NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 A 4.4993 8.1233 122.4845 51.8742 20.5320 175.2175 5 K 4.9458 8.7087 121.9400 54.6773 35.3947 173.6696 6 I 4.9708 8.9241 125.5681 59.5246 40.4979 175.0755 7 G 4.3638 9.4383 114.8593 45.7928 0.0000 172.8228 8 I 5.2431 8.9929 122.4283 59.5923 41.6473 174.3891 9 V 4.7470 8.8429 127.4338 61.3804 34.3038 174.2397 10 T 4.8482 8.8571 125.8611 62.4583 70.5721 174.0254 11 V 4.7195 8.4485 126.9869 61.7794 34.0340 174.3640 12 S 4.4722 9.3786 119.9368 57.0468 66.4568 176.7142 13 D 4.4051 8.6063 128.3897 57.9948 40.5966 179.5900 14 R 3.6876 7.8574 117.2865 59.1386 29.7015 178.9015 15 A 4.1186 8.3706 120.7363 54.8610 18.1096 179.4709 16 S 4.1827 8.0588 110.9570 60.9041 62.6276 175.7213 17 A 4.1292 7.9645 122.6756 52.8851 17.9987 178.1468 18 G 3.8190 7.4443 103.5460 46.3086 0.0000 175.2684 19 I 3.8726 6.7624 120.4956 63.3734 37.6868 175.9310 20 Y 4.6603 7.1102 120.6717 57.6638 38.9123 175.9012 21 E 4.2008 8.6350 122.6526 56.6745 30.6242 178.0093 22 D 4.7372 8.4155 122.5076 53.0674 38.9625 176.8643 23 I 3.7670 7.7115 118.1115 63.3586 38.0994 178.6225 24 S 4.1546 8.1400 116.8090 61.6329 62.9922 176.6889 25 G 3.7565 8.6718 108.3183 47.2767 0.0000 175.4560 26 K 3.7362 7.9781 121.6745 59.6293 32.1389 178.5820 27 A 3.9532 7.9425 120.7482 55.1230 18.1689 179.6077 28 I 3.5392 7.6075 117.7175 64.6951 37.2699 178.6424 29 I 3.8491 7.6128 120.2513 64.6656 36.9584 178.3483 30 D 4.3488 8.1923 119.6324 57.4632 40.6315 178.8973 31 T 3.4461 7.8931 116.3217 66.6317 68.4823 176.6971 32 L 3.3944 7.6271 120.7265 57.4780 41.2150 179.3155 33 N 4.6403 8.0998 116.4668 56.9097 39.0390 176.3855 34 D 4.5272 7.8790 119.1626 57.4283 41.0250 178.3594 35 Y 4.3776 7.9181 117.2344 59.8562 38.0024 175.4838 36 L 4.8529 7.3851 119.0335 53.9626 42.7308 176.9702 37 T 4.3481 8.4818 113.9129 63.0667 69.7691 175.6329 38 S 4.4339 7.9182 115.4600 57.5255 63.7272 173.2383 39 E 4.2383 8.5918 122.3784 56.1906 29.9282 175.5751 40 W 5.5772 8.1683 121.0882 55.4907 31.9532 173.2848 41 E 4.4037 9.3798 121.3926 53.4537 31.9511 172.8501 42 P 5.0737 0.0000 0.0000 62.9986 32.3438 175.7896 43 I 4.3927 8.7825 126.6034 59.9706 38.5157 173.9414 44 Y 5.3952 8.5681 128.3242 55.9729 41.1920 174.5333 45 Q 4.1449 8.2713 125.4263 54.5582 33.2103 172.9541 46 V 4.8069 7.9326 125.3163 61.0501 33.5784 174.5988 47 I 4.8521 8.9385 120.7416 58.1752 41.2890 172.9484 48 P 4.5783 0.0000 0.0000 62.2807 31.9684 176.7868 49 D 4.6886 8.3252 121.0246 54.3173 38.6963 176.8867 50 E 4.5981 7.5821 118.9027 53.6982 33.1251 175.9896 51 Q 3.9473 8.6854 125.2300 59.4645 29.2736 177.8370 52 D 4.3542 8.1124 119.2618 57.4554 40.8360 178.9322 53 V 3.5582 7.7191 117.9818 65.9782 31.5856 177.7315 54 I 3.6676 7.7797 119.4468 64.6246 37.0051 178.1389 55 E 3.9591 8.4522 119.4489 59.7903 29.2909 179.5928 56 T 3.8384 8.3323 116.0408 67.0321 68.3169 176.5858 57 T 3.9610 7.8890 113.6766 64.6670 67.4078 176.2269 58 L 4.1250 7.8349 120.4574 57.7863 41.9656 178.9742 59 I 3.8870 7.6594 119.6702 64.3489 37.1406 178.5607 60 K 3.7586 7.7566 116.4753 57.7134 31.8279 177.6904 *62 A 4.2597 7.8105 121.0097 52.1504 20.3906 178.6117 63 D 4.5129 8.5839 114.4706 57.0872 41.1298 177.7616 64 E 4.3608 7.9359 115.9588 57.1213 30.1429 176.9419 65 Q 4.4846 7.9531 114.5284 54.6653 30.1813 174.6573 66 D 4.3654 8.0907 116.5141 55.3918 38.3420 174.1750 67 C 4.5463 7.9925 115.9334 59.7573 28.9649 174.3340 68 C 4.4053 9.0681 121.1086 60.4295 30.7708 173.4187 69 L 5.2132 7.8421 120.7686 53.2700 45.5905 174.8908 70 I 5.0684 8.8993 126.1823 59.5922 40.7385 174.6653 71 V 4.9815 8.7647 120.2391 59.7442 34.5125 175.0889 72 T 5.1632 8.7658 114.9585 60.3676 72.1311 173.1126 73 T 4.9679 8.6338 116.5613 61.8508 70.8165 174.4751 74 G 4.0174 7.8856 113.4197 48.1119 0.0000 173.2186 75 G 4.1562 9.0984 105.5135 47.0090 0.0000 174.8488 76 T 4.4492 7.8551 107.6599 60.9211 69.8020 174.5441 77 G 4.0217 7.8606 111.9395 43.9295 0.0000 171.7612 78 P 4.4375 0.0000 0.0000 63.2470 32.0292 176.4559 79 A 4.1655 7.6756 123.0302 51.8036 19.1455 178.0986 80 K 3.8392 8.8762 122.7218 59.6709 32.1094 178.3820 81 R 4.0266 7.8280 111.8133 57.5158 29.7797 176.0359 82 D 4.5505 7.9036 119.4116 54.5489 40.1690 175.8964 83 V 4.9681 7.9857 115.3978 59.4492 33.8644 178.0885 84 T 3.8910 8.3152 120.3092 66.3769 68.0800 174.8417 85 P 4.4108 0.0000 0.0000 65.4681 31.3166 178.3765 86 E 4.0826 8.2337 116.8307 59.4499 29.2747 179.1928 87 A 3.9788 8.0809 120.6101 55.4273 18.5027 179.7206 88 T 3.7963 8.1247 114.4701 66.8932 68.3101 176.6401 89 E 3.9484 8.1792 119.0462 59.4330 29.5722 179.0249 90 A 4.1223 7.8705 119.6651 54.7653 18.5577 179.3000 91 V 3.9540 7.4289 108.2443 61.3766 32.5157 176.2522 92 C 4.6104 7.2456 116.4833 58.7381 29.1256 173.3962 93 D 4.5876 8.2928 121.8777 54.5089 40.0453 175.9824 94 R 4.5356 7.3281 115.1018 54.1611 32.4246 173.2440 *97 P 4.6370 0.0000 0.0000 62.6801 33.2507 178.9234 98 G 3.6446 8.1243 105.4098 47.3952 0.0000 175.7063 99 F 4.0907 8.4560 119.1591 60.5703 39.2264 177.4201 100 G 3.8410 8.2086 103.4082 47.7533 0.0000 174.9938 101 E 4.2070 7.9128 120.5427 59.0331 29.5070 180.5626 102 L 4.0414 7.6798 119.2391 55.4822 42.3382 178.8040 *104 R 4.2247 8.0716 117.8768 55.7469 32.1269 177.9796 105 A 4.0681 7.9602 118.7260 55.0132 18.6739 179.2950 106 E 4.1465 8.5187 117.4354 59.8351 29.6270 179.8099 107 S 4.4300 8.1532 114.6226 61.4224 62.7453 176.3171 108 L 4.6741 7.8816 121.9804 56.5283 41.3721 179.0910 109 K 4.0094 7.8424 117.3455 58.1014 31.8692 177.9314 110 F 4.6196 7.9865 116.5491 57.6341 40.8932 176.5248 111 V 4.5758 7.1538 110.6563 58.1475 35.7594 174.0268 112 P 4.4533 0.0000 0.0000 65.2806 31.2101 177.8263 113 T 4.2426 7.7819 108.1947 62.2814 69.2511 175.8295 114 A 4.0390 8.0507 125.0558 55.3635 18.1603 179.1620 115 I 3.9081 7.2328 108.1567 62.7518 37.9105 176.8474 116 L 4.2491 7.9956 121.3316 55.8317 42.0522 176.4132 117 S 4.5594 7.7277 113.9053 57.9803 62.8740 173.6635 118 R 4.5587 8.8523 126.1424 55.8265 30.0927 176.3467 119 Q 4.1467 7.5620 116.3247 57.6209 29.1591 175.8687 120 T 4.8083 8.9146 114.7773 61.3383 71.6227 171.5911 121 A 4.9843 8.2811 122.0805 50.9499 22.4658 175.4735 122 G 3.9720 8.5741 105.9201 45.8914 0.0000 171.7437 123 L 5.1991 8.9398 120.0808 52.7745 44.1915 176.3150 124 R 4.7303 8.8653 124.4074 55.0714 32.1079 176.3025 125 G 4.1879 8.1281 116.9864 47.2245 0.0000 172.8503 126 D 4.7201 8.8901 122.9360 52.9143 39.5171 175.3693 127 S 4.8926 8.3016 117.4584 57.3018 65.0129 172.9413 128 L 4.5590 8.4983 127.4259 54.4482 43.4157 175.1486 129 I 4.8631 8.8758 127.5792 59.5062 39.8848 174.7378 130 V 4.5674 8.6372 126.6202 61.0574 34.4118 173.9825 131 N 5.5562 8.7721 125.5723 51.9924 39.5149 174.5895 132 L 5.1622 8.6379 122.3082 52.1198 46.0573 174.7239 133 P 4.6285 0.0000 0.0000 61.8482 32.6991 176.7087 134 G 3.6992 8.5155 106.8663 48.2392 0.0000 175.3325 135 K 4.1024 7.8835 120.5670 55.0632 33.3880 175.6890 136 P 4.1715 0.0000 0.0000 65.7887 31.3448 178.4692 137 K 3.8272 7.9345 117.4244 59.6432 32.1514 178.7729 138 S 3.9342 7.8610 114.7841 61.4954 62.7114 176.1857 139 I 3.6329 8.0700 122.9113 64.7370 36.8474 178.3010 140 R 3.8423 7.9752 118.9419 59.5388 29.8632 178.4449 141 E 3.9599 8.1441 118.3649 59.4961 28.8711 179.1736 142 C 4.1940 8.6724 117.0988 62.8416 28.1668 176.1284 143 L 4.2287 8.3347 120.9512 58.0040 40.9902 179.2813 144 D 4.4733 8.3483 117.8411 57.4418 40.8369 178.4488 145 A 4.1389 7.8656 119.9809 54.3650 18.7792 178.8548 146 V 4.0620 7.5099 114.3658 63.6461 33.1236 177.5858 147 F 4.0723 8.6634 121.1133 60.7728 39.2041 175.0911 148 P 4.2991 0.0000 0.0000 65.0114 31.4562 176.9177 149 A 4.6418 7.6359 117.4866 51.9775 19.7416 178.5831 150 I 3.6545 7.6899 119.6810 63.6014 37.1813 176.3992 151 P 4.0169 0.0000 0.0000 65.7931 31.2010 177.9125 152 Y 4.1276 7.9115 117.6680 60.8084 38.3905 177.5518 153 C 3.9627 7.6129 118.4282 62.4579 31.8817 175.4089 154 I 3.7939 7.6617 121.2991 64.5177 36.4863 177.9772 155 D 4.4102 7.8567 118.4893 57.2743 40.6909 179.7850 156 L 4.0179 7.2193 117.8367 54.4948 41.7003 177.2951 *158 E 4.2117 8.1932 115.9272 56.2125 31.0011 176.5198 159 G 4.0488 7.9166 109.9513 43.6276 0.0000 172.4452 160 P 4.3398 0.0000 0.0000 62.8302 31.6618 176.7654 161 Y 4.2818 8.4016 123.5218 56.6883 37.1427 173.6495 162 L 4.1680 7.8886 124.9183 54.2699 42.6668 176.4314 163 E 4.8772 8.7621 122.5694 54.7530 32.6570 174.7061 164 C 5.3980 8.4599 119.4925 57.5868 32.2165 173.6091 165 N 4.4203 9.0657 120.9305 53.8913 38.2448 175.2369 166 E 4.2627 9.1381 127.2954 58.2037 30.0804 177.9180 167 A 4.1293 8.0167 120.2807 54.0538 18.7867 177.9027 168 V 4.1273 7.6553 113.9844 63.8733 32.7375 175.3662 169 I 4.3825 7.8644 118.8762 58.8675 40.5336 174.3034 170 K 4.6291 8.3581 126.9495 53.9244 31.8633 173.8987 171 P 4.5710 0.0000 0.0000 62.4290 32.0332 175.7896 172 F 4.5124 9.0764 127.9522 57.1175 40.2652 175.2554 173 R 3.6351 7.7637 125.5198 53.0971 31.7890 174.2826 174 P 3.9015 0.0000 0.0000 62.7626 31.3006 176.6135 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 4 A 8.12 4.50 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 K 8.71 4.95 0.00 1.99 1.78 0.00 1.66 0.00 0.00 1.95 0.00 0.00 3.13 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.49 1.60 7.81 6 I 8.92 4.97 2.13 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.01 0.98 0.00 0.00 7 G 9.44 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 I 8.99 5.24 2.15 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.01 1.13 0.00 0.00 9 V 8.84 4.75 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.93 0.00 0.00 10 T 8.86 4.85 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 11 V 8.45 4.72 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.93 0.00 0.00 12 S 9.38 4.47 0.00 3.92 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 D 8.61 4.41 0.00 2.68 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 R 7.86 3.69 0.00 1.63 0.99 0.00 2.99 0.00 0.00 2.98 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.50 0.00 15 A 8.37 4.12 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 S 8.06 4.18 0.00 4.05 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 A 7.96 4.13 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 G 7.44 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 I 6.76 3.87 1.76 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.48 0.48 0.00 0.00 20 Y 7.11 4.66 0.00 3.00 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 E 8.63 4.20 0.00 2.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.34 0.00 22 D 8.42 4.74 0.00 2.91 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 I 7.71 3.77 1.84 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.47 0.88 0.00 0.00 24 S 8.14 4.15 0.00 3.93 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 G 8.67 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 K 7.98 3.74 0.00 1.92 1.92 0.00 1.61 0.00 0.00 1.62 0.00 0.00 2.91 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.39 1.41 7.81 27 A 7.94 3.95 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 I 7.61 3.54 1.89 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.76 0.91 0.00 0.00 29 I 7.61 3.85 1.82 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.86 0.94 0.00 0.00 30 D 8.19 4.35 0.00 2.73 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 T 7.89 3.45 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.27 0.00 0.00 32 L 7.63 3.39 0.00 1.54 0.67 0.64 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 33 N 8.10 4.64 0.00 3.08 2.97 0.00 0.00 7.24 8.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 D 7.88 4.53 0.00 2.75 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 Y 7.92 4.38 0.00 2.77 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 L 7.39 4.85 0.00 1.60 1.60 0.05 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 37 T 8.48 4.35 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 38 S 7.92 4.43 0.00 4.12 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 E 8.59 4.24 0.00 2.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.40 0.00 40 W 8.17 5.58 0.00 3.60 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 E 9.38 4.40 0.00 2.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.13 0.00 42 P 0.00 5.07 0.00 2.12 2.16 0.00 3.38 0.00 0.00 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.44 0.00 43 I 8.78 4.39 1.94 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.10 0.98 0.00 0.00 44 Y 8.57 5.40 0.00 2.91 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 Q 8.27 4.14 0.00 2.04 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.54 0.00 0.00 0.00 0.00 0.00 2.15 2.17 0.00 46 V 7.93 4.81 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.85 0.00 0.00 47 I 8.94 4.85 1.84 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.75 0.85 0.00 0.00 48 P 0.00 4.58 0.00 2.08 2.08 0.00 3.74 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.98 0.00 49 D 8.33 4.69 0.00 2.85 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 E 7.58 4.60 0.00 1.91 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.25 0.00 51 Q 8.69 3.95 0.00 2.11 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.87 0.00 0.00 0.00 0.00 0.00 2.53 2.45 0.00 52 D 8.11 4.35 0.00 2.72 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 V 7.72 3.56 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 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0.00 2.76 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 E 7.94 4.36 0.00 2.10 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.26 0.00 65 Q 7.95 4.48 0.00 2.02 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.84 0.00 0.00 0.00 0.00 0.00 2.26 2.52 0.00 66 D 8.09 4.37 0.00 2.82 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 C 7.99 4.55 0.00 2.99 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 C 9.07 4.41 0.00 3.00 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 L 7.84 5.21 0.00 1.74 1.51 0.99 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 70 I 8.90 5.07 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.62 0.93 0.00 0.00 71 V 8.76 4.98 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 133 P 0.00 4.63 0.00 2.17 2.08 0.00 3.77 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.95 0.00 134 G 8.52 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 K 7.88 4.10 0.00 1.77 1.70 0.00 1.68 0.00 0.00 1.79 0.00 0.00 2.89 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.48 1.48 7.81 136 P 0.00 4.17 0.00 2.10 2.09 0.00 3.55 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.30 0.00 137 K 7.93 3.83 0.00 1.74 1.70 0.00 1.68 0.00 0.00 1.71 0.00 0.00 2.79 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.23 1.40 7.81 138 S 7.86 3.93 0.00 3.96 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 I 8.07 3.63 2.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.87 0.87 0.00 0.00 140 R 7.98 3.84 0.00 1.87 1.86 0.00 3.56 0.00 0.00 3.12 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.71 0.00 141 E 8.14 3.96 0.00 1.94 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.65 0.00 142 C 8.67 4.19 0.00 2.94 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 L 8.33 4.23 0.00 1.80 1.94 0.80 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 144 D 8.35 4.47 0.00 2.89 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 145 A 7.87 4.14 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 V 7.51 4.06 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.90 0.00 0.00 147 F 8.66 4.07 0.00 3.41 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 P 0.00 4.30 0.00 2.16 2.25 0.00 3.61 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.10 0.00 149 A 7.64 4.64 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 I 7.69 3.65 1.22 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.85 0.69 0.00 0.00 151 P 0.00 4.02 0.00 1.95 1.86 0.00 3.28 0.00 0.00 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.69 0.00 152 Y 7.91 4.13 0.00 3.07 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 C 7.61 3.96 0.00 3.17 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 I 7.66 3.79 1.92 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.55 0.91 0.00 0.00 155 D 7.86 4.41 0.00 2.68 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 L 7.22 4.02 0.00 1.56 1.52 0.61 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 *158 E 8.19 4.21 0.00 1.98 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.29 0.00 159 G 7.92 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 160 P 0.00 4.34 0.00 2.11 2.07 0.00 3.70 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.12 0.00 161 Y 8.40 4.28 0.00 3.01 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 162 L 7.89 4.17 0.00 1.51 1.56 0.95 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 163 E 8.76 4.88 0.00 2.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.64 0.00 164 C 8.46 5.40 0.00 2.83 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 N 9.07 4.42 0.00 2.85 2.92 0.00 0.00 6.93 8.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 E 9.14 4.26 0.00 1.99 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.28 0.00 167 A 8.02 4.13 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 V 7.66 4.13 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 1.02 0.00 0.00 169 I 7.86 4.38 1.10 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 1.05 0.51 0.00 0.00 170 K 8.36 4.63 0.00 1.76 1.78 0.00 1.84 0.00 0.00 1.73 0.00 0.00 2.90 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.36 1.38 7.81 171 P 0.00 4.57 0.00 1.87 1.89 0.00 3.66 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.08 0.00 172 F 9.08 4.51 0.00 2.89 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 R 7.76 3.64 0.00 1.48 1.65 0.00 3.26 0.00 0.00 3.32 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.50 0.00 174 P 0.00 3.90 0.00 1.72 1.86 0.00 2.20 0.00 0.00 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.92 0.00 * Residues marked with a * may have inaccurate shift predictions.