 1.00 96.85 C ATOM 320 O ILE A 30 120.342 102.081 273.393 1.00102.62 O ATOM 321 CB ILE A 30 122.528 100.879 271.103 1.00 89.59 C ATOM 322 H ILE A 30 123.632 103.320 271.220 1.00 0.00 H ATOM 323 N GLU A 31 122.512 102.426 273.827 1.00 93.85 N ATOM 324 CA GLU A 31 122.307 102.503 275.275 1.00 92.60 C ATOM 325 C GLU A 31 122.054 103.953 275.672 1.00 86.22 C ATOM 326 O GLU A 31 122.870 104.615 276.318 1.00 85.85 O ATOM 327 CB GLU A 31 123.504 101.931 276.012 1.00 98.88 C ATOM 328 CG GLU A 31 123.770 100.502 275.662 1.00115.63 C ATOM 329 CD GLU A 31 124.445 99.774 276.788 1.00130.65 C ATOM 330 OE1 GLU A 31 125.530 99.202 276.552 1.00136.78 O ATOM 331 OE2 GLU A 31 123.893 99.788 277.913 1.00135.29 O ATOM 332 H GLU A 31 123.473 102.534 273.443 1.00 0.00 H ATOM 333 N THR A 32 120.886 104.441 275.261 1.00 87.02 N ATOM 334 CA THR A 32 120.601 105.865 275.391 1.00 87.10 C ATOM 335 C THR A 32 120.317 106.256 276.836 1.00 88.86 C ATOM 336 O THR A 32 120.670 107.364 277.259 1.00 85.42 O ATOM 337 CB THR A 32 119.439 106.229 274.472 1.00 91.61 C ATOM 338 OG1 THR A 32 118.268 105.507 274.878 1.00 98.27 O ATOM 339 CG2 THR A 32 119.790 105.826 273.033 1.00 86.57 C ATOM 340 HG1 THR A 32 117.513 105.743 274.282 1.00 0.00 H ATOM 341 H THR A 32 120.175 103.805 274.846 1.00 0.00 H ATOM 342 N ASN A 33 119.709 105.362 277.615 1.00 89.06 N ATOM 343 CA ASN A 33 119.469 105.677 279.018 1.00 80.98 C ATOM 344 C ASN A 33 120.780 105.841 279.774 1.00 82.87 C ATOM 345 O ASN A 33 120.951 106.805 280.530 1.00 84.61 O ATOM 346 CB ASN A 33 118.600 104.599 279.656 1.00 77.99 C ATOM 347 CG ASN A 33 117.205 104.586 279.087 1.00 94.12 C ATOM 348 OD1 ASN A 33 116.421 105.510 279.325 1.00 92.05 O ATOM 349 ND2 ASN A 33 116.882 103.542 278.319 1.00107.74 N ATOM 350 HD22 ASN A 33 117.577 102.788 278.148 1.00 0.00 H ATOM 351 HD21 ASN A 33 115.935 103.483 277.892 1.00 0.00 H ATOM 352 H ASN A 33 119.408 104.446 277.225 1.00 0.00 H ATOM 353 N LYS A 34 121.728 104.922 279.570 1.00 78.53 N ATOM 354 CA LYS A 34 123.029 105.064 280.218 1.00 78.05 C ATOM 355 C LYS A 34 123.751 106.323 279.744 1.00 78.54 C ATOM 356 O LYS A 34 124.448 106.977 280.532 1.00 74.51 O ATOM 357 CB LYS A 34 123.872 103.815 279.957 1.00 87.31 C ATOM 358 CG LYS A 34 125.281 103.903 280.504 1.00 94.04 C ATOM 359 CD LYS A 34 126.063 102.630 280.251 1.00 99.50 C ATOM 360 CE LYS A 34 126.461 102.001 281.580 1.00108.04 C ATOM 361 NZ LYS A 34 127.616 101.067 281.435 1.00113.12 N ATOM 362 HZ1 LYS A 34 127.362 100.303 280.777 1.00 0.00 H ATOM 363 HZ2 LYS A 34 128.436 101.587 281.063 1.00 0.00 H ATOM 364 HZ3 LYS A 34 127.852 100.663 282.364 1.00 0.00 H ATOM 365 H LYS A 34 121.540 104.107 278.951 1.00 0.00 H ATOM 366 N PHE A 35 123.589 106.676 278.466 1.00 77.67 N ATOM 367 CA PHE A 35 124.095 107.949 277.956 1.00 72.26 C ATOM 368 C PHE A 35 123.585 109.116 278.795 1.00 73.72 C ATOM 369 O PHE A 35 124.359 109.992 279.203 1.00 67.91 O ATOM 370 CB PHE A 35 123.665 108.093 276.492 1.00 72.55 C ATOM 371 CG PHE A 35 124.263 109.263 275.779 1.00 72.65 C ATOM 372 CD1 PHE A 35 125.494 109.775 276.148 1.00 71.94 C ATOM 373 CD2 PHE A 35 123.594 109.836 274.707 1.00 73.75 C ATOM 374 CE1 PHE A 35 126.044 110.859 275.453 1.00 71.18 C ATOM 375 CE2 PHE A 35 124.133 110.912 274.021 1.00 74.60 C ATOM 376 CZ PHE A 35 125.360 111.422 274.400 1.00 72.61 C ATOM 377 H PHE A 35 123.092 106.031 277.819 1.00 0.00 H ATOM 378 N ALA A 36 122.277 109.140 279.065 1.00 76.82 N ATOM 379 CA ALA A 36 121.708 110.193 279.893 1.00 78.28 C ATOM 380 C ALA A 36 122.330 110.190 281.280 1.00 79.55 C ATOM 381 O ALA A 36 122.669 111.249 281.827 1.00 72.78 O ATOM 382 CB ALA A 36 120.197 110.007 279.990 1.00 77.27 C ATOM 383 H ALA A 36 121.659 108.398 278.679 1.00 0.00 H ATOM 384 N ALA A 37 122.491 108.996 281.853 1.00 79.20 N ATOM 385 CA ALA A 37 123.032 108.854 283.200 1.00 77.66 C ATOM 386 C ALA A 37 124.445 109.408 283.284 1.00 81.39 C ATOM 387 O ALA A 37 124.777 110.150 284.219 1.00 75.61 O ATOM 388 CB ALA A 37 123.009 107.377 283.603 1.00 67.59 C ATOM 389 H ALA A 37 122.223 108.142 281.324 1.00 0.00 H ATOM 390 N ILE A 38 125.285 109.084 282.288 1.00 77.25 N ATOM 391 CA ILE A 38 126.681 109.506 282.330 1.00 65.97 C ATOM 392 C ILE A 38 126.781 111.022 282.272 1.00 58.92 C ATOM 393 O ILE A 38 127.561 111.631 283.015 1.00 73.27 O ATOM 394 CB ILE A 38 127.485 108.821 281.207 1.00 70.65 C ATOM 395 CG1 ILE A 38 127.677 107.351 281.562 1.00 75.02 C ATOM 396 CG2 ILE A 38 128.843 109.474 281.020 1.00 59.70 C ATOM 397 CD1 ILE A 38 127.817 106.467 280.361 1.00 81.21 C ATOM 398 H ILE A 38 124.938 108.528 281.480 1.00 0.00 H ATOM 399 N CYS A 39 125.986 111.653 281.397 1.00 73.83 N ATOM 400 CA CYS A 39 125.986 113.110 281.283 1.00 65.29 C ATOM 401 C CYS A 39 125.501 113.742 282.581 1.00 67.46 C ATOM 402 O CYS A 39 126.025 114.773 283.023 1.00 64.46 O ATOM 403 CB CYS A 39 125.085 113.552 280.124 1.00 65.27 C ATOM 404 SG CYS A 39 125.615 113.124 278.426 1.00 66.96 S ATOM 405 H CYS A 39 125.356 111.094 280.786 1.00 0.00 H ATOM 406 N THR A 40 124.495 113.132 283.202 1.00 61.80 N ATOM 407 CA THR A 40 123.996 113.646 284.474 1.00 66.73 C ATOM 408 C THR A 40 125.074 113.582 285.539 1.00 64.18 C ATOM 409 O THR A 40 125.368 114.587 286.198 1.00 62.55 O ATOM 410 CB THR A 40 122.773 112.856 284.920 1.00 63.91 C ATOM 411 OG1 THR A 40 121.705 113.122 284.012 1.00 70.10 O ATOM 412 CG2 THR A 40 122.336 113.281 286.357 1.00 67.38 C ATOM 413 HG1 THR A 40 121.972 112.845 283.100 1.00 0.00 H ATOM 414 H THR A 40 124.062 112.286 282.780 1.00 0.00 H ATOM 415 N HIS A 41 125.656 112.391 285.733 1.00 63.41 N ATOM 416 CA HIS A 41 126.764 112.227 286.670 1.00 67.64 C ATOM 417 C HIS A 41 127.884 113.205 286.347 1.00 66.28 C ATOM 418 O HIS A 41 128.421 113.883 287.238 1.00 63.25 O ATOM 419 CB HIS A 41 127.267 110.782 286.608 1.00 72.35 C ATOM 420 CG HIS A 41 128.393 110.480 287.548 1.00 80.29 C ATOM 421 ND1 HIS A 41 129.718 110.626 287.191 1.00 73.26 N ATOM 422 CD2 HIS A 41 128.396 109.964 288.802 1.00 76.31 C ATOM 423 CE1 HIS A 41 130.487 110.262 288.202 1.00 75.84 C ATOM 424 NE2 HIS A 41 129.710 109.849 289.189 1.00 79.85 N ATOM 425 H HIS A 41 125.311 111.565 285.204 1.00 0.00 H ATOM 426 N LEU A 42 128.217 113.329 285.069 1.00 58.95 N ATOM 427 CA LEU A 42 129.262 114.261 284.683 1.00 56.42 C ATOM 428 C LEU A 42 128.938 115.678 285.153 1.00 66.87 C ATOM 429 O LEU A 42 129.797 116.376 285.717 1.00 67.75 O ATOM 430 CB LEU A 42 129.452 114.237 283.155 1.00 54.72 C ATOM 431 CG LEU A 42 130.857 114.647 282.728 1.00 74.23 C ATOM 432 CD1 LEU A 42 131.905 113.955 283.578 1.00 64.79 C ATOM 433 CD2 LEU A 42 131.076 114.345 281.244 1.00 74.46 C ATOM 434 H LEU A 42 127.731 112.761 284.346 1.00 0.00 H ATOM 435 N GLU A 43 127.715 116.145 284.879 1.00 68.16 N ATOM 436 CA GLU A 43 127.386 117.531 285.196 1.00 64.50 C ATOM 437 C GLU A 43 127.405 117.749 286.705 1.00 63.82 C ATOM 438 O GLU A 43 127.818 118.814 287.188 1.00 57.67 O ATOM 439 CB GLU A 43 126.024 117.907 284.598 1.00 62.71 C ATOM 440 CG GLU A 43 125.688 119.396 284.711 1.00 72.45 C ATOM 441 CD GLU A 43 124.374 119.780 284.038 1.00 83.51 C ATOM 442 OE1 GLU A 43 123.638 118.876 283.599 1.00 88.07 O ATOM 443 OE2 GLU A 43 124.055 120.988 283.972 1.00 90.35 O ATOM 444 H GLU A 43 127.003 115.525 284.443 1.00 0.00 H ATOM 445 N VAL A 44 127.012 116.727 287.464 1.00 59.64 N ATOM 446 CA VAL A 44 127.028 116.848 288.919 1.00 60.59 C ATOM 447 C VAL A 44 128.463 116.976 289.401 1.00 66.64 C ATOM 448 O VAL A 44 128.772 117.807 290.264 1.00 73.45 O ATOM 449 CB VAL A 44 126.319 115.647 289.574 1.00 63.03 C ATOM 450 CG1 VAL A 44 126.505 115.688 291.090 1.00 68.18 C ATOM 451 CG2 VAL A 44 124.834 115.660 289.262 1.00 65.44 C ATOM 452 H VAL A 44 126.694 115.842 287.020 1.00 0.00 H ATOM 453 N CYS A 45 129.369 116.180 288.819 1.00 63.78 N ATOM 454 CA CYS A 45 130.780 116.289 289.157 1.00 59.83 C ATOM 455 C CYS A 45 131.291 117.704 288.909 1.00 66.55 C ATOM 456 O CYS A 45 132.006 118.269 289.747 1.00 63.69 O ATOM 457 CB CYS A 45 131.590 115.266 288.351 1.00 67.09 C ATOM 458 SG CYS A 45 131.405 113.538 288.916 1.00 71.39 S ATOM 459 H CYS A 45 129.061 115.476 288.118 1.00 0.00 H ATOM 460 N PHE A 46 130.918 118.310 287.780 1.00 54.41 N ATOM 461 CA PHE A 46 131.406 119.653 287.497 1.00 53.66 C ATOM 462 C PHE A 46 130.784 120.695 288.429 1.00 69.31 C ATOM 463 O PHE A 46 131.477 121.597 288.914 1.00 54.41 O ATOM 464 CB PHE A 46 131.131 120.001 286.039 1.00 60.95 C ATOM 465 CG PHE A 46 132.052 119.316 285.077 1.00 73.62 C ATOM 466 CD1 PHE A 46 133.393 119.161 285.369 1.00 89.74 C ATOM 467 CD2 PHE A 46 131.577 118.822 283.882 1.00 80.62 C ATOM 468 CE1 PHE A 46 134.253 118.532 284.463 1.00 93.50 C ATOM 469 CE2 PHE A 46 132.430 118.192 282.965 1.00 76.48 C ATOM 470 CZ PHE A 46 133.763 118.043 283.265 1.00 82.89 C ATOM 471 H PHE A 46 130.286 117.828 287.109 1.00 0.00 H ATOM 472 N MET A 47 129.466 120.636 288.638 1.00 54.47 N ATOM 473 CA MET A 47 128.848 121.539 289.603 1.00 82.12 C ATOM 474 C MET A 47 129.477 121.374 290.978 1.00 56.58 C ATOM 475 O MET A 47 129.807 122.361 291.636 1.00 63.47 O ATOM 476 CB MET A 47 127.342 121.303 289.673 1.00 72.68 C ATOM 477 CG MET A 47 126.605 121.573 288.367 1.00 67.11 C ATOM 478 SD MET A 47 124.898 120.961 288.496 1.00 75.15 S ATOM 479 CE MET A 47 124.009 122.464 288.885 1.00 80.98 C ATOM 480 H MET A 47 128.884 119.950 288.116 1.00 0.00 H ATOM 481 N TYR A 48 129.712 120.132 291.392 1.00 59.61 N ATOM 482 CA TYR A 48 130.346 119.867 292.684 1.00 62.22 C ATOM 483 C TYR A 48 131.695 120.575 292.799 1.00 70.90 C ATOM 484 O TYR A 48 131.948 121.299 293.771 1.00 72.23 O ATOM 485 CB TYR A 48 130.491 118.362 292.868 1.00 66.01 C ATOM 486 CG TYR A 48 130.571 117.885 294.315 1.00 74.16 C ATOM 487 CD1 TYR A 48 131.741 118.019 295.042 1.00 62.45 C ATOM 488 CD2 TYR A 48 129.480 117.279 294.932 1.00 69.88 C ATOM 489 CE1 TYR A 48 131.837 117.565 296.324 1.00 73.64 C ATOM 490 CE2 TYR A 48 129.568 116.826 296.228 1.00 78.76 C ATOM 491 CZ TYR A 48 130.752 116.977 296.924 1.00 78.71 C ATOM 492 OH TYR A 48 130.859 116.531 298.229 1.00 76.73 O ATOM 493 HH TYR A 48 130.691 115.556 298.258 1.00 0.00 H ATOM 494 H TYR A 48 129.440 119.333 290.785 1.00 0.00 H ATOM 495 N SER A 49 132.565 120.413 291.794 1.00 62.43 N ATOM 496 CA SER A 49 133.877 121.050 291.839 1.00 64.32 C ATOM 497 C SER A 49 133.805 122.572 291.768 1.00 65.19 C ATOM 498 O SER A 49 134.757 123.238 292.192 1.00 72.54 O ATOM 499 CB SER A 49 134.758 120.542 290.700 1.00 67.58 C ATOM 500 OG SER A 49 134.217 120.995 289.482 1.00 64.12 O ATOM 501 HG SER A 49 133.297 120.645 289.380 1.00 0.00 H ATOM 502 H SER A 49 132.303 119.828 290.975 1.00 0.00 H ATOM 503 N ASP A 50 132.723 123.143 291.221 1.00 58.65 N ATOM 504 CA ASP A 50 132.521 124.588 291.297 1.00 63.54 C ATOM 505 C ASP A 50 131.991 125.044 292.652 1.00 77.04 C ATOM 506 O ASP A 50 131.854 126.253 292.875 1.00 72.45 O ATOM 507 CB ASP A 50 131.544 125.050 290.215 1.00 78.22 C ATOM 508 CG ASP A 50 132.022 124.710 288.814 1.00106.11 C ATOM 509 OD1 ASP A 50 133.156 124.193 288.668 1.00111.59 O ATOM 510 OD2 ASP A 50 131.262 124.957 287.854 1.00110.48 O ATOM 511 H ASP A 50 132.019 122.550 290.737 1.00 0.00 H ATOM 512 N GLY A 51 131.651 124.106 293.541 1.00 81.72 N ATOM 513 CA GLY A 51 131.062 124.482 294.811 1.00 85.21 C ATOM 514 C GLY A 51 132.072 125.015 295.805 1.00 92.52 C ATOM 515 O GLY A 51 131.741 125.868 296.635 1.00 93.45 O ATOM 516 H GLY A 51 131.810 123.102 293.321 1.00 0.00 H ATOM 517 N GLY A 52 133.307 124.533 295.738 1.00 96.19 N ATOM 518 CA GLY A 52 134.323 124.939 296.680 1.00104.19 C ATOM 519 C GLY A 52 134.978 126.242 296.277 1.00110.47 C ATOM 520 O GLY A 52 134.516 126.974 295.398 1.00112.31 O ATOM 521 H GLY A 52 133.548 123.849 294.992 1.00 0.00 H ATOM 522 N SER A 53 136.084 126.534 296.951 1.00112.71 N ATOM 523 CA SER A 53 136.910 127.654 296.549 1.00115.81 C ATOM 524 C SER A 53 137.600 127.348 295.218 1.00116.46 C ATOM 525 O SER A 53 137.589 126.213 294.727 1.00114.59 O ATOM 526 CB SER A 53 137.935 127.967 297.631 1.00119.01 C ATOM 527 OG SER A 53 139.012 127.053 297.552 1.00122.22 O ATOM 528 HG SER A 53 139.674 127.263 298.258 1.00 0.00 H ATOM 529 H SER A 53 136.358 125.956 297.771 1.00 0.00 H ATOM 530 N LYS A 73 138.237 128.386 294.660 1.00118.58 N ATOM 531 CA LYS A 73 138.695 128.368 293.270 1.00115.80 C ATOM 532 C LYS A 73 139.473 127.101 292.923 1.00107.33 C ATOM 533 O LYS A 73 139.232 126.480 291.880 1.00 99.67 O ATOM 534 CB LYS A 73 139.553 129.608 292.986 1.00116.49 C ATOM 535 H LYS A 73 138.412 129.235 295.235 1.00 0.00 H ATOM 536 N HIS A 74 140.391 126.688 293.789 1.00108.50 N ATOM 537 CA HIS A 74 141.333 125.623 293.467 1.00112.26 C ATOM 538 C HIS A 74 141.363 124.571 294.573 1.00104.42 C ATOM 539 O HIS A 74 142.419 124.208 295.103 1.00108.54 O ATOM 540 CB HIS A 74 142.708 126.236 293.208 1.00125.48 C ATOM 541 CG HIS A 74 142.832 126.897 291.867 1.00132.51 C ATOM 542 ND1 HIS A 74 142.465 126.273 290.693 1.00132.28 N ATOM 543 CD2 HIS A 74 143.281 128.126 291.513 1.00135.45 C ATOM 544 CE1 HIS A 74 142.681 127.087 289.675 1.00132.07 C ATOM 545 NE2 HIS A 74 143.176 128.218 290.145 1.00133.77 N ATOM 546 H HIS A 74 140.439 127.138 294.725 1.00 0.00 H ATOM 547 N ARG A 75 140.178 124.061 294.923 1.00 87.72 N ATOM 548 CA ARG A 75 140.024 123.091 295.998 1.00 74.48 C ATOM 549 C ARG A 75 139.793 121.672 295.491 1.00 67.47 C ATOM 550 O ARG A 75 140.256 120.706 296.106 1.00 74.56 O ATOM 551 CB ARG A 75 138.858 123.495 296.914 1.00 74.06 C ATOM 552 CG ARG A 75 138.115 122.317 297.525 1.00 77.77 C ATOM 553 CD ARG A 75 137.198 122.723 298.684 1.00 77.44 C ATOM 554 NE ARG A 75 136.884 121.592 299.556 1.00 79.30 N ATOM 555 CZ ARG A 75 135.985 121.655 300.534 1.00 87.17 C ATOM 556 NH1 ARG A 75 135.329 122.791 300.742 1.00 90.25 N ATOM 557 NH2 ARG A 75 135.746 120.601 301.301 1.00 73.71 N ATOM 558 HE ARG A 75 137.388 120.695 299.404 1.00 0.00 H ATOM 559 HH12 ARG A 75 134.624 122.852 301.504 1.00 0.00 H ATOM 560 HH11 ARG A 75 135.521 123.619 300.143 1.00 0.00 H ATOM 561 HH22 ARG A 75 135.041 120.662 302.063 1.00 0.00 H ATOM 562 HH21 ARG A 75 136.264 119.713 301.141 1.00 0.00 H ATOM 563 H ARG A 75 139.330 124.370 294.406 1.00 0.00 H ATOM 564 N PHE A 76 139.090 121.512 294.383 1.00 70.51 N ATOM 565 CA PHE A 76 138.778 120.193 293.850 1.00 75.00 C ATOM 566 C PHE A 76 139.580 119.923 292.584 1.00 80.11 C ATOM 567 O PHE A 76 139.752 120.808 291.744 1.00 74.05 O ATOM 568 CB PHE A 76 137.283 120.064 293.563 1.00 77.00 C ATOM 569 CG PHE A 76 136.438 120.113 294.800 1.00 80.80 C ATOM 570 CD1 PHE A 76 136.327 118.999 295.621 1.00 86.25 C ATOM 571 CD2 PHE A 76 135.772 121.276 295.155 1.00 71.27 C ATOM 572 CE1 PHE A 76 135.546 119.032 296.777 1.00 83.14 C ATOM 573 CE2 PHE A 76 134.985 121.320 296.314 1.00 79.84 C ATOM 574 CZ PHE A 76 134.878 120.199 297.128 1.00 78.28 C ATOM 575 H PHE A 76 138.749 122.354 293.876 1.00 0.00 H ATOM 576 N GLU A 77 140.078 118.697 292.467 1.00 81.35 N ATOM 577 CA GLU A 77 140.644 118.170 291.234 1.00 76.57 C ATOM 578 C GLU A 77 139.622 117.212 290.621 1.00 75.18 C ATOM 579 O GLU A 77 139.079 116.344 291.315 1.00 81.27 O ATOM 580 CB GLU A 77 141.982 117.481 291.528 1.00 75.36 C ATOM 581 CG GLU A 77 142.734 116.992 290.322 1.00 78.41 C ATOM 582 CD GLU A 77 143.514 118.099 289.646 1.00 80.26 C ATOM 583 OE1 GLU A 77 143.029 118.544 288.588 1.00 74.44 O ATOM 584 OE2 GLU A 77 144.593 118.515 290.153 1.00 84.12 O ATOM 585 H GLU A 77 140.063 118.079 293.303 1.00 0.00 H ATOM 586 N ILE A 78 139.310 117.411 289.348 1.00 64.28 N ATOM 587 CA ILE A 78 138.314 116.599 288.648 1.00 73.09 C ATOM 588 C ILE A 78 139.007 115.406 288.003 1.00 69.70 C ATOM 589 O ILE A 78 139.928 115.582 287.202 1.00 76.15 O ATOM 590 CB ILE A 78 137.573 117.430 287.593 1.00 87.52 C ATOM 591 CG1 ILE A 78 137.027 118.718 288.228 1.00 89.16 C ATOM 592 CG2 ILE A 78 136.473 116.591 286.949 1.00 91.33 C ATOM 593 CD1 ILE A 78 136.214 119.604 287.292 1.00 85.97 C ATOM 594 H ILE A 78 139.791 118.172 288.828 1.00 0.00 H ATOM 595 N ILE A 79 138.557 114.198 288.332 1.00 64.92 N ATOM 596 CA ILE A 79 139.111 112.973 287.756 1.00 73.30 C ATOM 597 C ILE A 79 138.186 112.375 286.700 1.00 68.12 C ATOM 598 O ILE A 79 138.654 111.849 285.689 1.00 69.81 O ATOM 599 CB ILE A 79 139.411 111.936 288.865 1.00 73.86 C ATOM 600 CG1 ILE A 79 140.075 112.591 290.082 1.00 80.97 C ATOM 601 CG2 ILE A 79 140.255 110.771 288.313 1.00 68.65 C ATOM 602 CD1 ILE A 79 141.433 113.185 289.804 1.00 77.40 C ATOM 603 H ILE A 79 137.784 114.122 289.023 1.00 0.00 H ATOM 604 N GLU A 80 136.881 112.375 286.976 1.00 67.33 N ATOM 605 CA GLU A 80 135.887 111.910 286.025 1.00 71.43 C ATOM 606 C GLU A 80 135.945 112.781 284.780 1.00 73.74 C ATOM 607 O GLU A 80 136.309 113.958 284.846 1.00 63.32 O ATOM 608 CB GLU A 80 134.497 111.959 286.670 1.00 68.66 C ATOM 609 CG GLU A 80 133.347 111.254 285.939 1.00 71.78 C ATOM 610 CD GLU A 80 133.613 109.781 285.677 1.00 80.33 C ATOM 611 OE1 GLU A 80 134.389 109.449 284.739 1.00 77.99 O ATOM 612 OE2 GLU A 80 133.058 108.960 286.430 1.00 76.42 O ATOM 613 H GLU A 80 136.564 112.720 287.905 1.00 0.00 H ATOM 614 N GLY A 81 135.607 112.189 283.637 1.00 74.93 N ATOM 615 CA GLY A 81 135.672 112.873 282.367 1.00 72.98 C ATOM 616 C GLY A 81 136.989 112.724 281.630 1.00 79.64 C ATOM 617 O GLY A 81 137.019 112.861 280.400 1.00 73.12 O ATOM 618 H GLY A 81 135.285 111.200 283.659 1.00 0.00 H ATOM 619 N ARG A 82 138.076 112.446 282.340 1.00 81.23 N ATOM 620 CA ARG A 82 139.362 112.245 281.692 1.00 76.99 C ATOM 621 C ARG A 82 139.441 110.847 281.096 1.00 76.84 C ATOM 622 O ARG A 82 138.793 109.912 281.569 1.00 67.92 O ATOM 623 CB ARG A 82 140.498 112.423 282.693 1.00 79.83 C ATOM 624 CG ARG A 82 140.641 113.813 283.251 1.00 73.81 C ATOM 625 CD ARG A 82 141.734 113.828 284.306 1.00 71.49 C ATOM 626 NE ARG A 82 141.689 115.039 285.118 1.00 70.64 N ATOM 627 CZ ARG A 82 142.354 116.157 284.846 1.00 75.17 C ATOM 628 NH1 ARG A 82 143.142 116.230 283.775 1.00 67.12 N ATOM 629 NH2 ARG A 82 142.232 117.204 285.652 1.00 81.19 N ATOM 630 HE ARG A 82 141.094 115.027 285.971 1.00 0.00 H ATOM 631 HH12 ARG A 82 143.659 117.108 283.569 1.00 0.00 H ATOM 632 HH11 ARG A 82 143.240 115.409 283.145 1.00 0.00 H ATOM 633 HH22 ARG A 82 142.749 118.082 285.446 1.00 0.00 H ATOM 634 HH21 ARG A 82 141.619 117.146 286.490 1.00 0.00 H ATOM 635 H ARG A 82 138.007 112.371 283.375 1.00 0.00 H ATOM 636 N ASP A 83 140.262 110.697 280.058 1.00 70.79 N ATOM 637 CA ASP A 83 140.497 109.352 279.556 1.00 74.97 C ATOM 638 C ASP A 83 141.171 108.515 280.639 1.00 80.12 C ATOM 639 O ASP A 83 141.919 109.032 281.473 1.00 82.21 O ATOM 640 CB ASP A 83 141.349 109.386 278.287 1.00 89.91 C ATOM 641 CG ASP A 83 142.818 109.459 278.587 1.00 99.25 C ATOM 642 OD1 ASP A 83 143.451 108.388 278.737 1.00104.53 O ATOM 643 OD2 ASP A 83 143.336 110.590 278.667 1.00103.97 O ATOM 644 H ASP A 83 140.723 111.519 279.618 1.00 0.00 H ATOM 645 N ARG A 84 140.893 107.207 280.621 1.00 80.23 N ATOM 646 CA ARG A 84 141.263 106.347 281.744 1.00 81.12 C ATOM 647 C ARG A 84 142.736 106.502 282.126 1.00 89.45 C ATOM 648 O ARG A 84 143.071 106.558 283.315 1.00 88.51 O ATOM 649 CB ARG A 84 140.936 104.886 281.413 1.00 84.00 C ATOM 650 H ARG A 84 140.408 106.796 279.798 1.00 0.00 H ATOM 651 N ILE A 85 143.628 106.609 281.136 1.00 90.33 N ATOM 652 CA ILE A 85 145.059 106.651 281.437 1.00 91.65 C ATOM 653 C ILE A 85 145.435 107.967 282.109 1.00 87.19 C ATOM 654 O ILE A 85 146.171 107.981 283.103 1.00 95.58 O ATOM 655 CB ILE A 85 145.887 106.413 280.160 1.00 98.66 C ATOM 656 CG1 ILE A 85 145.739 104.961 279.697 1.00104.16 C ATOM 657 CG2 ILE A 85 147.356 106.752 280.403 1.00 91.77 C ATOM 658 CD1 ILE A 85 144.713 104.783 278.585 1.00103.63 C ATOM 659 H ILE A 85 143.304 106.663 280.149 1.00 0.00 H ATOM 660 N MET A 86 144.941 109.091 281.588 1.00 81.81 N ATOM 661 CA MET A 86 145.256 110.368 282.219 1.00 80.86 C ATOM 662 C MET A 86 144.637 110.489 283.607 1.00 77.55 C ATOM 663 O MET A 86 145.225 111.131 284.484 1.00 72.93 O ATOM 664 CB MET A 86 144.786 111.532 281.359 1.00 89.36 C ATOM 665 CG MET A 86 145.333 112.886 281.817 1.00104.79 C ATOM 666 SD MET A 86 147.143 112.920 281.879 1.00117.44 S ATOM 667 CE MET A 86 147.446 114.495 282.681 1.00118.75 C ATOM 668 H MET A 86 144.338 109.057 280.741 1.00 0.00 H ATOM 669 N ALA A 87 143.435 109.933 283.814 1.00 62.48 N ATOM 670 CA ALA A 87 142.809 110.019 285.129 1.00 77.13 C ATOM 671 C ALA A 87 143.643 109.292 286.178 1.00 84.32 C ATOM 672 O ALA A 87 143.711 109.729 287.332 1.00 86.42 O ATOM 673 CB ALA A 87 141.383 109.452 285.088 1.00 67.65 C ATOM 674 H ALA A 87 142.949 109.441 283.038 1.00 0.00 H ATOM 675 N TRP A 88 144.300 108.200 285.789 1.00 87.83 N ATOM 676 CA TRP A 88 145.147 107.467 286.720 1.00 89.28 C ATOM 677 C TRP A 88 146.472 108.185 286.963 1.00 88.47 C ATOM 678 O TRP A 88 146.993 108.164 288.089 1.00 90.27 O ATOM 679 CB TRP A 88 145.377 106.047 286.192 1.00 86.31 C ATOM 680 CG TRP A 88 144.319 105.086 286.647 1.00 91.82 C ATOM 681 CD1 TRP A 88 143.424 104.401 285.869 1.00 93.90 C ATOM 682 CD2 TRP A 88 144.045 104.713 287.998 1.00 85.66 C ATOM 683 NE1 TRP A 88 142.609 103.615 286.665 1.00 92.60 N ATOM 684 CE2 TRP A 88 142.970 103.797 287.975 1.00 91.28 C ATOM 685 CE3 TRP A 88 144.603 105.066 289.229 1.00 91.91 C ATOM 686 CZ2 TRP A 88 142.450 103.231 289.137 1.00 90.92 C ATOM 687 CZ3 TRP A 88 144.080 104.508 290.385 1.00 90.40 C ATOM 688 CH2 TRP A 88 143.017 103.600 290.328 1.00 89.88 C ATOM 689 HE1 TRP A 88 141.850 102.991 286.326 1.00 0.00 H ATOM 690 H TRP A 88 144.207 107.867 284.808 1.00 0.00 H ATOM 691 N THR A 89 147.007 108.834 285.928 1.00 71.44 N ATOM 692 CA THR A 89 148.222 109.634 286.064 1.00 74.83 C ATOM 693 C THR A 89 148.080 110.706 287.141 1.00 78.83 C ATOM 694 O THR A 89 149.000 110.909 287.947 1.00 79.10 O ATOM 695 CB THR A 89 148.556 110.276 284.715 1.00 79.77 C ATOM 696 OG1 THR A 89 148.425 109.289 283.682 1.00 83.76 O ATOM 697 CG2 THR A 89 149.976 110.854 284.702 1.00 77.82 C ATOM 698 HG1 THR A 89 147.496 108.948 283.669 1.00 0.00 H ATOM 699 H THR A 89 146.546 108.769 284.998 1.00 0.00 H ATOM 700 N VAL A 90 146.943 111.416 287.161 1.00 76.03 N ATOM 701 CA VAL A 90 146.781 112.532 288.096 1.00 79.15 C ATOM 702 C VAL A 90 146.564 112.026 289.524 1.00 72.80 C ATOM 703 O VAL A 90 147.006 112.667 290.488 1.00 71.32 O ATOM 704 CB VAL A 90 145.641 113.474 287.644 1.00 82.02 C ATOM 705 CG1 VAL A 90 144.354 112.704 287.437 1.00 88.58 C ATOM 706 CG2 VAL A 90 145.405 114.585 288.668 1.00 78.82 C ATOM 707 H VAL A 90 146.171 111.173 286.508 1.00 0.00 H ATOM 708 N VAL A 91 145.909 110.879 289.699 1.00 69.62 N ATOM 709 CA VAL A 91 145.691 110.401 291.062 1.00 75.74 C ATOM 710 C VAL A 91 146.978 109.809 291.632 1.00 80.49 C ATOM 711 O VAL A 91 147.207 109.828 292.842 1.00 87.91 O ATOM 712 CB VAL A 91 144.527 109.394 291.127 1.00 81.64 C ATOM 713 CG1 VAL A 91 143.255 109.942 290.519 1.00 77.68 C ATOM 714 CG2 VAL A 91 144.913 108.134 290.419 1.00101.56 C ATOM 715 H VAL A 91 145.561 110.336 288.883 1.00 0.00 H ATOM 716 N ASN A 92 147.840 109.272 290.776 1.00 82.71 N ATOM 717 CA ASN A 92 149.167 108.885 291.252 1.00 89.11 C ATOM 718 C ASN A 92 149.967 110.110 291.658 1.00 89.60 C ATOM 719 O ASN A 92 150.671 110.084 292.673 1.00 87.60 O ATOM 720 CB ASN A 92 149.933 108.076 290.192 1.00104.81 C ATOM 721 CG ASN A 92 149.215 106.817 289.788 1.00118.70 C ATOM 722 OD1 ASN A 92 148.091 106.555 290.232 1.00125.73 O ATOM 723 ND2 ASN A 92 149.865 106.011 288.972 1.00122.76 N ATOM 724 HD22 ASN A 92 150.809 106.274 288.624 1.00 0.00 H ATOM 725 HD21 ASN A 92 149.434 105.112 288.676 1.00 0.00 H ATOM 726 H ASN A 92 147.575 109.129 289.781 1.00 0.00 H ATOM 727 N SER A 93 149.869 111.195 290.881 1.00 82.74 N ATOM 728 CA SER A 93 150.477 112.453 291.298 1.00 77.51 C ATOM 729 C SER A 93 149.909 112.907 292.632 1.00 75.11 C ATOM 730 O SER A 93 150.652 113.296 293.538 1.00 74.54 O ATOM 731 CB SER A 93 150.250 113.532 290.234 1.00 82.41 C ATOM 732 OG SER A 93 150.836 113.151 289.013 1.00 70.60 O ATOM 733 HG SER A 93 150.430 112.303 288.704 1.00 0.00 H ATOM 734 H SER A 93 149.358 111.141 289.977 1.00 0.00 H ATOM 735 N ILE A 94 148.582 112.884 292.752 1.00 71.34 N ATOM 736 CA ILE A 94 147.923 113.281 293.993 1.00 76.23 C ATOM 737 C ILE A 94 148.378 112.390 295.148 1.00 81.03 C ATOM 738 O ILE A 94 148.704 112.879 296.235 1.00 75.81 O ATOM 739 CB ILE A 94 146.392 113.253 293.808 1.00 69.99 C ATOM 740 CG1 ILE A 94 145.930 114.518 293.072 1.00 74.45 C ATOM 741 CG2 ILE A 94 145.670 113.070 295.157 1.00 71.13 C ATOM 742 CD1 ILE A 94 144.473 114.502 292.707 1.00 73.09 C ATOM 743 H ILE A 94 148.003 112.577 291.944 1.00 0.00 H ATOM 744 N CYS A 95 148.450 111.078 294.912 1.00 82.21 N ATOM 745 CA CYS A 95 148.885 110.141 295.947 1.00 90.81 C ATOM 746 C CYS A 95 150.338 110.385 296.349 1.00 93.65 C ATOM 747 O CYS A 95 150.651 110.536 297.539 1.00 88.21 O ATOM 748 CB CYS A 95 148.704 108.703 295.456 1.00 92.85 C ATOM 749 SG CYS A 95 146.982 108.136 295.346 1.00 92.59 S ATOM 750 H CYS A 95 148.191 110.715 293.972 1.00 0.00 H ATOM 751 N ASN A 96 151.246 110.427 295.367 1.00 88.65 N ATOM 752 CA ASN A 96 152.663 110.608 295.663 1.00 98.88 C ATOM 753 C ASN A 96 152.977 111.999 296.185 1.00 99.77 C ATOM 754 O ASN A 96 154.139 112.272 296.509 1.00109.62 O ATOM 755 CB ASN A 96 153.509 110.318 294.418 1.00112.50 C ATOM 756 CG ASN A 96 153.571 108.831 294.082 1.00122.45 C ATOM 757 OD1 ASN A 96 152.571 108.225 293.689 1.00122.63 O ATOM 758 ND2 ASN A 96 154.753 108.238 294.235 1.00127.75 N ATOM 759 HD22 ASN A 96 155.571 108.787 294.569 1.00 0.00 H ATOM 760 HD21 ASN A 96 154.859 107.226 294.020 1.00 0.00 H ATOM 761 H ASN A 96 150.937 110.329 294.379 1.00 0.00 H ATOM 762 N THR A 97 151.978 112.877 296.262 1.00 91.50 N ATOM 763 CA THR A 97 152.127 114.212 296.817 1.00 93.40 C ATOM 764 C THR A 97 151.412 114.383 298.152 1.00 92.26 C ATOM 765 O THR A 97 151.859 115.183 298.978 1.00 87.83 O ATOM 766 CB THR A 97 151.622 115.255 295.802 1.00 94.56 C ATOM 767 OG1 THR A 97 152.641 115.482 294.815 1.00102.09 O ATOM 768 CG2 THR A 97 151.224 116.589 296.461 1.00 89.37 C ATOM 769 HG1 THR A 97 152.321 116.152 294.160 1.00 0.00 H ATOM 770 H THR A 97 151.043 112.592 295.907 1.00 0.00 H ATOM 771 N THR A 98 150.342 113.618 298.398 1.00 95.52 N ATOM 772 CA THR A 98 149.585 113.685 299.642 1.00 98.88 C ATOM 773 C THR A 98 149.931 112.563 300.612 1.00101.50 C ATOM 774 O THR A 98 149.476 112.595 301.761 1.00 93.00 O ATOM 775 CB THR A 98 148.079 113.612 299.365 1.00 98.44 C ATOM 776 OG1 THR A 98 147.812 112.475 298.534 1.00 97.47 O ATOM 777 CG2 THR A 98 147.618 114.873 298.642 1.00 99.84 C ATOM 778 HG1 THR A 98 148.305 112.568 297.681 1.00 0.00 H ATOM 779 H THR A 98 150.036 112.944 297.667 1.00 0.00 H ATOM 780 N GLY A 99 150.694 111.566 300.175 1.00106.32 N ATOM 781 CA GLY A 99 150.818 110.351 300.951 1.00116.52 C ATOM 782 C GLY A 99 149.492 109.676 301.217 1.00121.63 C ATOM 783 O GLY A 99 149.334 109.022 302.254 1.00126.40 O ATOM 784 H GLY A 99 151.203 111.660 299.273 1.00 0.00 H ATOM 785 N VAL A 100 148.518 109.833 300.312 1.00113.44 N ATOM 786 CA VAL A 100 147.241 109.139 300.423 1.00106.99 C ATOM 787 C VAL A 100 147.315 107.856 299.602 1.00106.91 C ATOM 788 O VAL A 100 148.013 107.782 298.580 1.00 96.12 O ATOM 789 CB VAL A 100 146.061 110.029 299.979 1.00 92.84 C ATOM 790 H VAL A 100 148.677 110.470 299.505 1.00 0.00 H ATOM 791 N GLU A 101 146.596 106.833 300.066 1.00105.65 N ATOM 792 CA GLU A 101 146.660 105.504 299.465 1.00105.64 C ATOM 793 C GLU A 101 145.972 105.493 298.101 1.00104.80 C ATOM 794 O GLU A 101 144.947 106.148 297.896 1.00105.68 O ATOM 795 CB GLU A 101 146.023 104.468 300.410 1.00104.71 C ATOM 796 H GLU A 101 145.970 106.987 300.882 1.00 0.00 H ATOM 797 N LYS A 102 146.553 104.757 297.159 1.00106.21 N ATOM 798 CA LYS A 102 146.025 104.710 295.800 1.00108.80 C ATOM 799 C LYS A 102 144.738 103.894 295.751 1.00105.82 C ATOM 800 O LYS A 102 144.766 102.692 296.038 1.00110.74 O ATOM 801 CB LYS A 102 147.064 104.124 294.845 1.00113.45 C ATOM 802 CG LYS A 102 146.657 104.195 293.377 1.00116.48 C ATOM 803 CD LYS A 102 147.642 103.464 292.472 1.00120.90 C ATOM 804 CE LYS A 102 148.944 104.237 292.326 1.00120.99 C ATOM 805 NZ LYS A 102 149.689 103.846 291.093 1.00123.33 N ATOM 806 HZ1 LYS A 102 149.915 102.832 291.133 1.00 0.00 H ATOM 807 HZ2 LYS A 102 149.100 104.039 290.258 1.00 0.00 H ATOM 808 HZ3 LYS A 102 150.569 104.396 291.032 1.00 0.00 H ATOM 809 H LYS A 102 147.401 104.203 297.396 1.00 0.00 H ATOM 810 N PRO A 103 143.607 104.490 295.372 1.00101.75 N ATOM 811 CA PRO A 103 142.347 103.736 295.330 1.00 95.88 C ATOM 812 C PRO A 103 142.358 102.637 294.274 1.00 99.59 C ATOM 813 O PRO A 103 143.041 102.723 293.251 1.00102.30 O ATOM 814 CB PRO A 103 141.307 104.812 294.995 1.00 87.94 C ATOM 815 CG PRO A 103 142.076 105.872 294.298 1.00 90.02 C ATOM 816 CD PRO A 103 143.454 105.872 294.885 1.00 92.93 C ATOM 817 N LYS A 104 141.573 101.588 294.538 1.00105.12 N ATOM 818 CA LYS A 104 141.518 100.452 293.622 1.00104.45 C ATOM 819 C LYS A 104 140.789 100.820 292.339 1.00102.99 C ATOM 820 O LYS A 104 141.156 100.357 291.252 1.00105.37 O ATOM 821 CB LYS A 104 140.845 99.258 294.306 1.00104.76 C ATOM 822 H LYS A 104 140.996 101.581 295.403 1.00 0.00 H ATOM 823 N PHE A 105 139.769 101.664 292.440 1.00102.62 N ATOM 824 CA PHE A 105 139.003 102.090 291.280 1.00104.21 C ATOM 825 C PHE A 105 139.057 103.602 291.144 1.00 96.01 C ATOM 826 O PHE A 105 139.257 104.324 292.125 1.00 91.85 O ATOM 827 CB PHE A 105 137.548 101.634 291.385 1.00110.31 C ATOM 828 CG PHE A 105 137.399 100.172 291.646 1.00117.29 C ATOM 829 CD1 PHE A 105 137.350 99.688 292.942 1.00123.21 C ATOM 830 CD2 PHE A 105 137.326 99.275 290.592 1.00121.75 C ATOM 831 CE1 PHE A 105 137.218 98.339 293.188 1.00125.71 C ATOM 832 CE2 PHE A 105 137.192 97.922 290.826 1.00125.52 C ATOM 833 CZ PHE A 105 137.139 97.452 292.127 1.00128.60 C ATOM 834 H PHE A 105 139.510 102.032 293.378 1.00 0.00 H ATOM 835 N LEU A 106 138.859 104.077 289.919 1.00 93.59 N ATOM 836 CA LEU A 106 138.899 105.508 289.664 1.00 86.29 C ATOM 837 C LEU A 106 137.830 106.232 290.478 1.00 84.75 C ATOM 838 O LEU A 106 136.636 105.903 290.364 1.00 73.42 O ATOM 839 CB LEU A 106 138.703 105.804 288.184 1.00 82.91 C ATOM 840 CG LEU A 106 139.962 105.831 287.316 1.00 82.41 C ATOM 841 CD1 LEU A 106 139.619 106.231 285.894 1.00 89.67 C ATOM 842 CD2 LEU A 106 140.986 106.796 287.892 1.00 89.95 C ATOM 843 H LEU A 106 138.674 103.419 289.135 1.00 0.00 H ATOM 844 N PRO A 107 138.195 107.203 291.287 1.00 84.50 N ATOM 845 CA PRO A 107 137.167 108.056 291.881 1.00 80.90 C ATOM 846 C PRO A 107 136.803 109.165 290.910 1.00 80.50 C ATOM 847 O PRO A 107 137.231 109.162 289.739 1.00 71.45 O ATOM 848 CB PRO A 107 137.842 108.577 293.158 1.00 84.94 C ATOM 849 CG PRO A 107 139.309 108.633 292.793 1.00 85.95 C ATOM 850 CD PRO A 107 139.555 107.604 291.696 1.00 83.24 C ATOM 851 N ASP A 108 136.004 110.114 291.395 1.00 71.46 N ATOM 852 CA ASP A 108 135.520 111.228 290.588 1.00 78.85 C ATOM 853 C ASP A 108 136.223 112.546 290.860 1.00 75.76 C ATOM 854 O ASP A 108 136.498 113.293 289.916 1.00 68.87 O ATOM 855 CB ASP A 108 134.014 111.402 290.800 1.00 76.86 C ATOM 856 CG ASP A 108 133.243 110.191 290.376 1.00 79.04 C ATOM 857 OD1 ASP A 108 133.388 109.803 289.200 1.00 77.95 O ATOM 858 OD2 ASP A 108 132.484 109.656 291.195 1.00 79.03 O ATOM 859 H ASP A 108 135.713 110.058 292.392 1.00 0.00 H ATOM 860 N LEU A 109 136.498 112.880 292.120 1.00 76.23 N ATOM 861 CA LEU A 109 137.205 114.116 292.439 1.00 73.45 C ATOM 862 C LEU A 109 138.281 113.861 293.483 1.00 75.11 C ATOM 863 O LEU A 109 138.372 112.777 294.072 1.00 83.13 O ATOM 864 CB LEU A 109 136.281 115.238 292.946 1.00 73.01 C ATOM 865 CG LEU A 109 134.908 115.657 292.400 1.00 84.08 C ATOM 866 CD1 LEU A 109 133.934 114.501 292.187 1.00 95.40 C ATOM 867 CD2 LEU A 109 134.296 116.657 293.384 1.00 79.57 C ATOM 868 H LEU A 109 136.203 112.248 292.891 1.00 0.00 H ATOM 869 N TYR A 110 139.101 114.894 293.702 1.00 67.57 N ATOM 870 CA TYR A 110 139.973 114.980 294.869 1.00 77.51 C ATOM 871 C TYR A 110 139.812 116.333 295.550 1.00 84.95 C ATOM 872 O TYR A 110 139.961 117.384 294.913 1.00 78.61 O ATOM 873 CB TYR A 110 141.446 114.773 294.530 1.00 71.66 C ATOM 874 CG TYR A 110 142.301 114.747 295.790 1.00 85.24 C ATOM 875 CD1 TYR A 110 142.298 113.635 296.623 1.00 85.44 C ATOM 876 CD2 TYR A 110 143.078 115.844 296.170 1.00 87.78 C ATOM 877 CE1 TYR A 110 143.058 113.600 297.778 1.00 89.24 C ATOM 878 CE2 TYR A 110 143.844 115.813 297.336 1.00 87.67 C ATOM 879 CZ TYR A 110 143.825 114.688 298.129 1.00 93.97 C ATOM 880 OH TYR A 110 144.573 114.633 299.283 1.00104.87 O ATOM 881 HH TYR A 110 144.437 113.756 299.721 1.00 0.00 H ATOM 882 H TYR A 110 139.118 115.670 293.010 1.00 0.00 H ATOM 883 N ASP A 111 139.549 116.293 296.853 1.00 89.81 N ATOM 884 CA ASP A 111 139.343 117.488 297.665 1.00 93.99 C ATOM 885 C ASP A 111 140.673 117.882 298.299 1.00 91.34 C ATOM 886 O ASP A 111 141.105 117.262 299.273 1.00 87.23 O ATOM 887 CB ASP A 111 138.282 117.222 298.734 1.00 99.87 C ATOM 888 CG ASP A 111 137.942 118.462 299.558 1.00106.98 C ATOM 889 OD1 ASP A 111 136.745 118.780 299.708 1.00110.19 O ATOM 890 OD2 ASP A 111 138.861 119.121 300.075 1.00111.65 O ATOM 891 H ASP A 111 139.487 115.364 297.316 1.00 0.00 H ATOM 892 N TYR A 112 141.312 118.930 297.770 1.00 85.43 N ATOM 893 CA TYR A 112 142.578 119.369 298.356 1.00 92.35 C ATOM 894 C TYR A 112 142.402 119.912 299.774 1.00 91.54 C ATOM 895 O TYR A 112 143.331 119.832 300.584 1.00 90.41 O ATOM 896 CB TYR A 112 143.241 120.416 297.460 1.00 95.97 C ATOM 897 CG TYR A 112 143.981 119.795 296.297 1.00 93.52 C ATOM 898 CD1 TYR A 112 145.097 118.994 296.515 1.00 96.34 C ATOM 899 CD2 TYR A 112 143.546 119.983 294.984 1.00 80.53 C ATOM 900 CE1 TYR A 112 145.772 118.410 295.463 1.00 98.58 C ATOM 901 CE2 TYR A 112 144.223 119.401 293.912 1.00 77.18 C ATOM 902 CZ TYR A 112 145.333 118.617 294.164 1.00 88.85 C ATOM 903 OH TYR A 112 146.017 118.024 293.137 1.00 90.89 O ATOM 904 HH TYR A 112 146.776 117.506 293.504 1.00 0.00 H ATOM 905 H TYR A 112 140.913 119.429 296.949 1.00 0.00 H ATOM 906 N LYS A 113 141.228 120.466 300.088 1.00 89.52 N ATOM 907 CA LYS A 113 140.994 121.046 301.409 1.00 90.06 C ATOM 908 C LYS A 113 140.935 119.964 302.479 1.00 90.69 C ATOM 909 O LYS A 113 141.605 120.058 303.514 1.00 92.26 O ATOM 910 CB LYS A 113 139.694 121.855 301.396 1.00 91.21 C ATOM 911 CG LYS A 113 139.589 122.977 302.424 1.00100.71 C ATOM 912 CD LYS A 113 138.326 123.791 302.158 1.00105.02 C ATOM 913 CE LYS A 113 138.202 124.989 303.076 1.00110.36 C ATOM 914 NZ LYS A 113 136.947 124.904 303.886 1.00110.98 N ATOM 915 HZ1 LYS A 113 136.125 124.881 303.249 1.00 0.00 H ATOM 916 HZ2 LYS A 113 136.965 124.038 304.462 1.00 0.00 H ATOM 917 HZ3 LYS A 113 136.881 125.734 304.509 1.00 0.00 H ATOM 918 H LYS A 113 140.467 120.485 299.380 1.00 0.00 H ATOM 919 N GLU A 114 140.140 118.925 302.240 1.00 85.46 N ATOM 920 CA GLU A 114 139.916 117.854 303.198 1.00 89.75 C ATOM 921 C GLU A 114 140.759 116.614 302.920 1.00 95.86 C ATOM 922 O GLU A 114 140.687 115.646 303.689 1.00 80.83 O ATOM 923 CB GLU A 114 138.427 117.495 303.233 1.00 82.84 C ATOM 924 CG GLU A 114 137.537 118.715 303.439 1.00 92.72 C ATOM 925 CD GLU A 114 136.841 118.693 304.799 1.00104.50 C ATOM 926 OE1 GLU A 114 135.822 119.407 304.965 1.00108.96 O ATOM 927 OE2 GLU A 114 137.333 117.968 305.701 1.00 99.70 O ATOM 928 H GLU A 114 139.654 118.876 301.322 1.00 0.00 H ATOM 929 N ASN A 115 141.571 116.638 301.859 1.00 83.23 N ATOM 930 CA ASN A 115 142.531 115.575 301.543 1.00 92.38 C ATOM 931 C ASN A 115 141.855 114.207 301.467 1.00 96.45 C ATOM 932 O ASN A 115 142.302 113.229 302.074 1.00 98.40 O ATOM 933 CB ASN A 115 143.699 115.567 302.536 1.00 99.61 C ATOM 934 CG ASN A 115 144.268 116.957 302.772 1.00115.04 C ATOM 935 OD1 ASN A 115 143.580 117.845 303.279 1.00125.71 O ATOM 936 ND2 ASN A 115 145.520 117.161 302.375 1.00115.91 N ATOM 937 HD22 ASN A 115 146.065 116.383 301.952 1.00 0.00 H ATOM 938 HD21 ASN A 115 145.955 118.099 302.488 1.00 0.00 H ATOM 939 H ASN A 115 141.519 117.457 301.221 1.00 0.00 H ATOM 940 N ARG A 116 140.758 114.153 300.710 1.00 93.20 N ATOM 941 CA ARG A 116 140.077 112.908 300.387 1.00 91.26 C ATOM 942 C ARG A 116 139.710 112.882 298.912 1.00 84.00 C ATOM 943 O ARG A 116 139.330 113.902 298.323 1.00 75.10 O ATOM 944 CB ARG A 116 138.780 112.709 301.172 1.00 86.35 C ATOM 945 CG ARG A 116 138.736 113.397 302.507 1.00 98.19 C ATOM 946 CD ARG A 116 137.346 113.904 302.782 1.00100.74 C ATOM 947 NE ARG A 116 137.253 114.423 304.130 1.00117.81 N ATOM 948 CZ ARG A 116 136.158 114.956 304.648 1.00120.75 C ATOM 949 NH1 ARG A 116 135.050 115.052 303.923 1.00113.53 N ATOM 950 NH2 ARG A 116 136.184 115.400 305.890 1.00130.06 N ATOM 951 HE ARG A 116 138.101 114.374 304.730 1.00 0.00 H ATOM 952 HH12 ARG A 116 134.193 115.472 304.336 1.00 0.00 H ATOM 953 HH11 ARG A 116 135.039 114.707 302.942 1.00 0.00 H ATOM 954 HH22 ARG A 116 135.331 115.821 306.310 1.00 0.00 H ATOM 955 HH21 ARG A 116 137.058 115.329 306.449 1.00 0.00 H ATOM 956 H ARG A 116 140.371 115.042 300.333 1.00 0.00 H ATOM 957 N PHE A 117 139.790 111.690 298.338 1.00 84.15 N ATOM 958 CA PHE A 117 139.093 111.396 297.099 1.00 81.33 C ATOM 959 C PHE A 117 137.588 111.335 297.352 1.00 89.93 C ATOM 960 O PHE A 117 137.136 110.981 298.447 1.00 93.42 O ATOM 961 CB PHE A 117 139.586 110.072 296.526 1.00 76.12 C ATOM 962 CG PHE A 117 140.926 110.172 295.900 1.00 84.26 C ATOM 963 CD1 PHE A 117 141.070 110.839 294.697 1.00 80.47 C ATOM 964 CD2 PHE A 117 142.045 109.609 296.498 1.00 85.66 C ATOM 965 CE1 PHE A 117 142.294 110.958 294.095 1.00 81.15 C ATOM 966 CE2 PHE A 117 143.296 109.722 295.886 1.00 84.66 C ATOM 967 CZ PHE A 117 143.409 110.400 294.682 1.00 80.32 C ATOM 968 H PHE A 117 140.365 110.948 298.786 1.00 0.00 H ATOM 969 N ILE A 118 136.809 111.685 296.327 1.00 78.89 N ATOM 970 CA ILE A 118 135.349 111.679 296.412 1.00 75.05 C ATOM 971 C ILE A 118 134.785 110.802 295.299 1.00 81.05 C ATOM 972 O ILE A 118 135.166 110.946 294.129 1.00 72.00 O ATOM 973 CB ILE A 118 134.759 113.099 296.310 1.00 71.01 C ATOM 974 CG1 ILE A 118 135.231 113.957 297.493 1.00 68.72 C ATOM 975 CG2 ILE A 118 133.226 113.030 296.283 1.00 69.15 C ATOM 976 CD1 ILE A 118 135.151 115.449 297.249 1.00 67.25 C ATOM 977 H ILE A 118 137.257 111.973 295.434 1.00 0.00 H ATOM 978 N GLU A 119 133.863 109.916 295.665 1.00 75.74 N ATOM 979 CA GLU A 119 133.044 109.173 294.712 1.00 80.97 C ATOM 980 C GLU A 119 131.651 109.785 294.702 1.00 81.51 C ATOM 981 O GLU A 119 130.930 109.722 295.712 1.00 79.75 O ATOM 982 CB GLU A 119 132.961 107.683 295.062 1.00 85.61 C ATOM 983 CG GLU A 119 133.229 106.828 293.825 1.00103.05 C ATOM 984 CD GLU A 119 132.124 106.922 292.792 1.00 93.90 C ATOM 985 OE1 GLU A 119 132.428 106.818 291.608 1.00 81.08 O ATOM 986 OE2 GLU A 119 130.944 107.061 293.167 1.00102.76 O ATOM 987 H GLU A 119 133.718 109.744 296.680 1.00 0.00 H ATOM 988 N ILE A 120 131.283 110.392 293.571 1.00 72.15 N ATOM 989 CA ILE A 120 129.960 110.988 293.407 1.00 78.57 C ATOM 990 C ILE A 120 129.015 109.921 292.906 1.00 80.10 C ATOM 991 O ILE A 120 129.390 109.089 292.067 1.00 72.89 O ATOM 992 CB ILE A 120 129.996 112.187 292.440 1.00 82.33 C ATOM 993 CG1 ILE A 120 130.868 113.302 293.009 1.00 77.00 C ATOM 994 CG2 ILE A 120 128.576 112.662 292.068 1.00 63.47 C ATOM 995 CD1 ILE A 120 130.252 114.085 294.086 1.00 82.20 C ATOM 996 H ILE A 120 131.959 110.442 292.783 1.00 0.00 H ATOM 997 N GLY A 121 127.792 109.927 293.422 1.00 83.58 N ATOM 998 CA GLY A 121 126.757 108.993 293.005 1.00 80.49 C ATOM 999 C GLY A 121 125.487 109.724 292.662 1.00 79.86 C ATOM 1000 O GLY A 121 125.139 110.725 293.301 1.00 82.85 O ATOM 1001 H GLY A 121 127.564 110.629 294.155 1.00 0.00 H ATOM 1002 N VAL A 122 124.794 109.250 291.626 1.00 74.34 N ATOM 1003 CA VAL A 122 123.535 109.832 291.167 1.00 78.40 C ATOM 1004 C VAL A 122 122.606 108.659 290.868 1.00 90.51 C ATOM 1005 O VAL A 122 122.717 108.022 289.813 1.00 96.98 O ATOM 1006 CB VAL A 122 123.710 110.738 289.939 1.00 77.28 C ATOM 1007 CG1 VAL A 122 122.359 111.302 289.519 1.00 72.37 C ATOM 1008 CG2 VAL A 122 124.706 111.879 290.223 1.00 64.56 C ATOM 1009 H VAL A 122 125.169 108.423 291.119 1.00 0.00 H ATOM 1010 N THR A 123 121.690 108.369 291.789 1.00 89.44 N ATOM 1011 CA THR A 123 120.856 107.176 291.729 1.00 94.02 C ATOM 1012 C THR A 123 119.406 107.526 291.440 1.00 97.26 C ATOM 1013 O THR A 123 118.898 108.560 291.891 1.00 93.77 O ATOM 1014 CB THR A 123 120.914 106.391 293.037 1.00 95.22 C ATOM 1015 OG1 THR A 123 120.038 105.256 292.969 1.00106.80 O ATOM 1016 CG2 THR A 123 120.527 107.277 294.220 1.00 83.36 C ATOM 1017 HG1 THR A 123 120.319 104.668 292.223 1.00 0.00 H ATOM 1018 H THR A 123 121.564 109.023 292.587 1.00 0.00 H ATOM 1019 N ARG A 124 118.755 106.655 290.672 1.00102.16 N ATOM 1020 CA ARG A 124 117.306 106.673 290.547 1.00108.80 C ATOM 1021 C ARG A 124 116.653 105.816 291.610 1.00118.01 C ATOM 1022 O ARG A 124 115.552 106.140 292.071 1.00121.26 O ATOM 1023 CB ARG A 124 116.877 106.174 289.165 1.00113.28 C ATOM 1024 CG ARG A 124 117.326 107.042 288.018 1.00115.22 C ATOM 1025 CD ARG A 124 117.820 106.188 286.866 1.00123.83 C ATOM 1026 NE ARG A 124 119.266 105.988 286.910 1.00124.45 N ATOM 1027 CZ ARG A 124 119.984 105.483 285.912 1.00118.77 C ATOM 1028 NH1 ARG A 124 119.394 105.111 284.783 1.00112.73 N ATOM 1029 NH2 ARG A 124 121.296 105.341 286.049 1.00120.02 N ATOM 1030 HE ARG A 124 119.767 106.259 287.780 1.00 0.00 H ATOM 1031 HH12 ARG A 124 119.961 104.716 284.005 1.00 0.00 H ATOM 1032 HH11 ARG A 124 118.365 105.214 284.676 1.00 0.00 H ATOM 1033 HH22 ARG A 124 121.860 104.946 285.270 1.00 0.00 H ATOM 1034 HH21 ARG A 124 121.760 105.625 286.936 1.00 0.00 H ATOM 1035 H ARG A 124 119.298 105.941 290.146 1.00 0.00 H ATOM 1036 N ARG A 125 117.322 104.735 292.016 1.00122.40 N ATOM 1037 CA ARG A 125 116.826 103.885 293.087 1.00123.84 C ATOM 1038 C ARG A 125 116.936 104.606 294.421 1.00119.41 C ATOM 1039 O ARG A 125 117.152 105.825 294.476 1.00114.09 O ATOM 1040 CB ARG A 125 117.590 102.554 293.143 1.00121.49 C ATOM 1041 H ARG A 125 118.222 104.494 291.554 1.00 0.00 H ATOM 1042 N GLU A 126 116.814 103.838 295.496 1.00109.15 N ATOM 1043 CA GLU A 126 116.718 104.375 296.841 1.00103.32 C ATOM 1044 C GLU A 126 118.097 104.794 297.349 1.00102.55 C ATOM 1045 O GLU A 126 119.092 104.106 297.113 1.00112.89 O ATOM 1046 CB GLU A 126 116.087 103.306 297.741 1.00118.64 C ATOM 1047 CG GLU A 126 115.530 103.785 299.049 1.00118.11 C ATOM 1048 CD GLU A 126 116.615 104.173 300.021 1.00130.22 C ATOM 1049 OE1 GLU A 126 116.312 104.335 301.229 1.00141.87 O ATOM 1050 OE2 GLU A 126 117.774 104.313 299.580 1.00134.04 O ATOM 1051 H GLU A 126 116.786 102.806 295.369 1.00 0.00 H ATOM 1052 N VAL A 127 118.160 105.939 298.037 1.00108.88 N ATOM 1053 CA VAL A 127 119.462 106.517 298.382 1.00120.32 C ATOM 1054 C VAL A 127 120.279 105.545 299.224 1.00121.94 C ATOM 1055 O VAL A 127 121.468 105.311 298.946 1.00 90.68 O ATOM 1056 CB VAL A 127 119.280 107.874 299.091 1.00124.42 C ATOM 1057 CG1 VAL A 127 120.454 108.166 300.019 1.00132.46 C ATOM 1058 CG2 VAL A 127 119.155 108.987 298.058 1.00105.09 C ATOM 1059 H VAL A 127 117.285 106.420 298.327 1.00 0.00 H ATOM 1060 N HIS A 128 119.640 104.951 300.247 1.00118.74 N ATOM 1061 CA HIS A 128 120.299 104.014 301.159 1.00120.27 C ATOM 1062 C HIS A 128 120.924 102.841 300.408 1.00116.57 C ATOM 1063 O HIS A 128 122.104 102.530 300.608 1.00 98.88 O ATOM 1064 CB HIS A 128 119.310 103.467 302.226 1.00121.49 C ATOM 1065 CG HIS A 128 118.434 104.499 302.880 1.00136.65 C ATOM 1066 ND1 HIS A 128 117.067 104.546 302.688 1.00142.75 N ATOM 1067 CD2 HIS A 128 118.719 105.496 303.752 1.00140.23 C ATOM 1068 CE1 HIS A 128 116.554 105.532 303.400 1.00143.01 C ATOM 1069 NE2 HIS A 128 117.536 106.126 304.056 1.00141.15 N ATOM 1070 H HIS A 128 118.634 105.166 300.397 1.00 0.00 H ATOM 1071 N ILE A 129 120.132 102.141 299.581 1.00117.06 N ATOM 1072 CA ILE A 129 120.629 100.938 298.906 1.00120.15 C ATOM 1073 C ILE A 129 121.796 101.273 297.984 1.00118.10 C ATOM 1074 O ILE A 129 122.750 100.492 297.867 1.00117.96 O ATOM 1075 CB ILE A 129 119.489 100.218 298.145 1.00128.46 C ATOM 1076 CG1 ILE A 129 120.020 99.157 297.173 1.00134.43 C ATOM 1077 CG2 ILE A 129 118.675 101.167 297.335 1.00125.18 C ATOM 1078 CD1 ILE A 129 118.920 98.266 296.591 1.00141.00 C ATOM 1079 H ILE A 129 119.154 102.456 299.417 1.00 0.00 H ATOM 1080 N TYR A 130 121.754 102.439 297.333 1.00115.35 N ATOM 1081 CA TYR A 130 122.823 102.825 296.419 1.00103.36 C ATOM 1082 C TYR A 130 124.139 103.029 297.159 1.00 96.92 C ATOM 1083 O TYR A 130 125.195 102.594 296.680 1.00 92.57 O ATOM 1084 CB TYR A 130 122.428 104.099 295.675 1.00109.11 C ATOM 1085 CG TYR A 130 123.199 104.369 294.401 1.00104.33 C ATOM 1086 CD1 TYR A 130 123.240 103.429 293.376 1.00109.93 C ATOM 1087 CD2 TYR A 130 123.843 105.575 294.202 1.00104.39 C ATOM 1088 CE1 TYR A 130 123.918 103.676 292.199 1.00112.97 C ATOM 1089 CE2 TYR A 130 124.515 105.835 293.030 1.00109.88 C ATOM 1090 CZ TYR A 130 124.557 104.886 292.031 1.00116.33 C ATOM 1091 OH TYR A 130 125.233 105.143 290.857 1.00123.82 O ATOM 1092 HH TYR A 130 124.836 105.935 290.416 1.00 0.00 H ATOM 1093 H TYR A 130 120.948 103.080 297.480 1.00 0.00 H ATOM 1094 N TYR A 131 124.097 103.684 298.330 1.00101.76 N ATOM 1095 CA TYR A 131 125.332 103.970 299.060 1.00103.27 C ATOM 1096 C TYR A 131 126.011 102.673 299.484 1.00106.16 C ATOM 1097 O TYR A 131 127.222 102.503 299.290 1.00101.27 O ATOM 1098 CB TYR A 131 125.053 104.890 300.268 1.00104.17 C ATOM 1099 CG TYR A 131 126.282 105.248 301.124 1.00106.47 C ATOM 1100 CD1 TYR A 131 126.824 106.525 301.117 1.00 92.48 C ATOM 1101 CD2 TYR A 131 126.866 104.309 301.980 1.00114.84 C ATOM 1102 CE1 TYR A 131 127.947 106.846 301.896 1.00 96.08 C ATOM 1103 CE2 TYR A 131 127.976 104.618 302.763 1.00109.98 C ATOM 1104 CZ TYR A 131 128.513 105.881 302.722 1.00110.51 C ATOM 1105 OH TYR A 131 129.612 106.154 303.516 1.00108.66 O ATOM 1106 HH TYR A 131 129.888 107.096 303.384 1.00 0.00 H ATOM 1107 H TYR A 131 123.183 103.989 298.720 1.00 0.00 H ATOM 1108 N LEU A 132 125.237 101.738 300.050 1.00103.51 N ATOM 1109 CA LEU A 132 125.789 100.444 300.442 1.00104.45 C ATOM 1110 C LEU A 132 126.433 99.747 299.251 1.00102.57 C ATOM 1111 O LEU A 132 127.593 99.317 299.320 1.00101.02 O ATOM 1112 CB LEU A 132 124.693 99.563 301.058 1.00103.72 C ATOM 1113 H LEU A 132 124.229 101.936 300.213 1.00 0.00 H ATOM 1114 N GLU A 133 125.690 99.627 298.148 1.00102.03 N ATOM 1115 CA GLU A 133 126.241 99.023 296.939 1.00106.50 C ATOM 1116 C GLU A 133 127.549 99.697 296.547 1.00113.52 C ATOM 1117 O GLU A 133 128.553 99.022 296.280 1.00116.85 O ATOM 1118 CB GLU A 133 125.222 99.107 295.802 1.00106.27 C ATOM 1119 H GLU A 133 124.707 99.968 298.150 1.00 0.00 H ATOM 1120 N LYS A 134 127.566 101.036 296.530 1.00118.59 N ATOM 1121 CA LYS A 134 128.821 101.734 296.271 1.00118.47 C ATOM 1122 C LYS A 134 129.842 101.529 297.385 1.00113.49 C ATOM 1123 O LYS A 134 131.043 101.607 297.123 1.00105.47 O ATOM 1124 CB LYS A 134 128.598 103.235 296.026 1.00120.05 C ATOM 1125 CG LYS A 134 128.176 103.542 294.573 1.00120.68 C ATOM 1126 CD LYS A 134 129.291 104.219 293.771 1.00118.58 C ATOM 1127 CE LYS A 134 128.816 104.787 292.414 1.00111.96 C ATOM 1128 NZ LYS A 134 127.420 105.334 292.355 1.00107.33 N ATOM 1129 HZ1 LYS A 134 126.744 104.582 292.596 1.00 0.00 H ATOM 1130 HZ2 LYS A 134 127.326 106.116 293.034 1.00 0.00 H ATOM 1131 HZ3 LYS A 134 127.226 105.682 291.394 1.00 0.00 H ATOM 1132 H LYS A 134 126.692 101.574 296.700 1.00 0.00 H ATOM 1133 N ALA A 135 129.411 101.231 298.611 1.00122.65 N ATOM 1134 CA ALA A 135 130.394 101.000 299.667 1.00126.61 C ATOM 1135 C ALA A 135 131.101 99.657 299.502 1.00131.55 C ATOM 1136 O ALA A 135 132.287 99.542 299.836 1.00127.80 O ATOM 1137 CB ALA A 135 129.729 101.099 301.037 1.00129.11 C ATOM 1138 H ALA A 135 128.393 101.164 298.812 1.00 0.00 H ATOM 1139 N ASN A 136 130.400 98.645 298.976 1.00137.20 N ATOM 1140 CA ASN A 136 131.007 97.328 298.790 1.00138.84 C ATOM 1141 C ASN A 136 132.223 97.400 297.873 1.00135.63 C ATOM 1142 O ASN A 136 133.238 96.743 298.131 1.00140.70 O ATOM 1143 CB ASN A 136 129.976 96.339 298.241 1.00139.13 C ATOM 1144 H ASN A 136 129.410 98.798 298.696 1.00 0.00 H ATOM 1145 N LYS A 137 132.149 98.201 296.805 1.00130.26 N ATOM 1146 CA LYS A 137 133.309 98.368 295.931 1.00127.44 C ATOM 1147 C LYS A 137 134.480 99.032 296.650 1.00131.46 C ATOM 1148 O LYS A 137 135.613 98.957 296.159 1.00127.62 O ATOM 1149 CB LYS A 137 132.930 99.174 294.685 1.00117.43 C ATOM 1150 H LYS A 137 131.264 98.706 296.596 1.00 0.00 H ATOM 1151 N ILE A 138 134.228 99.676 297.792 1.00138.27 N ATOM 1152 CA ILE A 138 135.268 100.218 298.670 1.00139.20 C ATOM 1153 C ILE A 138 136.306 101.050 297.916 1.00140.44 C ATOM 1154 O ILE A 138 137.512 100.843 298.065 1.00143.65 O ATOM 1155 CB ILE A 138 135.955 99.090 299.451 1.00138.44 C ATOM 1156 H ILE A 138 133.235 99.800 298.075 1.00 0.00 H TER 1157 ILE A 138 ATOM 1158 N GLU A 141 138.490 101.794 300.459 1.00126.65 N ATOM 1159 CA GLU A 141 137.544 101.928 301.559 1.00127.41 C ATOM 1160 C GLU A 141 137.936 103.068 302.501 1.00130.53 C ATOM 1161 O GLU A 141 137.644 103.022 303.697 1.00137.74 O ATOM 1162 CB GLU A 141 137.444 100.616 302.340 1.00136.24 C ATOM 1163 HN3 GLU A 141 139.437 101.596 300.840 1.00 0.00 H ATOM 1164 HN2 GLU A 141 138.513 102.679 299.913 1.00 0.00 H ATOM 1165 HN1 GLU A 141 138.193 101.012 299.841 1.00 0.00 H ATOM 1166 N LYS A 142 138.611 104.087 301.959 1.00127.81 N ATOM 1167 CA LYS A 142 138.972 105.278 302.722 1.00126.34 C ATOM 1168 C LYS A 142 138.709 106.563 301.936 1.00117.63 C ATOM 1169 O LYS A 142 139.203 107.630 302.320 1.00113.04 O ATOM 1170 CB LYS A 142 140.437 105.220 303.166 1.00132.46 C ATOM 1171 H LYS A 142 138.889 104.029 300.958 1.00 0.00 H ATOM 1172 N THR A 143 137.936 106.485 300.849 1.00109.52 N ATOM 1173 CA THR A 143 137.528 107.642 300.062 1.00106.61 C ATOM 1174 C THR A 143 136.089 108.039 300.395 1.00100.94 C ATOM 1175 O THR A 143 135.251 107.190 300.696 1.00100.50 O ATOM 1176 CB THR A 143 137.643 107.354 298.558 1.00113.51 C ATOM 1177 OG1 THR A 143 136.424 106.767 298.085 1.00123.58 O ATOM 1178 CG2 THR A 143 138.798 106.393 298.264 1.00108.94 C ATOM 1179 HG1 THR A 143 135.674 107.394 298.244 1.00 0.00 H ATOM 1180 H THR A 143 137.607 105.546 300.547 1.00 0.00 H ATOM 1181 N HIS A 144 135.795 109.339 300.294 1.00 95.66 N ATOM 1182 CA HIS A 144 134.482 109.864 300.677 1.00 85.91 C ATOM 1183 C HIS A 144 133.437 109.584 299.596 1.00 87.02 C ATOM 1184 O HIS A 144 133.722 109.675 298.396 1.00 84.50 O ATOM 1185 CB HIS A 144 134.582 111.370 300.926 1.00 79.60 C ATOM 1186 CG HIS A 144 133.721 111.867 302.039 1.00 88.80 C ATOM 1187 ND1 HIS A 144 133.884 111.461 303.348 1.00 89.86 N ATOM 1188 CD2 HIS A 144 132.701 112.758 302.046 1.00 91.12 C ATOM 1189 CE1 HIS A 144 132.994 112.071 304.109 1.00 94.17 C ATOM 1190 NE2 HIS A 144 132.261 112.861 303.345 1.00 88.18 N ATOM 1191 H HIS A 144 136.517 109.995 299.934 1.00 0.00 H ATOM 1192 N ILE A 145 132.220 109.246 300.026 1.00 84.20 N ATOM 1193 CA ILE A 145 131.112 108.947 299.121 1.00 87.49 C ATOM 1194 C ILE A 145 130.005 109.965 299.342 1.00 91.43 C ATOM 1195 O ILE A 145 129.601 110.207 300.487 1.00 88.26 O ATOM 1196 CB ILE A 145 130.557 107.526 299.327 1.00 88.59 C ATOM 1197 CG1 ILE A 145 131.675 106.512 299.492 1.00 94.73 C ATOM 1198 CG2 ILE A 145 129.757 107.093 298.136 1.00 89.32 C ATOM 1199 CD1 ILE A 145 131.143 105.070 299.556 1.00 92.21 C ATOM 1200 H ILE A 145 132.052 109.193 301.051 1.00 0.00 H ATOM 1201 N HIS A 146 129.475 110.507 298.243 1.00 74.52 N ATOM 1202 CA HIS A 146 128.413 111.510 298.269 1.00 82.96 C ATOM 1203 C HIS A 146 127.408 111.176 297.179 1.00 86.36 C ATOM 1204 O HIS A 146 127.714 111.309 295.989 1.00 70.74 O ATOM 1205 CB HIS A 146 128.958 112.931 298.058 1.00 71.66 C ATOM 1206 CG HIS A 146 128.002 114.002 298.489 1.00 79.44 C ATOM 1207 ND1 HIS A 146 128.402 115.141 299.162 1.00 72.60 N ATOM 1208 CD2 HIS A 146 126.652 114.084 298.380 1.00 74.35 C ATOM 1209 CE1 HIS A 146 127.341 115.882 299.436 1.00 75.94 C ATOM 1210 NE2 HIS A 146 126.268 115.265 298.969 1.00 77.44 N ATOM 1211 H HIS A 146 129.838 110.199 297.318 1.00 0.00 H ATOM 1212 N ILE A 147 126.210 110.774 297.582 1.00 84.30 N ATOM 1213 CA ILE A 147 125.165 110.316 296.671 1.00 89.19 C ATOM 1214 C ILE A 147 124.109 111.408 296.566 1.00 88.59 C ATOM 1215 O ILE A 147 123.707 111.989 297.581 1.00 83.16 O ATOM 1216 CB ILE A 147 124.510 108.996 297.145 1.00 90.38 C ATOM 1217 CG1 ILE A 147 125.432 107.788 296.969 1.00102.09 C ATOM 1218 CG2 ILE A 147 123.196 108.741 296.439 1.00 80.65 C ATOM 1219 CD1 ILE A 147 126.468 107.659 298.040 1.00110.01 C ATOM 1220 H ILE A 147 126.004 110.786 298.601 1.00 0.00 H ATOM 1221 N PHE A 148 123.648 111.676 295.344 1.00 79.74 N ATOM 1222 CA PHE A 148 122.475 112.511 295.126 1.00 84.61 C ATOM 1223 C PHE A 148 121.385 111.715 294.418 1.00 85.15 C ATOM 1224 O PHE A 148 121.650 110.727 293.728 1.00 76.87 O ATOM 1225 CB PHE A 148 122.800 113.776 294.313 1.00 76.14 C ATOM 1226 CG PHE A 148 123.903 114.605 294.897 1.00 81.00 C ATOM 1227 CD1 PHE A 148 123.612 115.673 295.739 1.00 80.48 C ATOM 1228 CD2 PHE A 148 125.221 114.368 294.545 1.00 77.70 C ATOM 1229 CE1 PHE A 148 124.615 116.460 296.284 1.00 80.25 C ATOM 1230 CE2 PHE A 148 126.234 115.143 295.077 1.00 82.87 C ATOM 1231 CZ PHE A 148 125.925 116.202 295.963 1.00 80.20 C ATOM 1232 H PHE A 148 124.142 111.276 294.521 1.00 0.00 H ATOM 1233 N SER A 149 120.140 112.147 294.617 1.00 86.61 N ATOM 1234 CA SER A 149 118.986 111.506 294.002 1.00 85.31 C ATOM 1235 C SER A 149 118.211 112.512 293.162 1.00 85.52 C ATOM 1236 O SER A 149 118.245 113.724 293.401 1.00 93.01 O ATOM 1237 CB SER A 149 118.041 110.892 295.054 1.00 89.44 C ATOM 1238 OG SER A 149 116.963 111.772 295.333 1.00 81.14 O ATOM 1239 HG SER A 149 116.369 111.360 296.009 1.00 0.00 H ATOM 1240 H SER A 149 119.987 112.971 295.233 1.00 0.00 H ATOM 1241 N PHE A 150 117.485 111.981 292.181 1.00 87.62 N ATOM 1242 CA PHE A 150 116.495 112.759 291.445 1.00 93.48 C ATOM 1243 C PHE A 150 115.286 113.130 292.290 1.00100.34 C ATOM 1244 O PHE A 150 114.405 113.833 291.784 1.00111.15 O ATOM 1245 CB PHE A 150 116.022 111.981 290.216 1.00 89.20 C ATOM 1246 CG PHE A 150 117.073 111.802 289.191 1.00 88.01 C ATOM 1247 CD1 PHE A 150 117.944 110.731 289.251 1.00 93.61 C ATOM 1248 CD2 PHE A 150 117.208 112.721 288.161 1.00 86.42 C ATOM 1249 CE1 PHE A 150 118.932 110.579 288.280 1.00 91.22 C ATOM 1250 CE2 PHE A 150 118.180 112.576 287.204 1.00 81.58 C ATOM 1251 CZ PHE A 150 119.043 111.502 287.261 1.00 86.55 C ATOM 1252 H PHE A 150 117.628 110.981 291.932 1.00 0.00 H ATOM 1253 N THR A 151 115.209 112.665 293.540 1.00 88.95 N ATOM 1254 CA THR A 151 114.144 113.059 294.453 1.00 95.59 C ATOM 1255 C THR A 151 114.536 114.209 295.363 1.00 96.65 C ATOM 1256 O THR A 151 113.663 114.771 296.037 1.00 99.07 O ATOM 1257 CB THR A 151 113.717 111.881 295.344 1.00 89.98 C ATOM 1258 OG1 THR A 151 114.569 111.820 296.497 1.00 99.26 O ATOM 1259 CG2 THR A 151 113.793 110.565 294.599 1.00 87.70 C ATOM 1260 HG1 THR A 151 115.507 111.692 296.207 1.00 0.00 H ATOM 1261 H THR A 151 115.935 111.999 293.873 1.00 0.00 H ATOM 1262 N GLY A 152 115.822 114.537 295.441 1.00 80.82 N ATOM 1263 CA GLY A 152 116.289 115.547 296.367 1.00 87.22 C ATOM 1264 C GLY A 152 116.909 115.030 297.652 1.00 96.63 C ATOM 1265 O GLY A 152 117.223 115.837 298.533 1.00 99.45 O ATOM 1266 H GLY A 152 116.508 114.057 294.823 1.00 0.00 H ATOM 1267 N GLU A 153 117.103 113.724 297.790 1.00100.58 N ATOM 1268 CA GLU A 153 117.777 113.178 298.957 1.00102.47 C ATOM 1269 C GLU A 153 119.271 113.019 298.683 1.00103.79 C ATOM 1270 O GLU A 153 119.684 112.703 297.562 1.00103.07 O ATOM 1271 CB GLU A 153 117.153 111.836 299.352 1.00104.53 C ATOM 1272 H GLU A 153 116.766 113.078 297.048 1.00 0.00 H ATOM 1273 N GLU A 154 120.082 113.253 299.715 1.00105.12 N ATOM 1274 CA GLU A 154 121.519 113.030 299.649 1.00103.53 C ATOM 1275 C GLU A 154 121.982 112.238 300.866 1.00102.21 C ATOM 1276 O GLU A 154 121.407 112.331 301.951 1.00115.54 O ATOM 1277 CB GLU A 154 122.297 114.350 299.558 1.00 96.48 C ATOM 1278 CG GLU A 154 122.052 115.283 300.716 1.00108.62 C ATOM 1279 CD GLU A 154 122.807 116.585 300.592 1.00111.90 C ATOM 1280 OE1 GLU A 154 123.103 117.211 301.629 1.00117.39 O ATOM 1281 OE2 GLU A 154 123.132 116.977 299.457 1.00112.33 O ATOM 1282 H GLU A 154 119.672 113.609 300.602 1.00 0.00 H ATOM 1283 N MET A 155 123.027 111.440 300.656 1.00 96.48 N ATOM 1284 CA MET A 155 123.718 110.728 301.720 1.00 92.58 C ATOM 1285 C MET A 155 125.214 110.852 301.479 1.00 89.71 C ATOM 1286 O MET A 155 125.678 110.719 300.336 1.00 82.04 O ATOM 1287 CB MET A 155 123.299 109.255 301.776 1.00100.48 C ATOM 1288 H MET A 155 123.367 111.319 299.681 1.00 0.00 H ATOM 1289 N ALA A 156 125.959 111.139 302.545 1.00 84.09 N ATOM 1290 CA ALA A 156 127.406 111.260 302.473 1.00 89.92 C ATOM 1291 C ALA A 156 128.065 110.536 303.637 1.00 95.11 C ATOM 1292 O ALA A 156 127.542 110.511 304.763 1.00 88.73 O ATOM 1293 CB ALA A 156 127.859 112.726 302.462 1.00 94.90 C ATOM 1294 H ALA A 156 125.489 111.282 303.462 1.00 0.00 H ATOM 1295 N THR A 157 129.234 109.960 303.343 1.00 89.20 N ATOM 1296 CA THR A 157 130.052 109.309 304.360 1.00 94.40 C ATOM 1297 C THR A 157 130.182 110.191 305.596 1.00101.87 C ATOM 1298 O THR A 157 130.407 111.401 305.493 1.00 95.97 O ATOM 1299 CB THR A 157 131.446 109.001 303.805 1.00 95.08 C ATOM 1300 OG1 THR A 157 131.327 108.202 302.623 1.00 89.76 O ATOM 1301 CG2 THR A 157 132.253 108.221 304.843 1.00 92.06 C ATOM 1302 HG1 THR A 157 130.866 107.354 302.844 1.00 0.00 H ATOM 1303 H THR A 157 129.571 109.976 302.359 1.00 0.00 H ATOM 1304 N LYS A 158 130.009 109.573 306.770 1.00103.06 N ATOM 1305 CA LYS A 158 130.191 110.208 308.075 1.00101.66 C ATOM 1306 C LYS A 158 129.294 111.418 308.265 1.00 99.96 C ATOM 1307 O LYS A 158 129.571 112.271 309.122 1.00101.09 O ATOM 1308 CB LYS A 158 131.653 110.611 308.306 1.00108.58 C ATOM 1309 CG LYS A 158 132.546 109.482 308.785 1.00122.64 C ATOM 1310 CD LYS A 158 134.007 109.906 308.810 1.00128.99 C ATOM 1311 CE LYS A 158 134.895 108.733 309.185 1.00138.07 C ATOM 1312 NZ LYS A 158 134.937 107.737 308.072 1.00138.56 N ATOM 1313 HZ1 LYS A 158 133.975 107.389 307.884 1.00 0.00 H ATOM 1314 HZ2 LYS A 158 135.316 108.191 307.217 1.00 0.00 H ATOM 1315 HZ3 LYS A 158 135.548 106.941 308.344 1.00 0.00 H ATOM 1316 H LYS A 158 129.726 108.572 306.754 1.00 0.00 H ATOM 1317 N ALA A 159 128.213 111.497 307.490 1.00 98.21 N ATOM 1318 CA ALA A 159 127.335 112.664 307.485 1.00 99.71 C ATOM 1319 C ALA A 159 128.123 113.951 307.244 1.00100.08 C ATOM 1320 O ALA A 159 127.733 115.020 307.711 1.00101.92 O ATOM 1321 CB ALA A 159 126.512 112.749 308.782 1.00 96.78 C ATOM 1322 H ALA A 159 127.986 110.697 306.865 1.00 0.00 H ATOM 1323 N ASP A 160 129.245 113.867 306.506 1.00 88.21 N ATOM 1324 CA ASP A 160 130.017 115.043 306.115 1.00 93.60 C ATOM 1325 C ASP A 160 129.764 115.283 304.632 1.00 93.60 C ATOM 1326 O ASP A 160 130.211 114.510 303.776 1.00 80.90 O ATOM 1327 CB ASP A 160 131.510 114.880 306.402 1.00 98.34 C ATOM 1328 CG ASP A 160 132.339 116.141 306.049 1.00 95.92 C ATOM 1329 OD1 ASP A 160 131.866 117.043 305.307 1.00 93.01 O ATOM 1330 OD2 ASP A 160 133.494 116.224 306.516 1.00 96.75 O ATOM 1331 H ASP A 160 129.575 112.929 306.203 1.00 0.00 H ATOM 1332 N TYR A 161 129.076 116.375 304.340 1.00 84.05 N ATOM 1333 CA TYR A 161 128.568 116.645 303.016 1.00 88.25 C ATOM 1334 C TYR A 161 129.481 117.568 302.214 1.00 83.11 C ATOM 1335 O TYR A 161 129.091 118.002 301.129 1.00 89.50 O ATOM 1336 CB TYR A 161 127.148 117.208 303.127 1.00 78.78 C ATOM 1337 CG TYR A 161 126.169 116.215 303.737 1.00101.55 C ATOM 1338 CD1 TYR A 161 126.151 115.923 305.102 1.00 99.42 C ATOM 1339 CD2 TYR A 161 125.323 115.495 302.909 1.00100.57 C ATOM 1340 CE1 TYR A 161 125.259 114.977 305.613 1.00 95.06 C ATOM 1341 CE2 TYR A 161 124.452 114.560 303.394 1.00 87.68 C ATOM 1342 CZ TYR A 161 124.414 114.297 304.733 1.00 97.89 C ATOM 1343 OH TYR A 161 123.507 113.340 305.150 1.00 93.82 O ATOM 1344 HH TYR A 161 123.569 113.235 306.132 1.00 0.00 H ATOM 1345 H TYR A 161 128.894 117.067 305.095 1.00 0.00 H ATOM 1346 N THR A 162 130.680 117.873 302.741 1.00 83.93 N ATOM 1347 CA THR A 162 131.773 118.590 302.071 1.00 80.05 C ATOM 1348 C THR A 162 131.451 120.045 301.737 1.00 78.71 C ATOM 1349 O THR A 162 132.055 120.953 302.319 1.00 79.43 O ATOM 1350 CB THR A 162 132.211 117.846 300.801 1.00 81.26 C ATOM 1351 OG1 THR A 162 132.212 116.434 301.055 1.00 78.65 O ATOM 1352 CG2 THR A 162 133.617 118.283 300.375 1.00 85.21 C ATOM 1353 HG1 THR A 162 132.494 115.953 300.237 1.00 0.00 H ATOM 1354 H THR A 162 130.851 117.571 303.721 1.00 0.00 H ATOM 1355 N LEU A 163 130.533 120.280 300.795 1.00 74.79 N ATOM 1356 CA LEU A 163 130.138 121.624 300.390 1.00 78.40 C ATOM 1357 C LEU A 163 129.078 122.197 301.324 1.00 87.81 C ATOM 1358 O LEU A 163 128.443 121.485 302.102 1.00 97.07 O ATOM 1359 CB LEU A 163 129.583 121.631 298.967 1.00 67.93 C ATOM 1360 CG LEU A 163 130.439 120.936 297.921 1.00 77.63 C ATOM 1361 CD1 LEU A 163 129.663 120.824 296.612 1.00 68.37 C ATOM 1362 CD2 LEU A 163 131.717 121.717 297.751 1.00 70.03 C ATOM 1363 H LEU A 163 130.080 119.468 300.330 1.00 0.00 H ATOM 1364 N ASP A 164 128.863 123.504 301.206 1.00 85.63 N ATOM 1365 CA ASP A 164 127.812 124.156 301.965 1.00 86.36 C ATOM 1366 C ASP A 164 126.442 123.853 301.355 1.00 87.26 C ATOM 1367 O ASP A 164 126.324 123.338 300.234 1.00 82.20 O ATOM 1368 CB ASP A 164 128.059 125.660 302.038 1.00 93.01 C ATOM 1369 CG ASP A 164 128.192 126.298 300.679 1.00104.91 C ATOM 1370 OD1 ASP A 164 128.186 125.567 299.664 1.00109.70 O ATOM 1371 OD2 ASP A 164 128.311 127.539 300.630 1.00111.67 O ATOM 1372 H ASP A 164 129.455 124.066 300.562 1.00 0.00 H ATOM 1373 N GLU A 165 125.398 124.191 302.124 1.00 83.07 N ATOM 1374 CA GLU A 165 124.029 123.817 301.776 1.00 81.15 C ATOM 1375 C GLU A 165 123.642 124.313 300.386 1.00 78.57 C ATOM 1376 O GLU A 165 123.076 123.553 299.591 1.00 82.88 O ATOM 1377 CB GLU A 165 123.052 124.348 302.839 1.00 78.23 C ATOM 1378 H GLU A 165 125.567 124.735 302.994 1.00 0.00 H ATOM 1379 N GLU A 166 123.956 125.576 300.058 1.00 75.24 N ATOM 1380 CA GLU A 166 123.456 126.154 298.801 1.00 79.57 C ATOM 1381 C GLU A 166 124.097 125.512 297.573 1.00 68.79 C ATOM 1382 O GLU A 166 123.436 125.361 296.537 1.00 70.11 O ATOM 1383 CB GLU A 166 123.661 127.671 298.774 1.00 89.47 C ATOM 1384 CG GLU A 166 124.968 128.146 299.374 1.00104.73 C ATOM 1385 CD GLU A 166 124.809 128.598 300.828 1.00116.41 C ATOM 1386 OE1 GLU A 166 124.906 127.741 301.735 1.00119.72 O ATOM 1387 OE2 GLU A 166 124.589 129.809 301.067 1.00121.21 O ATOM 1388 H GLU A 166 124.552 126.146 300.692 1.00 0.00 H ATOM 1389 N SER A 167 125.373 125.127 297.653 1.00 70.61 N ATOM 1390 CA SER A 167 125.976 124.457 296.498 1.00 69.35 C ATOM 1391 C SER A 167 125.382 123.069 296.300 1.00 73.78 C ATOM 1392 O SER A 167 125.181 122.622 295.167 1.00 68.24 O ATOM 1393 CB SER A 167 127.493 124.373 296.654 1.00 66.60 C ATOM 1394 OG SER A 167 128.038 125.640 297.007 1.00 72.87 O ATOM 1395 HG SER A 167 127.645 125.939 297.865 1.00 0.00 H ATOM 1396 H SER A 167 125.927 125.299 298.516 1.00 0.00 H ATOM 1397 N ARG A 168 125.089 122.370 297.390 1.00 73.15 N ATOM 1398 CA ARG A 168 124.402 121.092 297.273 1.00 75.30 C ATOM 1399 C ARG A 168 122.981 121.291 296.768 1.00 74.15 C ATOM 1400 O ARG A 168 122.510 120.522 295.924 1.00 74.69 O ATOM 1401 CB ARG A 168 124.410 120.369 298.624 1.00 81.94 C ATOM 1402 CG ARG A 168 125.767 119.804 298.965 1.00 80.38 C ATOM 1403 CD ARG A 168 126.084 120.010 300.434 1.00 84.04 C ATOM 1404 NE ARG A 168 125.169 119.247 301.273 1.00 80.49 N ATOM 1405 CZ ARG A 168 124.856 119.573 302.522 1.00 77.53 C ATOM 1406 NH1 ARG A 168 125.398 120.640 303.095 1.00 79.77 N ATOM 1407 NH2 ARG A 168 124.005 118.821 303.204 1.00 80.05 N ATOM 1408 HE ARG A 168 124.734 118.394 300.868 1.00 0.00 H ATOM 1409 HH12 ARG A 168 125.148 120.888 304.073 1.00 0.00 H ATOM 1410 HH11 ARG A 168 126.073 121.228 302.566 1.00 0.00 H ATOM 1411 HH22 ARG A 168 123.757 119.073 304.182 1.00 0.00 H ATOM 1412 HH21 ARG A 168 123.585 117.979 302.761 1.00 0.00 H ATOM 1413 H ARG A 168 125.350 122.736 298.328 1.00 0.00 H ATOM 1414 N ALA A 169 122.304 122.343 297.246 1.00 70.15 N ATOM 1415 CA ALA A 169 120.927 122.610 296.836 1.00 75.93 C ATOM 1416 C ALA A 169 120.837 122.880 295.335 1.00 70.94 C ATOM 1417 O ALA A 169 119.904 122.412 294.668 1.00 72.03 O ATOM 1418 CB ALA A 169 120.357 123.786 297.645 1.00 70.20 C ATOM 1419 H ALA A 169 122.767 122.983 297.922 1.00 0.00 H ATOM 1420 N ARG A 170 121.815 123.604 294.782 1.00 70.65 N ATOM 1421 CA ARG A 170 121.873 123.804 293.328 1.00 73.72 C ATOM 1422 C ARG A 170 121.894 122.482 292.570 1.00 71.18 C ATOM 1423 O ARG A 170 121.123 122.289 291.624 1.00 73.94 O ATOM 1424 CB ARG A 170 123.103 124.617 292.954 1.00 68.08 C ATOM 1425 CG ARG A 170 123.070 126.058 293.426 1.00 84.50 C ATOM 1426 CD ARG A 170 124.348 126.745 293.003 1.00 88.65 C ATOM 1427 NE ARG A 170 124.515 126.690 291.552 1.00108.10 N ATOM 1428 CZ ARG A 170 125.537 126.110 290.920 1.00115.37 C ATOM 1429 NH1 ARG A 170 126.516 125.525 291.607 1.00124.58 N ATOM 1430 NH2 ARG A 170 125.582 126.115 289.592 1.00106.59 N ATOM 1431 HE ARG A 170 123.781 127.137 290.967 1.00 0.00 H ATOM 1432 HH12 ARG A 170 127.308 125.076 291.104 1.00 0.00 H ATOM 1433 HH11 ARG A 170 126.489 125.517 292.647 1.00 0.00 H ATOM 1434 HH22 ARG A 170 126.377 125.664 289.097 1.00 0.00 H ATOM 1435 HH21 ARG A 170 124.822 126.570 289.048 1.00 0.00 H ATOM 1436 H ARG A 170 122.544 124.031 295.389 1.00 0.00 H ATOM 1437 N ILE A 171 122.768 121.559 292.969 1.00 65.79 N ATOM 1438 CA ILE A 171 122.809 120.239 292.341 1.00 63.88 C ATOM 1439 C ILE A 171 121.436 119.549 292.404 1.00 73.53 C ATOM 1440 O ILE A 171 120.947 119.033 291.391 1.00 72.90 O ATOM 1441 CB ILE A 171 123.932 119.400 292.980 1.00 71.20 C ATOM 1442 CG1 ILE A 171 125.282 119.829 292.373 1.00 67.07 C ATOM 1443 CG2 ILE A 171 123.707 117.919 292.776 1.00 62.56 C ATOM 1444 CD1 ILE A 171 126.453 119.648 293.314 1.00 65.77 C ATOM 1445 H ILE A 171 123.431 121.781 293.739 1.00 0.00 H ATOM 1446 N LYS A 172 120.779 119.538 293.581 1.00 68.17 N ATOM 1447 CA LYS A 172 119.497 118.827 293.668 1.00 70.41 C ATOM 1448 C LYS A 172 118.425 119.487 292.811 1.00 71.48 C ATOM 1449 O LYS A 172 117.570 118.799 292.241 1.00 70.46 O ATOM 1450 CB LYS A 172 118.968 118.747 295.111 1.00 69.46 C ATOM 1451 CG LYS A 172 119.937 118.316 296.178 1.00 78.36 C ATOM 1452 CD LYS A 172 119.263 118.373 297.572 1.00 79.53 C ATOM 1453 CE LYS A 172 120.300 118.532 298.667 1.00 86.69 C ATOM 1454 NZ LYS A 172 120.100 119.796 299.469 1.00 83.79 N ATOM 1455 HZ1 LYS A 172 120.169 120.620 298.838 1.00 0.00 H ATOM 1456 HZ2 LYS A 172 119.161 119.777 299.915 1.00 0.00 H ATOM 1457 HZ3 LYS A 172 120.833 119.858 300.204 1.00 0.00 H ATOM 1458 H LYS A 172 121.173 120.024 294.412 1.00 0.00 H ATOM 1459 N THR A 173 118.385 120.824 292.807 1.00 65.62 N ATOM 1460 CA THR A 173 117.482 121.543 291.914 1.00 83.90 C ATOM 1461 C THR A 173 117.665 121.101 290.464 1.00 69.10 C ATOM 1462 O THR A 173 116.686 120.815 289.766 1.00 74.32 O ATOM 1463 CB THR A 173 117.712 123.045 292.072 1.00 80.94 C ATOM 1464 OG1 THR A 173 117.248 123.450 293.371 1.00 72.56 O ATOM 1465 CG2 THR A 173 117.018 123.844 290.978 1.00 72.24 C ATOM 1466 HG1 THR A 173 117.750 122.958 294.068 1.00 0.00 H ATOM 1467 H THR A 173 119.005 121.358 293.449 1.00 0.00 H ATOM 1468 N ARG A 174 118.908 120.982 290.010 1.00 66.94 N ATOM 1469 CA ARG A 174 119.133 120.622 288.611 1.00 65.67 C ATOM 1470 C ARG A 174 118.730 119.172 288.331 1.00 74.28 C ATOM 1471 O ARG A 174 118.138 118.872 287.280 1.00 63.75 O ATOM 1472 CB ARG A 174 120.591 120.875 288.260 1.00 62.47 C ATOM 1473 CG ARG A 174 121.006 120.330 286.896 1.00 67.10 C ATOM 1474 CD ARG A 174 120.611 121.239 285.763 1.00 65.93 C ATOM 1475 NE ARG A 174 121.114 120.677 284.506 1.00 69.78 N ATOM 1476 CZ ARG A 174 120.391 120.541 283.402 1.00 67.90 C ATOM 1477 NH1 ARG A 174 119.121 120.926 283.391 1.00 76.09 N ATOM 1478 NH2 ARG A 174 120.930 119.994 282.320 1.00 75.27 N ATOM 1479 HE ARG A 174 122.105 120.364 284.478 1.00 0.00 H ATOM 1480 HH12 ARG A 174 118.553 120.820 282.526 1.00 0.00 H ATOM 1481 HH11 ARG A 174 118.694 121.334 284.247 1.00 0.00 H ATOM 1482 HH22 ARG A 174 120.364 119.887 281.454 1.00 0.00 H ATOM 1483 HH21 ARG A 174 121.919 119.672 282.338 1.00 0.00 H ATOM 1484 H ARG A 174 119.715 121.144 290.645 1.00 0.00 H ATOM 1485 N LEU A 175 119.013 118.261 289.269 1.00 73.55 N ATOM 1486 CA LEU A 175 118.582 116.877 289.107 1.00 73.85 C ATOM 1487 C LEU A 175 117.073 116.784 288.905 1.00 82.20 C ATOM 1488 O LEU A 175 116.601 116.060 288.019 1.00 86.09 O ATOM 1489 CB LEU A 175 119.004 116.052 290.325 1.00 70.73 C ATOM 1490 CG LEU A 175 120.508 115.799 290.324 1.00 74.78 C ATOM 1491 CD1 LEU A 175 120.962 115.093 291.569 1.00 65.67 C ATOM 1492 CD2 LEU A 175 120.904 115.002 289.079 1.00 75.13 C ATOM 1493 H LEU A 175 119.543 118.541 290.119 1.00 0.00 H ATOM 1494 N PHE A 176 116.296 117.511 289.718 1.00 77.33 N ATOM 1495 CA PHE A 176 114.840 117.433 289.607 1.00 78.87 C ATOM 1496 C PHE A 176 114.336 118.100 288.334 1.00 73.68 C ATOM 1497 O PHE A 176 113.276 117.725 287.821 1.00 77.39 O ATOM 1498 CB PHE A 176 114.169 118.067 290.831 1.00 82.52 C ATOM 1499 CG PHE A 176 112.765 117.547 291.101 1.00 85.12 C ATOM 1500 CD1 PHE A 176 112.567 116.401 291.851 1.00 93.50 C ATOM 1501 CD2 PHE A 176 111.653 118.217 290.607 1.00 82.21 C ATOM 1502 CE1 PHE A 176 111.283 115.926 292.101 1.00 98.72 C ATOM 1503 CE2 PHE A 176 110.376 117.755 290.838 1.00 87.07 C ATOM 1504 CZ PHE A 176 110.183 116.605 291.590 1.00 95.95 C ATOM 1505 H PHE A 176 116.729 118.133 290.430 1.00 0.00 H ATOM 1506 N THR A 177 115.056 119.105 287.825 1.00 71.99 N ATOM 1507 CA THR A 177 114.685 119.678 286.533 1.00 76.93 C ATOM 1508 C THR A 177 114.890 118.668 285.412 1.00 76.22 C ATOM 1509 O THR A 177 114.052 118.558 284.506 1.00 74.23 O ATOM 1510 CB THR A 177 115.488 120.949 286.251 1.00 77.82 C ATOM 1511 OG1 THR A 177 115.036 121.999 287.119 1.00 75.37 O ATOM 1512 CG2 THR A 177 115.322 121.379 284.774 1.00 61.02 C ATOM 1513 HG1 THR A 177 115.555 122.822 286.937 1.00 0.00 H ATOM 1514 H THR A 177 115.876 119.477 288.346 1.00 0.00 H ATOM 1515 N ILE A 178 115.994 117.911 285.468 1.00 69.74 N ATOM 1516 CA ILE A 178 116.219 116.860 284.477 1.00 74.07 C ATOM 1517 C ILE A 178 115.092 115.837 284.531 1.00 79.24 C ATOM 1518 O ILE A 178 114.568 115.408 283.495 1.00 79.33 O ATOM 1519 CB ILE A 178 117.597 116.207 284.693 1.00 72.19 C ATOM 1520 CG1 ILE A 178 118.715 117.164 284.251 1.00 68.24 C ATOM 1521 CG2 ILE A 178 117.696 114.897 283.914 1.00 72.85 C ATOM 1522 CD1 ILE A 178 120.095 116.654 284.591 1.00 67.59 C ATOM 1523 H ILE A 178 116.694 118.072 286.220 1.00 0.00 H ATOM 1524 N ARG A 179 114.680 115.452 285.737 1.00 75.66 N ATOM 1525 CA ARG A 179 113.562 114.525 285.861 1.00 76.98 C ATOM 1526 C ARG A 179 112.315 115.070 285.168 1.00 79.54 C ATOM 1527 O ARG A 179 111.659 114.359 284.398 1.00 80.73 O ATOM 1528 CB ARG A 179 113.277 114.250 287.337 1.00 84.74 C ATOM 1529 CG ARG A 179 111.916 113.604 287.578 1.00 86.29 C ATOM 1530 CD ARG A 179 111.574 113.534 289.053 1.00 89.03 C ATOM 1531 NE ARG A 179 110.603 112.475 289.296 1.00101.89 N ATOM 1532 CZ ARG A 179 110.508 111.797 290.431 1.00103.52 C ATOM 1533 NH1 ARG A 179 111.332 112.072 291.435 1.00 99.45 N ATOM 1534 NH2 ARG A 179 109.596 110.842 290.555 1.00108.50 N ATOM 1535 HE ARG A 179 109.942 112.236 288.530 1.00 0.00 H ATOM 1536 HH12 ARG A 179 111.260 111.542 292.327 1.00 0.00 H ATOM 1537 HH11 ARG A 179 112.049 112.818 291.330 1.00 0.00 H ATOM 1538 HH22 ARG A 179 109.519 110.309 291.444 1.00 0.00 H ATOM 1539 HH21 ARG A 179 108.958 110.627 289.763 1.00 0.00 H ATOM 1540 H ARG A 179 115.155 115.812 286.589 1.00 0.00 H ATOM 1541 N GLN A 180 111.966 116.334 285.435 1.00 76.29 N ATOM 1542 CA GLN A 180 110.742 116.898 284.870 1.00 78.47 C ATOM 1543 C GLN A 180 110.801 116.951 283.348 1.00 79.34 C ATOM 1544 O GLN A 180 109.838 116.588 282.662 1.00 83.16 O ATOM 1545 CB GLN A 180 110.514 118.294 285.424 1.00 78.25 C ATOM 1546 CG GLN A 180 110.125 118.325 286.897 1.00 87.62 C ATOM 1547 CD GLN A 180 109.841 119.733 287.319 1.00 83.99 C ATOM 1548 OE1 GLN A 180 110.736 120.459 287.767 1.00 83.08 O ATOM 1549 NE2 GLN A 180 108.605 120.161 287.116 1.00 86.83 N ATOM 1550 HE22 GLN A 180 107.886 119.512 286.737 1.00 0.00 H ATOM 1551 HE21 GLN A 180 108.353 121.146 287.335 1.00 0.00 H ATOM 1552 H GLN A 180 112.569 116.918 286.048 1.00 0.00 H ATOM 1553 N GLU A 181 111.914 117.439 282.804 1.00 77.07 N ATOM 1554 CA GLU A 181 112.041 117.507 281.355 1.00 75.45 C ATOM 1555 C GLU A 181 111.877 116.121 280.735 1.00 78.96 C ATOM 1556 O GLU A 181 111.103 115.945 279.786 1.00 87.37 O ATOM 1557 CB GLU A 181 113.381 118.140 280.987 1.00 73.44 C ATOM 1558 CG GLU A 181 113.498 119.616 281.362 1.00 83.34 C ATOM 1559 CD GLU A 181 112.578 120.514 280.545 1.00103.18 C ATOM 1560 OE1 GLU A 181 112.889 120.771 279.358 1.00111.25 O ATOM 1561 OE2 GLU A 181 111.554 120.978 281.093 1.00112.50 O ATOM 1562 H GLU A 181 112.690 117.770 283.412 1.00 0.00 H ATOM 1563 N MET A 182 112.548 115.115 281.306 1.00 75.09 N ATOM 1564 CA MET A 182 112.331 113.728 280.893 1.00 80.02 C ATOM 1565 C MET A 182 110.864 113.330 280.996 1.00 86.29 C ATOM 1566 O MET A 182 110.307 112.730 280.068 1.00 92.39 O ATOM 1567 CB MET A 182 113.181 112.784 281.742 1.00 81.06 C ATOM 1568 CG MET A 182 114.657 112.816 281.408 1.00 77.44 C ATOM 1569 SD MET A 182 115.468 111.377 282.118 1.00 86.64 S ATOM 1570 CE MET A 182 117.160 111.739 281.652 1.00 82.42 C ATOM 1571 H MET A 182 113.237 115.322 282.057 1.00 0.00 H ATOM 1572 N ALA A 183 110.225 113.618 282.135 1.00 87.95 N ATOM 1573 CA ALA A 183 108.841 113.183 282.310 1.00 85.83 C ATOM 1574 C ALA A 183 107.922 113.892 281.326 1.00 83.38 C ATOM 1575 O ALA A 183 106.991 113.281 280.788 1.00 84.17 O ATOM 1576 CB ALA A 183 108.379 113.417 283.752 1.00 84.32 C ATOM 1577 H ALA A 183 110.708 114.147 282.889 1.00 0.00 H ATOM 1578 N SER A 184 108.182 115.179 281.064 1.00 83.24 N ATOM 1579 CA SER A 184 107.398 115.937 280.096 1.00 96.35 C ATOM 1580 C SER A 184 107.457 115.337 278.692 1.00 96.74 C ATOM 1581 O SER A 184 106.569 115.608 277.877 1.00 95.22 O ATOM 1582 CB SER A 184 107.877 117.388 280.064 1.00105.92 C ATOM 1583 OG SER A 184 107.325 118.079 278.959 1.00112.66 O ATOM 1584 HG SER A 184 107.603 117.633 278.120 1.00 0.00 H ATOM 1585 H SER A 184 108.963 115.650 281.564 1.00 0.00 H ATOM 1586 N ARG A 185 108.479 114.536 278.389 1.00 90.26 N ATOM 1587 CA ARG A 185 108.578 113.843 277.111 1.00 85.82 C ATOM 1588 C ARG A 185 108.305 112.346 277.231 1.00 91.97 C ATOM 1589 O ARG A 185 108.544 111.607 276.273 1.00 95.16 O ATOM 1590 CB ARG A 185 109.957 114.073 276.487 1.00 78.26 C ATOM 1591 CG ARG A 185 110.414 115.536 276.458 1.00 76.47 C ATOM 1592 CD ARG A 185 111.910 115.628 276.156 1.00 75.98 C ATOM 1593 NE ARG A 185 112.322 116.899 275.555 1.00 69.58 N ATOM 1594 CZ ARG A 185 112.461 118.041 276.230 1.00 76.14 C ATOM 1595 NH1 ARG A 185 112.166 118.093 277.529 1.00 73.68 N ATOM 1596 NH2 ARG A 185 112.861 119.144 275.608 1.00 74.74 N ATOM 1597 HE ARG A 185 112.519 116.912 274.534 1.00 0.00 H ATOM 1598 HH12 ARG A 185 112.276 118.985 278.052 1.00 0.00 H ATOM 1599 HH11 ARG A 185 111.826 117.241 278.020 1.00 0.00 H ATOM 1600 HH22 ARG A 185 112.967 120.031 276.140 1.00 0.00 H ATOM 1601 HH21 ARG A 185 113.068 119.120 274.589 1.00 0.00 H ATOM 1602 H ARG A 185 109.234 114.401 279.091 1.00 0.00 H ATOM 1603 N SER A 186 107.830 111.880 278.386 1.00 92.91 N ATOM 1604 CA SER A 186 107.462 110.481 278.624 1.00101.39 C ATOM 1605 C SER A 186 108.660 109.535 278.626 1.00 96.84 C ATOM 1606 O SER A 186 108.484 108.308 278.550 1.00 96.33 O ATOM 1607 CB SER A 186 106.415 109.985 277.617 1.00103.67 C ATOM 1608 OG SER A 186 105.278 110.831 277.584 1.00103.01 O ATOM 1609 HG SER A 186 104.627 110.481 276.926 1.00 0.00 H ATOM 1610 H SER A 186 107.713 112.553 279.170 1.00 0.00 H ATOM 1611 N LEU A 187 109.869 110.081 278.741 1.00 95.03 N ATOM 1612 CA LEU A 187 111.103 109.310 278.830 1.00 94.10 C ATOM 1613 C LEU A 187 111.468 108.926 280.255 1.00 92.14 C ATOM 1614 O LEU A 187 112.321 108.049 280.441 1.00 91.00 O ATOM 1615 CB LEU A 187 112.273 110.101 278.217 1.00 86.15 C ATOM 1616 CG LEU A 187 112.013 110.740 276.850 1.00 85.78 C ATOM 1617 CD1 LEU A 187 113.173 111.630 276.402 1.00 77.96 C ATOM 1618 CD2 LEU A 187 111.734 109.645 275.826 1.00 86.71 C ATOM 1619 H LEU A 187 109.937 111.118 278.769 1.00 0.00 H ATOM 1620 N TRP A 188 110.855 109.565 281.255 1.00 93.91 N ATOM 1621 CA TRP A 188 111.203 109.290 282.645 1.00 89.05 C ATOM 1622 C TRP A 188 110.929 107.841 283.023 1.00 95.26 C ATOM 1623 O TRP A 188 111.763 107.204 283.679 1.00 94.89 O ATOM 1624 CB TRP A 188 110.434 110.209 283.584 1.00 80.63 C ATOM 1625 CG TRP A 188 110.721 109.850 284.989 1.00 88.31 C ATOM 1626 CD1 TRP A 188 109.880 109.241 285.883 1.00 90.59 C ATOM 1627 CD2 TRP A 188 111.967 110.020 285.661 1.00 92.69 C ATOM 1628 NE1 TRP A 188 110.525 109.051 287.085 1.00 89.88 N ATOM 1629 CE2 TRP A 188 111.810 109.518 286.973 1.00 94.30 C ATOM 1630 CE3 TRP A 188 113.204 110.565 285.285 1.00 92.89 C ATOM 1631 CZ2 TRP A 188 112.841 109.547 287.910 1.00 97.15 C ATOM 1632 CZ3 TRP A 188 114.227 110.593 286.214 1.00 93.01 C ATOM 1633 CH2 TRP A 188 114.040 110.087 287.515 1.00 97.20 C ATOM 1634 HE1 TRP A 188 110.107 108.624 287.936 1.00 0.00 H ATOM 1635 H TRP A 188 110.120 110.268 281.040 1.00 0.00 H ATOM 1636 N ASP A 189 109.753 107.317 282.648 1.00 97.26 N ATOM 1637 CA ASP A 189 109.417 105.923 282.933 1.00104.50 C ATOM 1638 C ASP A 189 110.531 104.978 282.496 1.00105.26 C ATOM 1639 O ASP A 189 111.032 104.179 283.296 1.00 99.60 O ATOM 1640 CB ASP A 189 108.106 105.534 282.240 1.00113.27 C ATOM 1641 CG ASP A 189 106.882 106.075 282.949 1.00122.32 C ATOM 1642 OD1 ASP A 189 106.928 106.231 284.190 1.00121.15 O ATOM 1643 OD2 ASP A 189 105.869 106.329 282.261 1.00128.21 O ATOM 1644 H ASP A 189 109.066 107.914 282.144 1.00 0.00 H ATOM 1645 N SER A 190 110.933 105.056 281.221 1.00104.99 N ATOM 1646 CA SER A 190 111.983 104.170 280.728 1.00106.15 C ATOM 1647 C SER A 190 113.291 104.395 281.476 1.00104.05 C ATOM 1648 O SER A 190 113.982 103.434 281.840 1.00103.00 O ATOM 1649 CB SER A 190 112.181 104.376 279.228 1.00110.01 C ATOM 1650 OG SER A 190 113.352 103.714 278.778 1.00114.72 O ATOM 1651 HG SER A 190 113.460 103.861 277.805 1.00 0.00 H ATOM 1652 H SER A 190 110.496 105.749 280.581 1.00 0.00 H ATOM 1653 N PHE A 191 113.635 105.662 281.732 1.00102.82 N ATOM 1654 CA PHE A 191 114.891 105.978 282.408 1.00 98.20 C ATOM 1655 C PHE A 191 114.920 105.416 283.822 1.00 98.79 C ATOM 1656 O PHE A 191 115.936 104.855 284.246 1.00 92.62 O ATOM 1657 CB PHE A 191 115.108 107.493 282.435 1.00 90.40 C ATOM 1658 CG PHE A 191 116.463 107.906 282.952 1.00 91.38 C ATOM 1659 CD1 PHE A 191 117.626 107.542 282.269 1.00 88.31 C ATOM 1660 CD2 PHE A 191 116.576 108.668 284.110 1.00 90.79 C ATOM 1661 CE1 PHE A 191 118.881 107.922 282.731 1.00 80.47 C ATOM 1662 CE2 PHE A 191 117.823 109.054 284.588 1.00 90.70 C ATOM 1663 CZ PHE A 191 118.983 108.682 283.892 1.00 87.73 C ATOM 1664 H PHE A 191 112.999 106.433 281.446 1.00 0.00 H ATOM 1665 N ARG A 192 113.814 105.555 284.563 1.00110.06 N ATOM 1666 CA ARG A 192 113.781 105.099 285.951 1.00118.04 C ATOM 1667 C ARG A 192 113.994 103.592 286.049 1.00118.52 C ATOM 1668 O ARG A 192 114.744 103.120 286.912 1.00124.75 O ATOM 1669 CB ARG A 192 112.454 105.499 286.606 1.00125.68 C ATOM 1670 CG ARG A 192 112.448 105.451 288.137 1.00130.65 C ATOM 1671 CD ARG A 192 111.050 105.726 288.699 1.00135.54 C ATOM 1672 NE ARG A 192 111.102 106.524 289.923 1.00135.92 N ATOM 1673 CZ ARG A 192 110.143 107.354 290.327 1.00134.19 C ATOM 1674 NH1 ARG A 192 109.038 107.509 289.607 1.00131.25 N ATOM 1675 NH2 ARG A 192 110.291 108.034 291.457 1.00133.87 N ATOM 1676 HE ARG A 192 111.949 106.437 290.521 1.00 0.00 H ATOM 1677 HH12 ARG A 192 108.294 108.160 289.930 1.00 0.00 H ATOM 1678 HH11 ARG A 192 108.917 106.980 288.720 1.00 0.00 H ATOM 1679 HH22 ARG A 192 109.543 108.683 291.775 1.00 0.00 H ATOM 1680 HH21 ARG A 192 111.155 107.918 292.025 1.00 0.00 H ATOM 1681 H ARG A 192 112.968 105.993 284.146 1.00 0.00 H ATOM 1682 N GLN A 193 113.359 102.821 285.168 1.00113.84 N ATOM 1683 CA GLN A 193 113.431 101.366 285.219 1.00114.94 C ATOM 1684 C GLN A 193 114.616 100.796 284.435 1.00121.85 C ATOM 1685 O GLN A 193 114.630 99.595 284.144 1.00126.70 O ATOM 1686 CB GLN A 193 112.118 100.758 284.715 1.00111.89 C ATOM 1687 H GLN A 193 112.794 103.271 284.420 1.00 0.00 H ATOM 1688 N SER A 194 115.608 101.624 284.095 1.00122.51 N ATOM 1689 CA SER A 194 116.814 101.167 283.413 1.00122.20 C ATOM 1690 C SER A 194 117.972 100.859 284.355 1.00121.62 C ATOM 1691 O SER A 194 118.785 99.979 284.050 1.00125.76 O ATOM 1692 CB SER A 194 117.278 102.215 282.396 1.00121.59 C ATOM 1693 OG SER A 194 118.661 102.069 282.127 1.00123.80 O ATOM 1694 HG SER A 194 119.173 102.186 282.966 1.00 0.00 H ATOM 1695 H SER A 194 115.517 102.634 284.326 1.00 0.00 H ATOM 1696 N GLU A 195 118.072 101.560 285.482 1.00118.18 N ATOM 1697 CA GLU A 195 119.185 101.392 286.414 1.00116.26 C ATOM 1698 C GLU A 195 119.229 99.994 287.035 1.00121.16 C ATOM 1699 O GLU A 195 118.194 99.419 287.376 1.00127.56 O ATOM 1700 CB GLU A 195 119.104 102.450 287.516 1.00110.66 C ATOM 1701 CG GLU A 195 120.090 102.236 288.647 1.00114.93 C ATOM 1702 CD GLU A 195 120.313 103.495 289.456 1.00111.55 C ATOM 1703 OE1 GLU A 195 119.994 104.586 288.943 1.00106.41 O ATOM 1704 OE2 GLU A 195 120.801 103.396 290.602 1.00110.08 O ATOM 1705 H GLU A 195 117.330 102.253 285.708 1.00 0.00 H TER 1706 GLU A 195 HETATM 1707 MN MN A 1 130.755 108.443 290.424 1.00 81.11 MN HETATM 1708 MN MN A 2 133.465 108.029 288.200 1.00 87.88 MN HETATM 1709 O HOH 3 135.259 107.997 287.851 1.00 52.48 O HETATM 1710 O HOH 4 134.444 107.035 289.967 1.00 58.48 O HETATM 1711 O HOH 5 135.757 111.341 278.180 1.00 69.13 O HETATM 1712 O HOH 6 136.904 107.986 281.259 1.00 85.00 O HETATM 1713 O HOH 7 126.552 107.556 289.622 1.00 80.00 O HETATM 1714 O HOH 8 147.283 119.297 288.970 1.00 75.57 O HETATM 1715 O HOH 9 140.258 101.874 285.800 1.00 98.81 O HETATM 1716 O HOH 10 124.965 121.051 281.059 1.00 69.30 O HETATM 1717 O HOH 11 115.639 120.939 277.591 1.00 84.79 O HETATM 1718 O HOH 12 117.400 124.111 287.178 1.00 81.59 O HETATM 1719 O HOH 13 131.743 129.695 291.333 1.00 97.18 O HETATM 1720 C1 GY A 8 126.349 105.321 285.582 1.00 0.09 C HETATM 1721 C2 GY A 8 127.649 105.248 285.074 1.00 0.10 C HETATM 1722 C22 GY A 8 128.367 106.444 285.011 1.00 0.09 C HETATM 1723 C23 GY A 8 127.763 107.625 285.422 1.00 0.03 C HETATM 1724 N5 GY A 8 126.521 107.673 285.898 1.00 -0.29 N HETATM 1725 C24 GY A 8 125.825 106.544 285.978 1.00 0.03 C HETATM 1726 H14 GY A 8 124.813 106.579 286.366 1.00 0.08 H HETATM 1727 H13 GY A 8 128.327 108.548 285.352 1.00 0.08 H HETATM 1728 CL2 GY A 8 129.984 106.478 284.411 1.00 -0.06 CL HETATM 1729 C3 GY A 8 128.253 103.932 284.676 1.00 0.22 C HETATM 1730 N1 GY A 8 128.649 103.115 285.664 1.00 -0.25 N HETATM 1731 C21 GY A 8 129.325 101.822 285.451 1.00 0.04 C HETATM 1732 C20 GY A 8 129.821 101.468 286.838 1.00 -0.03 C HETATM 1733 C19 GY A 8 128.711 102.014 287.723 1.00 -0.01 C HETATM 1734 C4 GY A 8 128.460 103.401 287.107 1.00 0.13 C HETATM 1735 C5 GY A 8 129.360 104.507 287.615 1.00 0.16 C HETATM 1736 N2 GY A 8 130.548 104.638 287.020 1.00 -0.30 N HETATM 1737 C6 GY A 8 131.399 105.584 287.442 1.00 0.11 C HETATM 1738 C17 GY A 8 131.067 106.450 288.446 1.00 0.18 C HETATM 1739 C18 GY A 8 129.824 106.348 289.080 1.00 0.26 C HETATM 1740 N4 GY A 8 128.984 105.351 288.632 1.00 -0.19 N HETATM 1741 H20 GY A 8 128.085 105.240 289.055 1.00 0.25 H HETATM 1742 O4 GY A 8 129.450 107.093 290.004 1.00 -0.40 O HETATM 1743 O3 GY A 8 131.880 107.417 288.890 1.00 -0.33 O HETATM 1744 H21 GY A 8 132.682 107.028 289.220 1.00 0.25 H HETATM 1745 C7 GY A 8 132.711 105.656 286.709 1.00 0.20 C HETATM 1746 N3 GY A 8 132.739 105.011 285.538 1.00 -0.28 N HETATM 1747 C8 GY A 8 133.936 104.911 284.727 1.00 0.06 C HETATM 1748 C16 GY A 8 133.921 103.562 283.981 1.00 0.00 C HETATM 1749 C11 GY A 8 133.011 103.853 282.816 1.00 -0.04 C HETATM 1750 C10 GY A 8 132.989 105.219 282.573 1.00 -0.04 C HETATM 1751 C15 GY A 8 132.221 105.738 281.540 1.00 -0.07 C HETATM 1752 C14 GY A 8 131.476 104.870 280.760 1.00 -0.08 C HETATM 1753 C13 GY A 8 131.501 103.509 281.000 1.00 -0.08 C HETATM 1754 C12 GY A 8 132.265 102.987 282.030 1.00 -0.07 C HETATM 1755 H1 GY A 8 132.280 101.920 282.219 1.00 0.05 H HETATM 1756 H2 GY A 8 130.916 102.843 280.375 1.00 0.05 H HETATM 1757 H3 GY A 8 130.867 105.262 279.953 1.00 0.05 H HETATM 1758 H4 GY A 8 132.205 106.805 281.347 1.00 0.05 H HETATM 1759 C9 GY A 8 133.880 105.921 283.563 1.00 0.00 C HETATM 1760 H17 GY A 8 133.442 106.877 283.886 1.00 0.04 H HETATM 1761 H18 GY A 8 134.880 106.100 283.142 1.00 0.04 H HETATM 1762 H5 GY A 8 134.929 103.284 283.640 1.00 0.04 H HETATM 1763 H6 GY A 8 133.514 102.760 284.615 1.00 0.04 H HETATM 1764 H16 GY A 8 134.837 105.040 285.344 1.00 0.06 H HETATM 1765 H19 GY A 8 131.899 104.580 285.208 1.00 0.18 H HETATM 1766 O2 GY A 8 133.678 106.292 287.130 1.00 -0.39 O HETATM 1767 H15 GY A 8 127.421 103.708 287.299 1.00 0.08 H HETATM 1768 H7 GY A 8 129.039 102.096 288.770 1.00 0.03 H HETATM 1769 H8 GY A 8 127.811 101.384 287.669 1.00 0.03 H HETATM 1770 H9 GY A 8 129.928 100.380 286.958 1.00 0.03 H HETATM 1771 H10 GY A 8 130.782 101.957 287.055 1.00 0.03 H HETATM 1772 H11 GY A 8 128.621 101.064 285.077 1.00 0.05 H HETATM 1773 H12 GY A 8 130.162 101.925 284.745 1.00 0.05 H HETATM 1774 O1 GY A 8 128.402 103.627 283.493 1.00 -0.38 O HETATM 1775 CL1 GY A 8 125.379 103.902 285.710 1.00 -0.06 CL CONECT 1 2 6 7 8 CONECT 6 1 CONECT 7 1 CONECT 8 1 CONECT 424 422 423 1707 CONECT 612 610 1708 CONECT 857 856 1708 CONECT 858 856 1707 CONECT 985 984 1707 CONECT 991 990 1707 CONECT 1158 1159 1163 1164 1165 CONECT 1163 1158 CONECT 1164 1158 CONECT 1165 1158 CONECT 1707 424 858 985 991 CONECT 1708 612 857 CONECT 1720 1721 1725 1775 CONECT 1721 1720 1722 1729 CONECT 1722 1721 1723 1728 CONECT 1723 1722 1724 1727 CONECT 1724 1723 1725 CONECT 1725 1720 1724 1726 CONECT 1726 1725 CONECT 1727 1723 CONECT 1728 1722 CONECT 1729 1721 1730 1774 CONECT 1730 1729 1731 1734 CONECT 1731 1730 1732 1772 1773 CONECT 1732 1731 1733 1770 1771 CONECT 1733 1732 1734 1768 1769 CONECT 1734 1730 1733 1735 1767 CONECT 1735 1734 1736 1740 CONECT 1736 1735 1737 CONECT 1737 1736 1738 1745 CONECT 1738 1737 1739 1743 CONECT 1739 1738 1740 1742 CONECT 1740 1735 1739 1741 CONECT 1741 1740 CONECT 1742 1739 CONECT 1743 1738 1744 CONECT 1744 1743 CONECT 1745 1737 1746 1766 CONECT 1746 1745 1747 1765 CONECT 1747 1746 1748 1759 1764 CONECT 1748 1747 1749 1762 1763 CONECT 1749 1748 1750 1754 CONECT 1750 1749 1751 1759 CONECT 1751 1750 1752 1758 CONECT 1752 1751 1753 1757 CONECT 1753 1752 1754 1756 CONECT 1754 1749 1753 1755 CONECT 1755 1754 CONECT 1756 1753 CONECT 1757 1752 CONECT 1758 1751 CONECT 1759 1747 1750 1760 1761 CONECT 1760 1759 CONECT 1761 1759 CONECT 1762 1748 CONECT 1763 1748 CONECT 1764 1747 CONECT 1765 1746 CONECT 1766 1745 CONECT 1767 1734 CONECT 1768 1733 CONECT 1769 1733 CONECT 1770 1732 CONECT 1771 1732 CONECT 1772 1731 CONECT 1773 1731 CONECT 1774 1729 CONECT 1775 1720 MASTER 0 0 0 0 0 0 0 0 1773 2 72 15 END
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Related entries of code: 5w7u
Entries with 90% protein sequence similarity cutoff in PDBbind
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204aa, >4AVG_1|Chains... at 97%
4awf
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PDBbind
204aa, >4AWF_1|Chains... at 97%
4awg
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204aa, >4AWG_1|Chains... at 97%
4awm
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192aa, >4AWM_1|Chain... at 96%
4e5f
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PDBbind
187aa, >4E5F_1|Chains... at 91%
4e5g
RCSB PDB
PDBbind
187aa, >4E5G_1|Chains... at 91%
4e5h
RCSB PDB
PDBbind
187aa, >4E5H_1|Chains... at 91%
4e5i
RCSB PDB
PDBbind
187aa, >4E5I_1|Chains... at 91%
4e5j
RCSB PDB
PDBbind
187aa, >4E5J_1|Chains... at 91%
4kil
RCSB PDB
PDBbind
213aa, >4KIL_1|Chain... at 98%
4ln7
RCSB PDB
PDBbind
209aa, >4LN7_1|Chain... at 100%
4m4q
RCSB PDB
PDBbind
241aa, >4M4Q_1|Chain... *
4m5o
RCSB PDB
PDBbind
241aa, >4M5O_1|Chain... at 100%
4m5r
RCSB PDB
PDBbind
241aa, >4M5R_1|Chain... at 100%
4m5u
RCSB PDB
PDBbind
241aa, >4M5U_1|Chain... at 100%
4mk1
RCSB PDB
PDBbind
241aa, >4MK1_1|Chain... at 100%
4mk2
RCSB PDB
PDBbind
241aa, >4MK2_1|Chain... at 100%
4mk5
RCSB PDB
PDBbind
241aa, >4MK5_1|Chain... at 100%
4w9s
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PDBbind
241aa, >4W9S_1|Chain... at 100%
5cgv
RCSB PDB
PDBbind
187aa, >5CGV_1|Chain... at 94%
5ega
RCSB PDB
PDBbind
187aa, >5EGA_1|Chain... at 94%
5w44
RCSB PDB
PDBbind
178aa, >5W44_1|Chain... at 98%
5w73
RCSB PDB
PDBbind
197aa, >5W73_1|Chain... at 93%
5w92
RCSB PDB
PDBbind
197aa, >5W92_1|Chain... at 93%
5w9g
RCSB PDB
PDBbind
197aa, >5W9G_1|Chain... at 93%
5wa7
RCSB PDB
PDBbind
197aa, >5WA7_1|Chain... at 93%
5wap
RCSB PDB
PDBbind
197aa, >5WAP_1|Chain... at 93%
5wb3
RCSB PDB
PDBbind
197aa, >5WB3_1|Chain... at 93%
5wdc
RCSB PDB
PDBbind
197aa, >5WDC_1|Chain... at 93%
5wdw
RCSB PDB
PDBbind
197aa, >5WDW_1|Chain... at 93%
5we9
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PDBbind
187aa, >5WE9_1|Chain... at 94%
5web
RCSB PDB
PDBbind
197aa, >5WEB_1|Chain... at 93%
5wef
RCSB PDB
PDBbind
187aa, >5WEF_1|Chain... at 93%
5wei
RCSB PDB
PDBbind
197aa, >5WEI_1|Chain... at 92%
5wf3
RCSB PDB
PDBbind
197aa, >5WF3_1|Chain... at 92%
5wfm
RCSB PDB
PDBbind
197aa, >5WFM_1|Chain... at 92%
5wfw
RCSB PDB
PDBbind
197aa, >5WFW_1|Chain... at 92%
5wfz
RCSB PDB
PDBbind
197aa, >5WFZ_1|Chain... at 92%
5wg9
RCSB PDB
PDBbind
197aa, >5WG9_1|Chain... at 92%
6dcy
RCSB PDB
PDBbind
192aa, >6DCY_1|Chain... at 96%
6dcz
RCSB PDB
PDBbind
192aa, >6DCZ_1|Chain... at 96%
6dzq
RCSB PDB
PDBbind
192aa, >6DZQ_1|Chain... at 96%
6e0q
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PDBbind
192aa, >6E0Q_1|Chain... at 96%
6nem
RCSB PDB
PDBbind
241aa, >6NEM_1|Chain... at 100%
6nel
RCSB PDB
PDBbind
241aa, >6NEL_1|Chain... at 100%
6e6w
RCSB PDB
PDBbind
192aa, >6E6W_1|Chain... at 96%
6e6v
RCSB PDB
PDBbind
192aa, >6E6V_1|Chain... at 96%
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PDBbind
192aa, >6E4C_1|Chain... at 96%
6e3p
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PDBbind
192aa, >6E3P_1|Chain... at 96%
6e3n
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192aa, >6E3N_1|Chain... at 96%
6e3o
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192aa, >6E3O_1|Chain... at 96%
6e3m
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Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
5w7u
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Polymerase acidic protein
Ligand Name
GY8
EC.Number
E.C.-.-.-.-
Resolution
2.2(Å)
Affinity (Kd/Ki/IC50)
Ki=0.009uM
Release Year
2017
Protein/NA Sequence
Check fasta file
Primary Reference
(2017) Sci Rep Vol. 7: pp. 17139-17139
Ligand Properties
Formula
C
2
4
H
2
1
Cl
2
N
5
O
4
Molecular Weight
514.361
Exact Mass
513.097
No. of atoms
56
No. of bonds
60
Polar Surface Area
128.28
LOGP Value
3.12 (
Computed with XLOGP3
)
3.38 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 3
No. of Hydrogen Bond Acceptors: 5
No. of Rotatable Bonds: 7
No. of Nitrogen and Oxygen Atoms: 9
No. of Rings: 5
Canonical SMILES
O=C(c1nc([nH]c(=O)c1O)[C@@H]1CCCN1C(=O)c1c(Cl)cncc1Cl)NC1Cc2c(C1)cccc2
InChI String
InChI=1S/C24H21Cl2N5O4/c25-15-10-27-11-16(26)18(15)24(35)31-7-3-6-17(31)21-29-19(20(32)23(34)30-21)22(33)28-14-8-12-4-1-2-5-13(12)9-14/h1-2,4-5,10-11,14,17,32H,3,6-9H2,(H,28,33)(H,29,30,34)/t17-/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
C3W5S0
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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