NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 E 4.2810 8.4444 120.2259 56.5692 31.6981 176.1101 7 T 3.9126 7.7390 111.5629 61.1669 68.2036 171.2768 8 E 4.1490 8.6162 121.5944 59.0364 31.0255 180.3540 9 S 4.5183 7.9017 111.0747 58.7536 62.7043 175.8943 *11 K 4.1541 8.2278 123.2168 57.6162 33.7027 177.7591 12 T 3.8430 8.0787 115.5399 66.6498 68.3805 176.6488 13 V 3.5544 8.2612 120.4688 65.9985 31.5334 178.0311 14 R 3.8837 7.9161 117.8378 59.4578 29.9345 178.3552 15 I 3.6523 8.0783 119.9337 64.4641 37.1361 178.5034 16 R 3.8887 8.2006 119.0928 59.4766 30.0218 179.0207 17 E 4.0228 8.1217 117.9023 59.2329 29.3886 179.5881 18 K 4.0263 8.0425 118.5250 59.4803 32.0798 179.4073 19 I 3.7732 7.9524 120.1480 64.4352 36.8269 178.6277 20 K 3.9939 7.8942 117.8846 59.4124 32.2501 179.2540 21 K 4.1517 8.0417 118.4476 59.4628 31.7765 179.1473 22 F 4.2089 8.2272 119.8104 61.1126 39.1799 176.3689 23 L 4.1091 8.2457 116.5768 54.8145 41.3628 178.7321 24 G 3.7023 7.4578 106.4722 48.1367 0.0000 174.7903 25 D 4.5252 7.9117 119.8803 56.4754 41.1153 176.3981 26 R 3.6043 6.5441 111.3787 54.1462 32.2256 172.3123 27 P 4.2645 0.0000 0.0000 62.9288 31.9392 176.0888 28 R 4.8758 8.6792 120.2715 54.5306 35.1327 174.4350 29 N 5.8521 9.1636 118.8626 51.7271 39.2622 176.3560 30 T 4.0076 8.9039 115.8139 66.7628 68.4040 176.7019 31 A 3.9931 8.1005 122.1500 55.2793 18.5551 179.3225 32 E 3.9646 8.7891 117.2699 59.6202 29.4515 179.7613 33 I 3.5699 8.0211 119.7965 64.1762 37.1121 178.1925 34 L 3.8442 8.1876 121.5403 58.1581 42.0604 178.6158 35 E 3.8298 8.2837 119.3301 59.3519 29.3037 178.2371 36 H 3.8187 7.7414 117.1571 59.1565 30.1572 176.8363 37 I 3.6662 7.6302 121.7514 64.6833 36.8328 178.2624 38 N 4.4521 8.0827 115.3687 55.4118 38.4352 176.9351 39 S 4.3564 7.5483 114.2771 59.4097 64.2686 173.9464 40 T 4.4835 7.4055 112.3654 60.9380 68.6604 174.3223 *42 R 4.2610 8.0001 122.4468 57.0947 32.1149 175.1440 43 H 4.6663 8.0980 111.7841 55.1568 31.3463 176.0503 44 G 3.7469 8.2695 106.8274 45.8723 0.0000 170.5265 45 T 4.5474 8.9608 115.9687 60.3063 70.8057 173.7389 46 T 4.6936 7.5343 112.4109 59.5841 72.6261 175.1353 47 S 4.0855 8.4010 116.4656 61.4348 62.8930 176.4032 48 Q 3.9423 7.9700 122.6810 59.2437 29.0015 178.0049 49 Q 3.9890 8.0723 119.0947 58.8407 28.6853 178.5849 50 L 3.9748 8.3134 121.8461 57.9833 42.1289 179.1389 51 G 3.6981 8.1496 105.6857 47.9308 0.0000 175.3686 52 N 4.3569 7.9619 118.6078 56.0120 38.5828 177.6290 53 V 3.5110 7.7591 119.5330 66.0281 31.3832 178.0793 54 L 3.6133 7.7329 117.7587 57.7266 41.3018 179.4226 55 S 4.4637 7.7429 114.0768 61.5491 62.8802 176.4006 56 K 4.2885 8.1395 121.5072 57.8153 32.3114 176.2735 57 D 4.5468 7.8623 119.9846 53.2816 40.8927 176.8131 58 K 4.3106 8.6090 126.4752 58.4686 32.4913 177.7869 59 D 4.5924 8.9891 119.0599 55.2645 41.1670 175.4851 60 I 5.0084 7.6938 119.8759 59.6795 39.5626 175.3089 61 V 4.7026 9.0457 121.3234 59.3098 34.5902 175.1895 62 K 4.0062 8.7058 125.7151 56.1241 32.1802 176.6698 63 V 4.0604 8.1001 120.4563 61.0233 33.1936 175.4927 64 G 4.0777 7.3177 106.0197 46.7929 0.0000 171.6799 65 Y 5.3536 8.3473 119.8393 56.2999 42.1179 173.7820 66 I 4.4116 8.4307 126.0901 59.2026 41.0184 174.0459 67 K 4.5612 8.3103 127.6379 54.3383 34.3130 174.8743 68 R 4.4960 8.4614 127.5626 54.4994 32.8564 174.2468 69 S 5.1232 7.6311 118.7254 56.2960 65.9258 172.9035 70 G 4.2525 8.2549 110.1985 45.3382 0.0000 174.4468 71 I 3.9000 8.7007 115.2800 62.7501 38.0726 176.7573 72 L 4.4067 7.8596 121.4157 56.8436 42.9322 177.2783 73 S 4.2023 8.3282 113.0240 59.7362 63.4763 176.0036 74 G 3.9117 8.0356 108.6538 45.4454 0.0000 171.7387 75 G 4.5023 8.3733 105.4498 44.8273 0.0000 172.0898 76 Y 5.0411 8.2128 119.4161 56.1122 41.7248 172.9107 77 D 5.3270 8.8278 119.1088 52.5879 44.7239 175.5400 78 I 4.6900 8.6838 121.4363 59.8732 40.9378 174.3518 79 C 5.2099 8.8918 123.5827 57.9415 31.7624 172.4362 80 E 5.1350 8.6626 121.2721 54.4413 32.0877 175.2382 81 W 5.3607 9.2382 122.7259 55.0519 33.6898 174.1494 82 A 4.9621 8.8926 123.1373 50.2315 22.8396 175.9863 83 T 4.5367 8.3961 108.9916 61.2155 70.0201 175.7923 84 R 4.0615 9.1105 123.9020 59.9654 30.0695 178.8790 85 N 4.4119 8.2776 115.8199 55.8498 38.5151 176.9796 86 W 4.0645 8.4879 129.9198 60.5423 30.8475 178.1902 87 V 3.6084 8.2291 117.9797 66.0176 30.7391 177.7305 88 A 4.1569 8.2155 119.7450 55.3162 18.2582 179.1311 89 E 3.9660 8.0102 116.1360 59.1085 29.7203 178.2701 90 H 4.3642 7.7661 114.3194 55.5773 30.8731 175.2659 91 C 4.8090 8.1580 118.5881 57.4595 28.1265 172.3672 92 P 4.8626 0.0000 0.0000 63.2024 31.4854 177.5824 93 E 4.4795 8.0253 116.8677 56.1812 30.2696 175.6996 94 W 4.6628 8.1227 129.9145 56.8322 31.7254 175.3472 95 T 4.1298 6.6102 112.2902 60.0702 71.2106 173.5765 96 E 3.8563 7.5202 121.2474 56.6493 30.5764 175.3874 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 6 E 8.44 4.28 0.00 1.97 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 2.21 2.30 0.00 7 T 7.74 3.91 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 8 E 8.62 4.15 0.00 1.93 1.95 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 2.31 1.87 0.00 9 S 7.90 4.52 0.00 3.99 4.11 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 *11 K 8.23 4.15 0.00 1.83 2.02 0.00 1.72 0.00 0.00 1.81 0.00 0.00 2.87 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.39 1.46 7.81 12 T 8.08 3.84 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 1.19 0.00 0.00 13 V 8.26 3.55 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 0.99 0.00 0.00 1.00 0.00 0.00 14 R 7.92 3.88 0.00 1.91 2.07 0.00 3.22 0.00 0.00 3.33 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.71 0.00 15 I 8.08 3.65 1.99 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.59 0.85 0.00 0.00 16 R 8.20 3.89 0.00 1.99 1.98 0.00 3.12 0.00 0.00 3.24 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.83 0.00 17 E 8.12 4.02 0.00 2.28 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 2.22 0.00 18 K 8.04 4.03 0.00 1.99 1.87 0.00 1.62 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.64 7.81 19 I 7.95 3.77 1.97 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.69 0.89 0.00 0.00 20 K 7.89 3.99 0.00 2.03 1.91 0.00 1.83 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.48 1.36 7.81 21 K 8.04 4.15 0.00 2.03 1.92 0.00 1.68 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.58 1.63 7.81 22 F 8.23 4.21 0.00 2.89 3.23 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 23 L 8.25 4.11 0.00 1.70 1.56 0.97 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 24 G 7.46 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 25 D 7.91 4.53 0.00 2.54 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 26 R 6.54 3.60 0.00 1.39 1.75 0.00 2.96 0.00 0.00 3.15 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.22 0.00 27 P 0.00 4.26 0.00 1.60 1.73 0.00 2.92 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.72 0.00 28 R 8.68 4.88 0.00 1.74 1.94 0.00 3.10 0.00 0.00 2.90 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.96 0.00 29 N 9.16 5.85 0.00 3.01 2.97 0.00 0.00 6.89 7.34 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 30 T 8.90 4.01 4.40 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 31 A 8.10 3.99 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 32 E 8.79 3.96 0.00 2.35 2.27 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 2.40 2.60 0.00 33 I 8.02 3.57 2.01 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.12 0.85 0.00 0.00 34 L 8.19 3.84 0.00 1.81 1.78 0.85 0.78 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 35 E 8.28 3.83 0.00 2.10 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 2.27 0.00 36 H 7.74 3.82 0.00 2.16 2.58 0.00 6.02 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 I 7.63 3.67 1.94 0.00 0.00 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 1.57 0.76 0.83 0.00 0.00 38 N 8.08 4.45 0.00 2.73 2.82 0.00 0.00 7.18 8.42 0.00 0.00 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 S 7.55 4.36 0.00 3.99 4.06 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.41 4.48 4.16 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 0.00 0.00 0.00 1.05 0.00 0.00 *42 R 8.00 4.26 0.00 1.70 1.89 0.00 3.11 0.00 0.00 3.13 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.14 0.00 43 H 8.10 4.67 0.00 3.15 3.28 0.00 5.85 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 44 G 8.27 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 45 T 8.96 4.55 4.20 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 0.00 0.00 0.00 1.16 0.00 0.00 46 T 7.53 4.69 4.23 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 1.26 0.00 0.00 47 S 8.40 4.09 0.00 4.09 4.17 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 0.00 0.00 0.00 0.00 48 Q 7.97 3.94 0.00 2.16 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.94 0.00 0.00 0.00 0.00 0.00 2.44 2.47 0.00 49 Q 8.07 3.99 0.00 2.13 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.58 0.00 0.00 0.00 0.00 0.00 2.37 2.36 0.00 50 L 8.31 3.97 0.00 1.73 1.82 0.78 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 51 G 8.15 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 52 N 7.96 4.36 0.00 2.87 2.87 0.00 0.00 6.67 9.00 0.00 0.00 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 7.76 3.51 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 0.94 0.00 0.00 0.95 0.00 0.00 54 L 7.73 3.61 0.00 0.76 0.13 -0.16 0.29 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 55 S 7.74 4.46 0.00 4.05 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 56 K 8.14 4.29 0.00 1.78 1.88 0.00 1.80 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.45 1.45 7.81 57 D 7.86 4.55 0.00 2.79 2.51 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 0.00 0.00 0.00 0.00 58 K 8.61 4.31 0.00 1.83 1.91 0.00 1.87 0.00 0.00 1.77 0.00 0.00 3.24 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.48 1.44 7.81 59 D 8.99 4.59 0.00 2.80 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 60 I 7.69 5.01 1.86 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 1.25 0.64 0.93 0.00 0.00 61 V 9.05 4.70 2.24 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 1.02 0.00 0.00 0.94 0.00 0.00 62 K 8.71 4.01 0.00 1.15 1.44 0.00 1.46 0.00 0.00 1.42 0.00 0.00 2.61 0.00 0.00 2.87 0.00 0.00 0.00 0.00 0.82 0.21 7.81 63 V 8.10 4.06 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 0.51 0.00 0.00 0.76 0.00 0.00 64 G 7.32 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 0.00 0.00 0.00 65 Y 8.35 5.35 0.00 2.76 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 66 I 8.43 4.41 1.74 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 1.04 0.43 0.79 0.00 0.00 67 K 8.31 4.56 0.00 1.33 1.55 0.00 1.89 0.00 0.00 1.68 0.00 0.00 2.81 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.20 1.57 7.81 68 R 8.46 4.50 0.00 1.41 0.66 0.00 2.98 0.00 0.00 2.97 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.18 0.00 69 S 7.63 5.12 0.00 3.78 3.58 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 70 G 8.25 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.70 3.90 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 1.30 0.64 0.91 0.00 0.00 72 L 7.86 4.41 0.00 1.62 1.72 0.93 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 73 S 8.33 4.20 0.00 3.99 3.99 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 0.00 0.00 0.00 74 G 8.04 3.91 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 0.00 75 G 8.37 4.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 Y 8.21 5.04 0.00 3.02 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 77 D 8.83 5.33 0.00 2.60 2.49 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.68 4.69 1.85 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.82 0.94 0.00 0.00 79 C 8.89 5.21 0.00 3.04 2.34 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 80 E 8.66 5.13 0.00 1.75 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.17 0.00 81 W 9.24 5.36 0.00 3.22 3.06 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.89 4.96 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.40 4.54 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 1.26 0.00 0.00 84 R 9.11 4.06 0.00 2.02 2.09 0.00 3.20 0.00 0.00 3.29 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.93 0.00 85 N 8.28 4.41 0.00 2.87 2.92 0.00 0.00 6.76 7.68 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 86 W 8.49 4.06 0.00 3.44 3.37 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 87 V 8.23 3.61 2.31 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 0.73 0.00 0.00 1.02 0.00 0.00 88 A 8.22 4.16 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 89 E 8.01 3.97 0.00 2.12 1.74 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 2.34 2.22 0.00 90 H 7.77 4.36 0.00 1.72 2.67 0.00 5.79 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 C 8.16 4.81 0.00 3.00 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 92 P 0.00 4.86 0.00 2.17 2.21 0.00 3.73 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.94 0.00 93 E 8.03 4.48 0.00 2.03 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 0.00 2.25 2.23 0.00 94 W 8.12 4.66 0.00 3.26 3.32 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 95 T 6.61 4.13 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 1.06 0.00 0.00 96 E 7.52 3.86 0.00 1.46 1.70 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 1.89 2.49 0.00 * Residues marked with a * may have inaccurate shift predictions.