NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 T 4.2892 8.1593 117.3740 63.5625 69.9796 173.0807 2 S 4.5578 8.1072 119.5990 55.4242 65.6981 173.2845 3 K 3.7805 9.5174 122.8439 59.9503 32.7707 179.7494 4 K 3.8597 7.4897 118.5923 59.6978 31.7886 179.1619 5 K 4.0177 7.7342 118.1233 58.9532 32.1722 178.0816 6 R 4.3293 7.5369 115.8337 56.6785 30.4614 177.9688 7 Q 4.1099 7.9246 118.8588 57.2550 28.4161 176.2650 8 R 3.8951 7.4676 119.2365 58.2774 30.1571 176.5976 9 G 4.0269 9.1765 111.5943 45.2636 0.0000 173.5022 10 S 4.3796 7.7800 112.9868 57.3094 63.7420 174.3121 11 R 4.1020 7.9011 124.9722 57.6633 29.2967 176.4974 12 T 4.3401 7.6178 104.6249 61.0778 69.4926 174.1797 13 H 4.2529 8.3826 117.3590 56.0325 26.8969 175.1248 14 G 3.8788 8.3588 102.3886 46.6409 0.0000 174.9464 15 G 3.8933 8.3722 106.5491 44.3515 0.0000 176.7314 16 G 3.7479 7.6874 107.2111 44.8210 0.0000 172.8662 17 S 3.9549 8.6419 113.9731 58.8458 62.4624 175.8531 18 H 4.2775 9.0312 122.8419 57.4615 28.1532 175.6493 19 K 4.1687 7.7546 119.0119 56.8178 31.8178 177.2540 20 N 4.4154 8.1107 117.3953 55.6347 39.4800 177.1014 21 R 4.4225 7.4758 118.0755 56.2531 28.9803 176.8871 22 R 4.6066 7.1806 122.9252 56.0824 30.3443 180.1120 23 G 4.0683 8.4316 121.0500 45.7559 0.0000 173.4069 24 A 4.2891 8.6415 120.6718 54.2079 18.3478 179.9987 25 G 3.5944 8.0097 104.4507 47.7126 0.0000 174.8603 26 H 4.5328 8.0968 118.1685 57.6325 29.9810 176.1708 27 R 4.5311 7.6455 117.0116 55.3409 31.1427 175.6591 28 G 3.8344 8.3625 106.8415 46.8712 0.0000 173.3233 29 G 4.1478 7.6048 104.8302 43.1924 0.0000 174.4964 30 R 4.1839 8.6650 120.5056 56.4819 31.8841 175.9917 31 G 3.8111 8.1694 113.2373 47.5320 0.0000 173.6748 32 D 4.8239 8.5008 120.9734 53.6548 41.1622 175.7959 33 A 4.0789 7.5063 121.9494 53.8099 18.9612 179.0894 34 G 3.8374 8.9678 109.2653 45.6905 0.0000 175.3086 35 R 4.0171 7.7452 116.5363 57.6522 29.2521 177.2715 36 D 5.1370 7.9408 115.9834 52.7844 42.0295 175.5058 37 K 4.4115 8.9130 117.8754 57.2026 32.3915 177.4548 38 H 4.5639 9.8021 125.4598 58.3109 28.5255 176.2402 39 E 4.6793 7.6470 120.4503 55.6279 30.3047 178.0074 40 F 4.9910 8.2678 115.7390 59.3078 38.2502 175.4206 41 H 3.4373 5.7765 114.3840 57.5299 29.3380 174.7762 42 N 4.2308 8.8057 119.8348 54.2368 35.5880 173.6985 43 H 4.8586 7.5967 112.4504 53.7609 33.5609 174.0914 44 E 4.0940 8.7659 123.1718 55.7714 29.9136 175.4296 45 P 4.4631 0.0000 0.0000 62.2354 32.1371 176.3101 46 L 4.0225 8.3122 120.1771 55.4304 42.0970 175.9650 47 G 4.2708 7.9757 105.7995 43.4176 0.0000 173.0211 48 K 4.6135 8.0920 119.2586 54.5852 34.2398 176.5127 49 S 4.3769 8.1569 115.9798 57.6161 65.1880 175.1509 50 G 4.0224 8.9155 118.3920 45.3254 0.0000 171.3764 51 F 5.0421 8.2819 112.9710 55.3020 41.2018 173.4186 52 K 4.3619 8.4806 119.1312 54.4603 34.9881 176.2665 53 R 4.5203 8.2375 121.9466 53.9576 31.3026 174.6138 54 P 4.1804 0.0000 0.0000 63.5321 31.5908 175.6482 55 Q 4.1423 9.1373 122.4369 59.1495 28.7052 180.6337 56 K 4.5668 7.7894 114.9024 57.0180 32.4090 177.4791 57 V 4.4276 8.1602 115.5989 63.6260 33.6696 174.0831 58 Q 4.6748 7.9811 117.0462 54.7163 30.6186 174.5250 59 E 4.6015 8.5422 120.9454 54.5310 31.8379 174.8268 60 E 4.5381 8.4527 122.8989 54.3471 32.0673 174.0813 61 A 4.1286 8.2883 128.8798 50.2371 20.5613 176.0627 62 A 4.2272 8.5877 126.0627 51.7342 19.4044 176.3553 63 T 5.2732 8.3114 112.5845 59.7492 71.5490 173.9608 64 I 4.6125 7.8830 122.4783 59.8155 41.8716 173.2133 65 D 5.1421 8.6406 128.2833 53.4806 42.3680 177.7338 66 V 3.5733 8.5899 116.3876 64.9162 31.6689 178.8901 67 R 3.7948 7.7658 117.8755 60.3555 29.5075 177.0543 68 E 4.0703 8.4186 118.7849 57.9173 30.0157 178.5647 69 I 3.6377 7.4097 118.4193 64.6325 37.4547 177.2758 70 D 4.2700 8.4877 118.6625 57.6616 40.9518 178.4548 71 E 4.1260 7.9513 117.0563 58.3362 29.6642 177.2411 72 N 5.0627 7.8495 115.9574 52.7812 40.0151 177.0244 73 V 3.3947 7.5316 114.8325 64.7039 31.7535 178.3367 74 T 3.9674 7.7090 108.4975 64.7588 68.7934 175.7540 75 L 3.9806 7.8904 121.2884 56.3990 42.2646 178.0728 76 L 4.4043 7.1017 120.2518 53.3422 40.3036 176.5398 77 A 4.1195 7.6576 123.9051 54.9820 19.1798 178.9477 78 A 4.5943 7.8086 117.7091 52.7015 18.3390 176.4226 79 D 4.9494 7.9434 118.0624 53.6063 45.3168 175.5372 80 D 4.4373 8.6062 120.3722 55.0866 40.9440 177.1934 81 V 4.1881 8.3914 123.4499 62.5426 31.7196 175.0556 82 A 3.7123 8.4576 119.8878 53.4886 18.8221 178.7533 83 E 3.3148 8.3913 115.3405 57.7612 31.8700 176.0697 *89 F 4.5533 7.3644 120.1761 56.9170 41.0611 173.9618 90 R 5.4161 8.7828 121.3393 54.6438 32.0333 175.4265 91 V 4.4821 8.9059 125.7751 60.0973 35.3135 174.4865 92 D 4.8677 8.8294 124.0923 52.8474 40.2864 176.3500 93 V 3.5696 8.6412 127.9294 66.1871 31.6997 178.4940 94 R 3.9563 7.6260 116.9625 59.6356 29.9074 177.2870 95 D 4.5601 8.1914 114.8563 55.3560 41.3881 177.2398 96 V 3.8992 8.7228 119.3931 64.2962 32.3541 175.7622 97 V 3.5311 7.6692 121.3117 62.9649 31.1783 175.0627 98 E 3.9642 8.5470 126.8041 57.4705 29.8837 176.6191 99 E 3.8693 8.7974 118.2049 57.4460 27.5886 175.9277 100 A 4.0834 7.8902 124.3660 55.3325 18.7494 180.2228 101 D 4.3807 8.3273 114.2247 56.8630 38.9634 177.9096 102 D 4.4128 8.0364 115.9098 53.2845 39.5583 175.6277 103 A 4.4065 7.8534 123.9557 51.0545 20.3102 176.7701 104 D 4.5454 8.5247 117.8685 54.6672 41.5438 175.1118 105 Y 5.2369 6.7947 116.8252 56.4368 38.7321 169.9534 106 V 4.6324 8.8225 122.6716 61.4832 33.5346 174.4561 107 K 4.9550 9.1206 129.1489 54.5899 35.5732 174.5483 108 V 4.5575 8.4903 127.3398 61.4770 33.4353 174.5161 109 L 4.8699 9.1052 127.5880 52.4268 44.6744 176.8007 110 G 4.3430 8.2377 109.8159 45.0709 0.0000 173.3970 111 A 4.6484 7.9158 122.7820 51.7342 21.4639 177.5090 112 G 3.9633 8.8424 110.5345 44.5420 0.0000 172.1566 113 Q 4.4141 8.1419 118.0361 54.3967 30.7503 175.2978 114 V 4.1965 7.9152 117.3669 61.8913 32.9372 174.5184 115 R 4.4963 8.8604 125.7165 56.2315 30.0973 175.6601 116 H 5.2744 7.6344 113.3816 54.0737 33.6248 172.8143 117 E 4.5983 8.8376 118.1094 55.4396 30.0893 175.8865 118 L 5.1413 8.6574 124.2031 53.2342 45.6892 175.8819 119 T 4.9950 9.6369 120.5376 61.8623 69.5596 171.9426 120 L 5.0480 8.6709 125.8021 53.5139 44.0886 175.4759 121 I 5.5735 8.9072 123.6189 58.7997 40.2444 174.6209 122 A 4.7597 8.6980 127.0854 50.8650 22.5308 176.1807 123 D 4.5190 8.7765 117.8663 57.2663 42.0963 176.2491 124 D 4.7632 7.6860 115.5657 53.5348 45.0368 174.5582 125 F 5.2137 8.7508 121.1312 54.9713 43.1448 175.5123 126 S 4.6257 8.3499 118.1590 57.3879 65.9313 174.8927 127 E 4.0188 8.6152 120.8452 59.6676 29.6795 178.8782 128 G 3.7438 8.1678 104.6308 47.1348 0.0000 175.2387 129 A 4.1185 7.6807 122.9931 55.2348 18.6273 179.4740 130 R 3.7655 7.7992 116.5825 60.2312 30.1472 178.3834 131 E 3.7826 8.5496 116.7660 59.7198 28.9789 179.6848 132 K 3.9691 8.3562 117.2921 60.0362 32.6660 179.3713 133 V 3.4882 7.7223 117.7954 66.0071 31.5979 177.8643 134 E 4.6244 7.8007 119.3709 58.0245 29.1311 178.7949 135 G 3.8592 8.1162 104.2882 45.7741 0.0000 174.0036 136 A 4.5429 7.3081 123.5210 51.4628 19.8172 176.6964 137 G 3.8398 7.8378 103.9784 48.1317 0.0000 172.4185 138 G 4.4709 8.0547 105.3263 44.2799 0.0000 171.7653 139 S 4.8177 8.9732 113.0360 56.3178 66.7224 173.7470 140 V 4.0242 8.1994 120.9115 61.2779 33.4202 174.2790 141 E 4.4499 8.9293 129.2855 54.7320 31.0243 175.4173 142 L 4.8334 8.4497 127.7293 54.6517 42.9980 176.6400 143 T 4.0632 9.0871 123.7307 63.9130 69.6494 175.0587 144 D 4.3521 8.9021 122.5523 57.6140 41.0992 179.0660 145 L 3.9398 8.0589 119.3847 57.9775 42.3319 178.0147 146 G 3.8966 8.0901 106.2919 46.6526 0.0000 173.8012 147 E 4.4812 7.8691 119.1399 56.9463 29.1416 177.5656 148 E 4.2027 7.9398 119.1319 57.0507 30.1290 176.9282 149 R 3.8900 7.6610 117.8810 58.5161 29.8912 176.2715 150 Q 4.3446 8.8263 123.3753 55.5740 29.6003 172.7875 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 1 T 8.16 4.29 4.24 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 2 S 8.11 4.56 0.00 4.06 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 K 9.52 3.78 0.00 1.84 1.86 0.00 1.74 0.00 0.00 1.82 0.00 0.00 2.94 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.51 1.55 7.81 4 K 7.49 3.86 0.00 1.89 1.87 0.00 1.73 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.49 1.48 7.81 5 K 7.73 4.02 0.00 1.69 2.02 0.00 1.68 0.00 0.00 1.70 0.00 0.00 3.14 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.52 7.81 6 R 7.54 4.33 0.00 1.82 1.93 0.00 3.21 0.00 0.00 3.21 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.65 0.00 7 Q 7.92 4.11 0.00 2.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.80 6.97 0.00 0.00 0.00 0.00 0.00 2.57 2.52 0.00 8 R 7.47 3.90 0.00 1.79 1.90 0.00 3.35 0.00 0.00 3.26 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.59 0.00 9 G 9.18 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 S 7.78 4.38 0.00 3.98 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 R 7.90 4.10 0.00 1.97 2.07 0.00 3.21 0.00 0.00 3.27 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.61 0.00 12 T 7.62 4.34 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 13 H 8.38 4.25 0.00 3.28 3.38 0.00 5.73 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 G 8.36 3.88 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 0.00 0.00 0.00 0.00 0.00 0.00 15 G 8.37 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.69 3.75 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 0.00 0.00 0.00 17 S 8.64 3.95 0.00 3.87 3.80 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 18 H 9.03 4.28 0.00 3.31 3.40 0.00 5.57 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 K 7.75 4.17 0.00 1.77 1.82 0.00 1.70 0.00 0.00 1.69 0.00 0.00 2.99 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.37 1.39 7.81 20 N 8.11 4.42 0.00 2.65 2.61 0.00 0.00 6.93 7.52 0.00 0.00 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 R 7.48 4.42 0.00 1.78 1.91 0.00 3.20 0.00 0.00 3.24 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.65 0.00 22 R 7.18 4.61 0.00 1.76 1.02 0.00 3.24 0.00 0.00 3.19 7.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.54 0.00 23 G 8.43 4.07 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 A 8.64 4.29 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 25 G 8.01 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.10 4.53 0.00 3.11 3.50 0.00 5.91 0.00 0.00 0.00 0.00 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 R 7.65 4.53 0.00 2.05 1.90 0.00 3.36 0.00 0.00 3.22 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.65 0.00 28 G 8.36 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 G 7.60 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 R 8.66 4.18 0.00 1.91 1.81 0.00 3.39 0.00 0.00 3.35 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.69 0.00 31 G 8.17 3.81 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 0.00 0.00 0.00 0.00 0.00 0.00 32 D 8.50 4.82 0.00 2.74 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 33 A 7.51 4.08 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 34 G 8.97 3.84 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 0.00 0.00 0.00 35 R 7.75 4.02 0.00 1.86 2.21 0.00 2.77 0.00 0.00 3.22 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.64 0.00 36 D 7.94 5.14 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 37 K 8.91 4.41 0.00 1.75 1.54 0.00 1.76 0.00 0.00 1.78 0.00 0.00 2.99 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.38 1.52 7.81 38 H 9.80 4.56 0.00 3.31 3.46 0.00 5.46 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 E 7.65 4.68 0.00 1.86 1.85 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 2.23 2.03 0.00 40 F 8.27 4.99 0.00 3.04 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 41 H 5.78 3.44 0.00 2.89 3.10 0.00 5.81 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 N 8.81 4.23 0.00 2.83 2.82 0.00 0.00 6.82 8.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 H 7.60 4.86 0.00 3.36 3.20 0.00 5.91 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 E 8.77 4.09 0.00 1.97 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 2.31 2.25 0.00 45 P 0.00 4.46 0.00 2.18 2.07 0.00 3.80 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 0.00 46 L 8.31 4.02 0.00 1.66 1.66 0.92 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 47 G 7.98 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 K 8.09 4.61 0.00 1.75 1.74 0.00 1.73 0.00 0.00 1.65 0.00 0.00 3.01 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.36 1.40 7.81 49 S 8.16 4.38 0.00 3.77 3.69 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 50 G 8.92 4.02 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 0.00 0.00 0.00 0.00 0.00 0.00 51 F 8.28 5.04 0.00 3.11 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 K 8.48 4.36 0.00 1.72 1.67 0.00 1.72 0.00 0.00 1.68 0.00 0.00 2.75 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.23 1.35 7.81 53 R 8.24 4.52 0.00 1.79 1.90 0.00 3.38 0.00 0.00 3.31 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.61 0.00 54 P 0.00 4.18 0.00 2.19 2.13 0.00 3.88 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.06 0.00 55 Q 9.14 4.14 0.00 2.13 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.79 7.31 0.00 0.00 0.00 0.00 0.00 2.45 2.39 0.00 56 K 7.79 4.57 0.00 1.87 1.90 0.00 1.53 0.00 0.00 1.64 0.00 0.00 3.00 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.41 1.43 7.81 57 V 8.16 4.43 2.23 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 0.84 0.00 0.00 0.98 0.00 0.00 58 Q 7.98 4.67 0.00 2.11 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.76 6.51 0.00 0.00 0.00 0.00 0.00 2.27 2.66 0.00 59 E 8.54 4.60 0.00 1.98 1.87 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 2.44 2.30 0.00 60 E 8.45 4.54 0.00 1.94 1.68 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 2.14 2.19 0.00 61 A 8.29 4.13 0.91 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 0.00 0.00 0.00 0.00 0.00 62 A 8.59 4.23 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 T 8.31 5.27 4.21 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 1.20 0.00 0.00 64 I 7.88 4.61 1.83 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.15 0.91 0.00 0.00 65 D 8.64 5.14 0.00 2.63 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 66 V 8.59 3.57 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 1.05 0.00 0.00 67 R 7.77 3.79 0.00 1.99 1.97 0.00 3.08 0.00 0.00 3.08 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.67 0.00 68 E 8.42 4.07 0.00 1.98 1.96 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 2.30 2.32 0.00 69 I 7.41 3.64 1.97 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.91 0.91 0.00 0.00 70 D 8.49 4.27 0.00 2.74 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 71 E 7.95 4.13 0.00 2.21 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 2.32 2.50 0.00 72 N 7.85 5.06 0.00 2.69 2.70 0.00 0.00 6.83 6.96 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 73 V 7.53 3.39 0.79 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 0.46 0.00 0.00 0.62 0.00 0.00 74 T 7.71 3.97 4.24 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 75 L 7.89 3.98 0.00 1.63 1.78 1.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 76 L 7.10 4.40 0.00 1.81 1.84 0.89 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 77 A 7.66 4.12 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 78 A 7.81 4.59 1.28 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 0.00 0.00 0.00 79 D 7.94 4.95 0.00 2.84 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 D 8.61 4.44 0.00 3.15 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 V 8.39 4.19 2.07 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 0.67 0.00 0.00 1.05 0.00 0.00 82 A 8.46 3.71 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 E 8.39 3.31 0.00 2.12 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.45 0.00 *89 F 7.36 4.55 0.00 3.04 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 R 8.78 5.42 0.00 1.84 1.84 0.00 3.23 0.00 0.00 3.43 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.57 0.00 91 V 8.91 4.48 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.95 0.00 0.00 92 D 8.83 4.87 0.00 2.73 2.81 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 0.00 0.00 0.00 93 V 8.64 3.57 2.04 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 0.85 0.00 0.00 0.96 0.00 0.00 94 R 7.63 3.96 0.00 2.03 2.03 0.00 3.23 0.00 0.00 3.25 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.67 0.00 95 D 8.19 4.56 0.00 2.77 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 V 8.72 3.90 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.93 0.00 0.00 97 V 7.67 3.53 2.05 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 0.90 0.00 0.00 0.95 0.00 0.00 98 E 8.55 3.96 0.00 1.98 1.85 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 2.30 2.32 0.00 99 E 8.80 3.87 0.00 2.08 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 2.19 2.26 0.00 100 A 7.89 4.08 1.36 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 0.00 101 D 8.33 4.38 0.00 2.78 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 0.00 102 D 8.04 4.41 0.00 2.78 2.81 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 0.00 0.00 0.00 103 A 7.85 4.41 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 D 8.52 4.55 0.00 2.57 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 Y 6.79 5.24 0.00 3.47 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 V 8.82 4.63 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.92 0.00 0.00 107 K 9.12 4.96 0.00 2.05 1.64 0.00 1.92 0.00 0.00 1.65 0.00 0.00 2.80 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.31 1.46 7.81 108 V 8.49 4.56 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 0.99 0.00 0.00 0.68 0.00 0.00 109 L 9.11 4.87 0.00 1.78 1.52 0.91 0.76 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 0.00 110 G 8.24 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 A 7.92 4.65 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 G 8.84 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 0.00 0.00 0.00 113 Q 8.14 4.41 0.00 2.03 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.06 6.80 0.00 0.00 0.00 0.00 0.00 2.28 2.32 0.00 114 V 7.92 4.20 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 0.95 0.00 0.00 115 R 8.86 4.50 0.00 1.72 1.88 0.00 3.14 0.00 0.00 3.21 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.52 0.00 116 H 7.63 5.27 0.00 3.20 3.45 0.00 5.65 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 E 8.84 4.60 0.00 2.12 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.19 0.00 118 L 8.66 5.14 0.00 1.66 1.66 0.95 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 119 T 9.64 4.99 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 120 L 8.67 5.05 0.00 1.90 1.87 1.07 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 121 I 8.91 5.57 1.95 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 1.18 1.74 1.03 0.00 0.00 122 A 8.70 4.76 0.79 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 0.00 0.00 123 D 8.78 4.52 0.00 2.81 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 D 7.69 4.76 0.00 2.60 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 F 8.75 5.21 0.00 2.95 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 S 8.35 4.63 0.00 4.11 4.07 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 0.00 0.00 0.00 0.00 127 E 8.62 4.02 0.00 2.08 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.38 0.00 128 G 8.17 3.74 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 0.00 0.00 0.00 129 A 7.68 4.12 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 R 7.80 3.77 0.00 2.00 1.94 0.00 3.34 0.00 0.00 3.15 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.63 0.00 131 E 8.55 3.78 0.00 2.03 1.93 0.00 0.00 0.00 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 2.55 0.00 132 K 8.36 3.97 0.00 1.99 1.91 0.00 1.68 0.00 0.00 1.68 0.00 0.00 2.91 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.48 1.60 7.81 133 V 7.72 3.49 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 0.00 0.00 1.08 0.00 0.00 134 E 7.80 4.62 0.00 2.06 1.96 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 2.44 2.32 0.00 135 G 8.12 3.86 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 0.00 0.00 0.00 136 A 7.31 4.54 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 G 7.84 3.84 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 0.00 0.00 0.00 138 G 8.05 4.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.97 4.82 0.00 3.81 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 V 8.20 4.02 1.68 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 -0.93 0.00 0.00 0.56 0.00 0.00 141 E 8.93 4.45 0.00 1.98 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 2.25 2.22 0.00 142 L 8.45 4.83 0.00 1.65 1.60 1.24 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 143 T 9.09 4.06 4.35 0.00 0.00 0.00 0.00 0.00 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 0.00 144 D 8.90 4.35 0.00 2.71 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 0.00 145 L 8.06 3.94 0.00 1.61 1.91 1.09 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 146 G 8.09 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 E 7.87 4.48 0.00 2.01 1.97 0.00 0.00 0.00 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 2.37 0.00 148 E 7.94 4.20 0.00 1.87 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.37 0.00 149 R 7.66 3.89 0.00 1.79 1.90 0.00 3.38 0.00 0.00 3.14 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.56 0.00 150 Q 8.83 4.34 0.00 2.10 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.65 0.00 0.00 0.00 0.00 0.00 2.13 2.09 0.00 * Residues marked with a * may have inaccurate shift predictions.