NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -1 N 4.5849 8.4201 119.2058 53.2575 40.2546 174.2006 0 A 4.2787 8.0828 123.3677 49.9197 20.6143 174.7482 2 N 4.8467 9.2469 115.7851 52.2357 41.4803 174.6096 3 I 3.7462 8.2397 129.6962 64.3940 37.3955 178.0499 4 Q 3.4172 7.9519 119.7344 58.9955 28.9180 178.1290 5 A 3.9620 8.5937 122.1348 54.7976 18.4241 179.2631 6 L 3.8527 7.9850 118.9058 58.4964 42.1484 179.3367 7 L 3.9522 7.9294 118.8498 57.6345 41.4334 179.6140 8 S 4.0670 7.9860 115.1878 61.7085 62.8769 176.2027 9 E 3.9036 8.2228 121.7547 59.3437 29.2903 179.1449 10 K 3.9431 8.0885 118.2714 59.5363 32.0866 179.5692 11 V 3.5955 8.1046 118.9231 65.8364 31.3831 177.9026 12 S 4.0553 8.6674 113.2589 61.6832 62.2737 176.3247 13 Q 3.9751 8.2072 120.3858 58.7696 28.3082 178.5909 14 A 3.9846 8.0602 122.0069 55.0998 18.3645 179.7308 15 L 3.9688 8.2782 117.9171 57.8646 41.6667 179.7757 16 I 3.9739 8.1697 121.0358 63.8266 36.8394 178.3439 17 A 3.9832 7.9785 120.0746 54.0812 18.1754 178.4204 18 A 4.4747 7.1100 117.3168 51.9076 19.2401 177.8267 19 G 3.9477 7.9450 105.9323 45.3807 0.0000 174.7739 20 A 4.1354 8.4324 124.1477 50.9710 19.2453 175.6932 21 P 4.3082 0.0000 0.0000 62.3855 31.9890 177.5464 22 A 4.0350 8.5237 122.4630 54.7040 18.4476 178.1294 23 D 4.8216 7.8784 114.0487 53.0608 39.7416 176.4534 24 C 4.2098 7.8404 114.4481 58.8435 29.8715 172.8934 25 E 4.5870 8.3864 120.2402 54.0912 30.6928 175.5537 26 P 4.1711 0.0000 0.0000 63.6035 32.3595 176.4804 27 Q 3.2587 8.0601 116.7428 56.7660 26.1527 173.7622 28 V 4.4442 7.5455 116.2186 63.1188 32.5993 175.9629 29 R 4.9237 9.2617 125.8907 54.0481 35.1450 174.1162 30 Q 3.7278 8.9177 121.4106 56.8102 29.2260 176.9996 31 S 4.4721 8.3520 122.1275 58.8398 63.0463 174.9373 32 A 4.1519 9.2780 125.9911 54.6420 18.7079 177.8950 33 K 4.4789 7.6770 115.9002 55.3485 36.4362 177.9912 34 V 3.6166 8.2405 117.7555 64.0438 31.6711 179.6211 35 Q 4.1649 7.8162 117.5620 58.6000 28.5852 177.1162 36 F 4.9851 7.7747 115.2197 57.1300 39.4026 177.3800 37 G 2.7576 7.5831 108.3779 44.5767 0.0000 173.1331 38 D 4.5317 8.3044 116.7425 55.7480 42.8200 176.6469 39 Y 5.2118 7.7377 113.8312 56.1755 42.5691 174.6287 40 Q 5.7672 9.4257 119.9639 53.2489 33.2887 174.2783 41 A 4.7637 8.6311 124.4832 51.2671 20.1804 177.1520 42 N 4.9235 9.0771 119.6168 53.1860 39.9319 176.0037 43 G 3.9488 8.0919 107.5065 44.7586 0.0000 176.4697 44 V 3.5443 7.4866 117.5137 63.3909 31.0379 177.2635 *46 A 4.2454 8.1164 122.9612 51.7344 20.5396 180.1334 47 V 3.5414 7.7508 114.3952 66.1147 31.3472 178.1362 48 A 3.9823 8.2405 119.6533 54.8183 18.4408 179.1856 49 K 3.9805 7.9404 117.6471 59.8166 32.1601 179.0141 50 K 3.9969 7.5742 117.1642 59.0546 32.0334 178.3694 51 L 4.5710 7.8003 116.5219 53.0099 42.6420 176.6160 52 G 3.6401 7.5936 106.6205 45.6655 0.0000 172.0719 *54 A 4.0781 7.8581 124.9108 51.0161 20.5333 175.0625 55 P 4.1606 0.0000 0.0000 65.7540 31.3991 178.7547 56 R 3.8075 7.9244 117.9936 59.3299 30.0246 177.8879 57 Q 3.9373 8.0906 118.7110 59.2954 28.9393 178.0900 58 L 3.9361 7.9950 120.9705 58.0200 42.0913 178.7655 59 A 3.9969 8.2046 120.8888 55.1184 18.3075 179.3801 60 E 3.9117 8.3366 117.1096 59.6754 29.5545 179.5928 61 Q 3.9498 8.0370 117.9286 59.0269 28.8509 178.9113 62 V 3.6057 8.1472 119.5967 66.1101 31.2403 177.7279 63 L 3.9702 7.8664 118.9409 58.2804 42.0349 178.9126 64 S 4.2600 7.8693 112.8258 61.4532 63.1052 175.7631 65 H 4.3864 8.0153 119.1488 56.9467 28.8242 175.6884 66 L 4.0284 7.3839 123.0818 54.6157 42.3893 175.5416 67 D 4.7680 8.5955 124.7806 52.8766 42.4546 174.5179 68 L 4.6771 8.2028 125.6107 54.1450 42.7690 176.1372 69 N 4.2772 7.9496 116.4314 55.4283 38.6977 175.5636 70 G 4.0029 9.1529 111.3661 45.2476 0.0000 173.0125 71 I 3.3108 7.4553 116.8211 61.8212 39.4412 174.6788 72 A 5.1510 7.7792 122.3677 50.3231 20.8657 176.2886 73 N 4.7379 8.8715 121.2979 56.1531 39.7619 175.1082 74 K 4.7380 7.8657 115.5661 55.7375 36.1145 175.0218 75 V 5.1200 8.3102 120.2541 61.5473 34.5858 174.1788 76 E 4.9549 9.6196 125.8555 54.8689 34.3369 174.2143 77 I 5.0631 8.4277 121.1651 59.8431 39.6265 175.0968 78 A 4.6590 8.6163 126.5149 50.1075 22.5736 177.2218 79 G 3.7838 8.9491 108.2260 46.4510 0.0000 174.3032 80 P 4.3815 0.0000 0.0000 63.5149 31.6404 176.9670 81 G 4.4384 7.1283 120.6583 46.1046 0.0000 172.6797 82 F 4.3379 7.5707 119.4914 57.4737 40.4166 174.2792 83 I 4.8875 8.4781 122.9183 59.8388 39.5100 174.3441 84 N 4.9697 9.4749 126.2198 51.8979 40.3700 174.3740 85 I 4.6756 8.6502 126.0817 59.6671 39.8033 174.9124 86 F 4.9866 9.2997 127.6324 55.9370 40.1663 175.9266 87 L 4.7866 9.4545 125.1155 54.2295 42.8010 176.7001 88 D 4.5112 9.3822 123.1159 53.9992 41.7350 175.7371 89 P 4.4030 0.0000 0.0000 65.3845 31.4709 178.6747 90 A 4.0290 8.2382 119.5993 54.8875 18.2675 179.2265 91 F 4.1820 7.9270 119.0329 61.3982 39.4885 177.4461 92 L 3.6597 8.1325 118.2986 57.7047 41.4928 179.2581 93 A 3.9562 8.0635 120.7551 55.2023 18.1934 179.2457 94 D 4.1691 8.0554 116.4577 57.3384 40.8369 177.7424 95 N 4.0337 7.9768 117.9704 56.6470 38.8231 176.7126 96 V 3.5496 7.5844 119.3693 66.2420 31.7116 177.6084 97 N 4.2879 8.0659 115.9662 56.5031 38.1547 177.5279 98 R 3.9042 8.0434 118.3159 59.3183 30.2425 178.7824 99 A 4.1145 7.8083 119.3549 54.3060 18.5902 178.7363 100 L 4.3637 7.7140 116.2518 55.3648 42.2478 178.3961 101 Q 4.0020 7.9064 122.7533 60.2563 28.7305 179.5700 102 S 4.2319 8.1154 116.9462 62.7186 62.3245 176.9584 103 E 4.5886 8.0640 117.7995 57.0904 29.8960 176.3296 104 R 4.0939 7.5752 122.4627 56.7522 30.2703 176.0482 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 N 8.42 4.58 0.00 2.68 2.80 0.00 0.00 6.99 7.08 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 A 8.08 4.28 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 2 N 9.25 4.85 0.00 2.75 2.69 0.00 0.00 6.95 7.90 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 3 I 8.24 3.75 1.90 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.50 0.80 0.00 0.00 4 Q 7.95 3.42 0.00 2.13 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.92 0.00 0.00 0.00 0.00 0.00 2.42 2.42 0.00 5 A 8.59 3.96 1.34 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 6 L 7.98 3.85 0.00 1.77 1.80 0.90 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 7 L 7.93 3.95 0.00 1.51 1.60 0.65 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 8 S 7.99 4.07 0.00 3.97 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 9 E 8.22 3.90 0.00 2.06 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 0.00 2.30 2.39 0.00 10 K 8.09 3.94 0.00 1.93 1.81 0.00 1.71 0.00 0.00 1.55 0.00 0.00 2.86 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.53 1.53 7.81 11 V 8.10 3.60 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 1.08 0.00 0.00 0.95 0.00 0.00 12 S 8.67 4.06 0.00 3.86 4.08 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 0.00 0.00 0.00 0.00 13 Q 8.21 3.98 0.00 2.10 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.45 2.50 0.00 14 A 8.06 3.98 1.43 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 0.00 0.00 0.00 0.00 0.00 15 L 8.28 3.97 0.00 1.83 1.70 0.94 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 16 I 8.17 3.97 1.97 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 1.38 1.52 0.88 0.00 0.00 17 A 7.98 3.98 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 A 7.11 4.47 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 19 G 7.94 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 A 8.43 4.14 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 21 P 0.00 4.31 0.00 2.41 2.18 0.00 3.69 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.95 0.00 22 A 8.52 4.04 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.88 4.82 0.00 2.78 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 24 C 7.84 4.21 0.00 3.10 3.05 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 25 E 8.39 4.59 0.00 1.98 1.89 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 2.28 2.23 0.00 26 P 0.00 4.17 0.00 2.17 2.09 0.00 3.74 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.09 0.00 27 Q 8.06 3.26 0.00 2.19 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.86 7.11 0.00 0.00 0.00 0.00 0.00 2.56 2.27 0.00 28 V 7.55 4.44 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 0.80 0.00 0.00 0.96 0.00 0.00 29 R 9.26 4.92 0.00 1.79 1.78 0.00 3.24 0.00 0.00 3.13 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.62 0.00 30 Q 8.92 3.73 0.00 1.87 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.63 6.95 0.00 0.00 0.00 0.00 0.00 2.21 2.15 0.00 31 S 8.35 4.47 0.00 3.73 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 32 A 9.28 4.15 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 33 K 7.68 4.48 0.00 0.94 1.43 0.00 1.42 0.00 0.00 0.91 0.00 0.00 2.79 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.20 1.12 7.81 34 V 8.24 3.62 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 0.78 0.00 0.00 0.93 0.00 0.00 35 Q 7.82 4.16 0.00 1.44 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 7.38 0.00 0.00 0.00 0.00 0.00 2.27 2.38 0.00 36 F 7.77 4.99 0.00 3.01 2.93 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 0.00 0.00 0.00 37 G 7.58 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 0.00 0.00 0.00 38 D 8.30 4.53 0.00 2.83 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 39 Y 7.74 5.21 0.00 2.86 2.83 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 40 Q 9.43 5.77 0.00 2.01 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.88 0.00 0.00 0.00 0.00 0.00 2.41 2.11 0.00 41 A 8.63 4.76 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 42 N 9.08 4.92 0.00 2.78 2.94 0.00 0.00 6.97 7.17 0.00 0.00 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 G 8.09 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 V 7.49 3.54 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 0.80 0.00 0.00 0.88 0.00 0.00 *46 A 8.12 4.25 1.30 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 0.00 0.00 47 V 7.75 3.54 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.97 0.00 0.00 48 A 8.24 3.98 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 K 7.94 3.98 0.00 1.80 1.96 0.00 1.71 0.00 0.00 1.80 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.49 1.52 7.81 50 K 7.57 4.00 0.00 1.87 1.85 0.00 1.73 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.47 7.81 51 L 7.80 4.57 0.00 1.61 1.69 0.90 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 52 G 7.59 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *54 A 7.86 4.08 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 P 0.00 4.16 0.00 2.37 2.25 0.00 3.68 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.96 0.00 56 R 7.92 3.81 0.00 1.93 1.96 0.00 3.24 0.00 0.00 3.27 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.87 0.00 57 Q 8.09 3.94 0.00 2.15 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.68 0.00 0.00 0.00 0.00 0.00 2.42 2.42 0.00 58 L 8.00 3.94 0.00 1.80 1.78 0.91 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 59 A 8.20 4.00 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 60 E 8.34 3.91 0.00 2.19 2.01 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 2.33 2.46 0.00 61 Q 8.04 3.95 0.00 2.31 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.75 0.00 0.00 0.00 0.00 0.00 2.39 2.50 0.00 62 V 8.15 3.61 2.22 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 1.00 0.00 0.00 0.95 0.00 0.00 63 L 7.87 3.97 0.00 1.89 1.92 0.95 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 64 S 7.87 4.26 0.00 4.04 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 H 8.02 4.39 0.00 3.33 3.38 0.00 5.65 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 L 7.38 4.03 0.00 1.85 1.58 0.93 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 67 D 8.60 4.77 0.00 2.62 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 68 L 8.20 4.68 0.00 1.67 1.52 0.91 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 69 N 7.95 4.28 0.00 2.83 2.78 0.00 0.00 7.06 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 G 9.15 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.46 3.31 1.71 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 0.66 0.64 0.38 0.00 0.00 72 A 7.78 5.15 1.27 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 73 N 8.87 4.74 0.00 2.80 2.92 0.00 0.00 6.98 5.97 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 74 K 7.87 4.74 0.00 1.79 1.79 0.00 1.30 0.00 0.00 1.46 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.18 1.24 7.81 75 V 8.31 5.12 2.14 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 0.91 0.00 0.00 0.99 0.00 0.00 76 E 9.62 4.95 0.00 2.13 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 2.25 2.33 0.00 77 I 8.43 5.06 1.90 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.60 0.97 0.00 0.00 78 A 8.62 4.66 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 G 8.95 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 P 0.00 4.38 0.00 2.09 2.16 0.00 4.14 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.93 0.00 81 G 7.13 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 F 7.57 4.34 0.00 2.97 2.89 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 83 I 8.48 4.89 1.91 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 1.25 0.88 0.95 0.00 0.00 84 N 9.47 4.97 0.00 2.78 2.80 0.00 0.00 6.41 7.20 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 85 I 8.65 4.68 2.04 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.75 0.97 0.00 0.00 86 F 9.30 4.99 0.00 3.06 3.07 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 87 L 9.45 4.79 0.00 1.75 1.85 1.23 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 88 D 9.38 4.51 0.00 2.83 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 P 0.00 4.40 0.00 2.24 2.13 0.00 3.71 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.21 0.00 90 A 8.24 4.03 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 91 F 7.93 4.18 0.00 3.16 3.36 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 92 L 8.13 3.66 0.00 1.93 1.68 1.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 93 A 8.06 3.96 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 94 D 8.06 4.17 0.00 2.86 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 95 N 7.98 4.03 0.00 2.23 2.58 0.00 0.00 6.88 7.41 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 96 V 7.58 3.55 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 0.95 0.00 0.00 0.92 0.00 0.00 97 N 8.07 4.29 0.00 2.90 2.84 0.00 0.00 7.10 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 R 8.04 3.90 0.00 1.88 2.04 0.00 3.13 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.75 0.00 99 A 7.81 4.11 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 0.00 100 L 7.71 4.36 0.00 1.76 1.70 0.91 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 101 Q 7.91 4.00 0.00 2.35 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.82 6.77 0.00 0.00 0.00 0.00 0.00 2.36 2.39 0.00 102 S 8.12 4.23 0.00 3.75 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 E 8.06 4.59 0.00 2.00 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 2.27 2.47 0.00 104 R 7.58 4.09 0.00 1.77 1.89 0.00 3.35 0.00 0.00 3.35 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.76 0.00 * Residues marked with a * may have inaccurate shift predictions.