NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 T 4.6261 8.1744 111.0804 61.5682 70.2340 172.4944 7 L 4.6888 10.1688 125.8532 53.1160 45.5640 173.6018 8 T 5.0195 9.3509 122.0699 62.1027 71.3299 173.2499 9 V 4.5491 9.4821 120.4898 59.4838 35.5456 174.6983 10 Q 5.0504 8.6674 123.7368 54.6718 30.6340 175.0652 11 I 4.3488 8.9526 128.2020 60.0507 39.8646 175.5386 12 L 3.6574 10.5742 131.4282 56.4897 40.4631 173.6051 13 D 4.6584 8.1163 109.3325 54.9184 38.9742 174.5543 14 K 4.5593 7.7222 114.6532 55.0649 36.4963 175.0181 15 E 5.1061 8.2727 121.6237 55.2384 31.2878 175.0563 16 Y 4.6777 9.1718 120.9556 56.2085 42.1304 174.0043 17 C 5.2094 8.8924 123.2144 57.8600 33.6073 172.6049 18 I 4.5520 9.1992 127.1279 59.3220 41.2095 174.6928 19 N 4.8528 8.8418 125.6431 52.1228 37.1790 172.9009 20 C 4.6456 8.0447 116.7485 54.9081 31.8625 172.4760 21 P 4.1535 0.0000 0.0000 64.6565 31.1576 178.7568 22 D 4.0690 8.0250 123.0623 56.8695 41.5162 178.0190 23 D 4.5570 7.9798 114.6515 55.0539 39.6390 176.4521 24 E 4.3592 8.6596 119.8147 57.5808 30.8001 178.0188 25 R 3.7553 7.6698 118.8192 59.6779 30.0634 177.7897 26 A 4.0314 8.0085 119.7197 55.4004 18.4670 179.2436 27 N 4.3168 8.0716 114.4115 56.3784 38.6281 177.5791 28 L 4.0355 8.3957 120.9407 57.6849 41.5970 179.3785 29 E 3.9587 8.6341 119.0916 59.4958 29.5007 179.2572 30 S 4.0835 8.3083 112.9795 61.1973 62.2699 176.1827 31 A 3.9295 8.0249 123.2289 55.0800 18.1337 179.2318 32 A 3.9235 8.1949 119.5800 55.5354 18.4690 179.6570 33 R 3.8479 8.3142 117.3336 59.7701 29.9625 178.0831 34 Y 3.9531 7.9434 118.9341 60.7189 38.6410 177.5170 35 L 3.9654 8.1050 118.7641 58.1015 41.8733 178.5151 36 D 4.6001 8.2835 117.0708 57.6065 41.4150 178.6179 37 G 3.6970 7.9191 105.8158 47.4284 0.0000 176.4401 38 K 3.6920 7.8031 120.9934 56.4634 32.0179 178.7396 *40 R 4.2088 8.0022 118.5044 55.7509 32.4894 177.6527 41 E 3.8664 8.1885 118.0157 59.3884 29.3867 178.9947 42 I 3.6807 7.5988 118.4569 64.2973 37.5758 178.0364 43 R 4.0089 7.9183 119.0685 59.6235 29.7483 178.3836 44 S 4.1598 8.1422 112.0293 61.1487 62.3992 175.9130 45 S 4.2662 7.8550 116.1574 59.0451 62.8672 175.7559 46 G 3.9505 8.0057 108.9606 45.7860 0.0000 175.3342 47 K 4.0367 7.9634 118.6083 57.9163 32.2866 177.1689 48 V 4.3448 7.1914 118.8382 60.8212 33.7065 174.3387 49 I 4.2973 8.3184 127.9107 60.4179 38.9914 175.7973 50 G 3.9740 8.9928 112.8194 45.4805 0.0000 174.1991 51 A 4.0001 8.9319 126.3983 55.3102 18.3598 179.3273 52 D 4.3274 8.0423 117.1970 56.7765 39.3279 178.8882 53 R 4.0278 7.8665 118.0432 58.5952 30.2646 178.6105 54 V 3.7203 7.7541 117.6317 65.6017 31.7837 177.7033 55 A 4.1727 8.1247 120.6049 55.0402 18.4457 181.3046 56 V 3.9801 7.7904 111.5717 61.3400 31.6744 178.5876 *58 A 4.1531 8.0455 122.5351 52.2449 20.7607 179.7382 59 A 4.0450 8.3643 117.9887 55.1787 18.2754 179.6543 60 L 3.9491 8.6888 119.6688 58.0565 42.2168 178.7261 61 N 4.3216 8.0181 116.7086 56.8360 39.0413 176.6036 62 I 3.6361 7.9627 120.0015 64.0863 38.0107 177.9837 63 T 3.8531 8.0411 116.8912 66.7847 68.2224 176.0948 64 H 4.0642 8.4386 120.3098 59.0671 29.8421 176.7866 65 D 4.2103 7.9024 119.5678 57.3851 41.0932 178.1274 66 L 3.9135 8.1543 119.7900 57.9618 41.6542 179.6412 67 L 4.0197 8.0292 118.7528 57.9928 41.5219 179.3929 68 H 4.2797 7.9447 115.9160 59.0117 28.6348 178.1047 69 R 3.9461 8.0364 119.9171 58.9628 29.7388 178.9891 70 K 3.9047 8.5138 119.9842 59.2627 32.0627 178.5471 71 E 3.8625 8.1902 119.5836 59.4062 29.6837 178.6721 72 R 3.8660 7.8563 118.6151 59.3334 29.9543 178.0505 73 L 3.8685 8.0861 120.1043 58.3947 42.1469 178.5584 74 D 4.4225 8.4233 119.0460 57.7036 40.7115 178.5383 75 Q 3.9401 8.3923 120.4478 59.2091 29.1259 177.9235 76 E 3.9476 8.3185 119.3084 59.5362 29.6808 179.5298 77 S 4.0439 8.4580 113.5611 61.5627 62.5226 176.5320 78 S 4.2264 8.3030 116.6170 60.8938 62.8283 176.3340 79 S 4.0613 7.9356 117.7493 61.6152 62.1620 176.0769 80 T 4.0341 7.9071 112.1491 64.3452 68.6955 176.6991 81 R 3.8711 7.8600 121.7327 59.1686 29.9344 178.2629 82 E 4.0406 7.9437 118.2090 59.1276 29.5953 179.1992 83 R 3.8992 7.8428 117.6960 59.1791 30.1010 179.2908 84 V 3.5595 7.9862 118.1629 65.9207 31.5551 178.0151 85 R 3.8787 7.9247 118.3691 59.4622 29.9039 178.3283 86 E 3.9620 8.3914 118.4488 59.3523 29.4848 179.2850 87 L 3.9766 8.0442 118.9614 57.9874 41.7477 179.6635 88 L 4.0046 8.0538 118.8044 57.7369 41.5000 179.1507 89 D 4.3151 8.1106 118.0763 57.4904 41.1974 178.6017 90 R 3.9813 8.1255 118.5668 58.9780 29.7397 179.2807 91 V 3.5742 7.6103 117.7056 65.8046 31.8273 177.2435 92 D 4.4577 8.1962 117.7618 57.4778 41.1420 178.2807 93 R 3.8685 8.0062 118.1804 59.4712 29.9375 178.9125 94 A 4.0444 7.9131 118.7137 54.9006 18.3564 178.9580 95 L 4.2218 7.6197 115.5163 55.2767 42.1934 177.2276 96 A 4.1027 7.2163 124.0577 52.2773 19.2217 177.8268 *97 N 4.5483 8.4813 115.3373 52.6360 38.3779 175.3570 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 T 8.17 4.63 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 1.29 0.00 0.00 7 L 10.17 4.69 0.00 1.72 1.53 0.98 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 8 T 9.35 5.02 4.26 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 1.23 0.00 0.00 9 V 9.48 4.55 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 0.73 0.00 0.00 1.09 0.00 0.00 10 Q 8.67 5.05 0.00 2.05 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.65 6.82 0.00 0.00 0.00 0.00 0.00 2.26 2.45 0.00 11 I 8.95 4.35 2.01 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 1.21 0.88 0.00 0.00 12 L 10.57 3.66 0.00 1.66 1.72 0.94 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 13 D 8.12 4.66 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 14 K 7.72 4.56 0.00 2.04 1.30 0.00 1.71 0.00 0.00 1.57 0.00 0.00 2.94 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.30 1.42 7.81 15 E 8.27 5.11 0.00 1.73 1.79 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 2.23 2.28 0.00 16 Y 9.17 4.68 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 17 C 8.89 5.21 0.00 2.95 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 18 I 9.20 4.55 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 1.24 1.35 0.93 0.00 0.00 19 N 8.84 4.85 0.00 2.76 2.78 0.00 0.00 6.85 7.66 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 20 C 8.04 4.65 0.00 3.06 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 21 P 0.00 4.15 0.00 2.24 2.26 0.00 3.85 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 1.99 0.00 22 D 8.03 4.07 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 23 D 7.98 4.56 0.00 2.76 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 24 E 8.66 4.36 0.00 1.99 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 2.24 2.34 0.00 25 R 7.67 3.76 0.00 1.83 2.02 0.00 3.11 0.00 0.00 3.18 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.71 0.00 26 A 8.01 4.03 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 27 N 8.07 4.32 0.00 2.91 2.86 0.00 0.00 7.15 6.74 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 28 L 8.40 4.04 0.00 1.78 1.72 0.96 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 29 E 8.63 3.96 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 2.35 2.49 0.00 30 S 8.31 4.08 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 31 A 8.02 3.93 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 32 A 8.19 3.92 1.42 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 0.00 0.00 0.00 0.00 0.00 0.00 33 R 8.31 3.85 0.00 2.07 2.18 0.00 3.13 0.00 0.00 3.11 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.67 0.00 34 Y 7.94 3.95 0.00 3.15 3.17 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 35 L 8.11 3.97 0.00 1.95 1.72 1.01 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 36 D 8.28 4.60 0.00 2.65 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 37 G 7.92 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 0.00 0.00 0.00 38 K 7.80 3.69 0.00 1.26 1.63 0.00 1.48 0.00 0.00 1.51 0.00 0.00 2.67 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.30 1.42 7.81 *40 R 8.00 4.21 0.00 2.03 1.98 0.00 3.41 0.00 0.00 3.24 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.94 0.00 41 E 8.19 3.87 0.00 1.99 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 2.27 2.32 0.00 42 I 7.60 3.68 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 1.38 0.71 0.90 0.00 0.00 43 R 7.92 4.01 0.00 1.86 2.06 0.00 3.18 0.00 0.00 3.26 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.69 0.00 44 S 8.14 4.16 0.00 3.88 4.14 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 45 S 7.85 4.27 0.00 4.09 4.10 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 0.00 0.00 0.00 0.00 46 G 8.01 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 47 K 7.96 4.04 0.00 1.77 1.88 0.00 1.64 0.00 0.00 1.62 0.00 0.00 2.87 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.47 1.37 7.81 48 V 7.19 4.34 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 0.84 0.00 0.00 0.92 0.00 0.00 49 I 8.32 4.30 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 1.35 0.74 0.91 0.00 0.00 50 G 8.99 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 0.00 0.00 0.00 51 A 8.93 4.00 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 52 D 8.04 4.33 0.00 2.89 2.95 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 53 R 7.87 4.03 0.00 2.06 2.03 0.00 3.21 0.00 0.00 3.44 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00 54 V 7.75 3.72 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 0.80 0.00 0.00 0.96 0.00 0.00 55 A 8.12 4.17 1.42 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 0.00 0.00 0.00 0.00 0.00 0.00 56 V 7.79 3.98 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 0.95 0.00 0.00 0.93 0.00 0.00 *58 A 8.05 4.15 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 A 8.36 4.05 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 60 L 8.69 3.95 0.00 1.97 1.68 0.91 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 61 N 8.02 4.32 0.00 3.04 3.01 0.00 0.00 6.86 7.72 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 62 I 7.96 3.64 2.06 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 1.31 0.53 0.99 0.00 0.00 63 T 8.04 3.85 4.37 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 1.20 0.00 0.00 64 H 8.44 4.06 0.00 3.25 3.44 0.00 5.59 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 D 7.90 4.21 0.00 2.97 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 66 L 8.15 3.91 0.00 1.77 1.65 0.86 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 67 L 8.03 4.02 0.00 1.60 1.68 0.90 0.94 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 68 H 7.94 4.28 0.00 3.26 3.28 0.00 5.64 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 R 8.04 3.95 0.00 2.00 1.95 0.00 3.06 0.00 0.00 3.04 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.76 0.00 70 K 8.51 3.90 0.00 1.94 1.95 0.00 1.62 0.00 0.00 1.56 0.00 0.00 2.88 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.43 7.81 71 E 8.19 3.86 0.00 2.09 2.11 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 2.29 2.30 0.00 72 R 7.86 3.87 0.00 1.92 2.05 0.00 3.13 0.00 0.00 3.08 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.63 0.00 73 L 8.09 3.87 0.00 1.90 1.87 0.91 1.09 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 74 D 8.42 4.42 0.00 2.88 2.71 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.39 3.94 0.00 2.34 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.75 0.00 0.00 0.00 0.00 0.00 2.34 2.44 0.00 76 E 8.32 3.95 0.00 2.20 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 2.33 2.52 0.00 77 S 8.46 4.04 0.00 3.90 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 78 S 8.30 4.23 0.00 4.08 4.10 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 0.00 0.00 0.00 0.00 79 S 7.94 4.06 0.00 3.99 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 0.00 80 T 7.91 4.03 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 1.26 0.00 0.00 81 R 7.86 3.87 0.00 1.93 2.11 0.00 3.08 0.00 0.00 3.16 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 82 E 7.94 4.04 0.00 2.14 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 2.58 2.48 0.00 83 R 7.84 3.90 0.00 1.88 1.97 0.00 3.12 0.00 0.00 3.30 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.63 0.00 84 V 7.99 3.56 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 0.99 0.00 0.00 0.99 0.00 0.00 85 R 7.92 3.88 0.00 2.03 2.06 0.00 3.30 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 86 E 8.39 3.96 0.00 2.20 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 2.51 0.00 87 L 8.04 3.98 0.00 1.84 1.71 0.92 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 88 L 8.05 4.00 0.00 1.83 1.72 0.92 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 89 D 8.11 4.32 0.00 3.05 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 90 R 8.13 3.98 0.00 2.06 1.96 0.00 3.18 0.00 0.00 3.09 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.76 0.00 91 V 7.61 3.57 2.21 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 0.79 0.00 0.00 1.00 0.00 0.00 92 D 8.20 4.46 0.00 2.75 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 R 8.01 3.87 0.00 2.04 1.97 0.00 3.19 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.66 0.00 94 A 7.91 4.04 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 95 L 7.62 4.22 0.00 1.95 1.73 0.92 0.82 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 96 A 7.22 4.10 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 *97 N 8.48 4.55 0.00 2.50 2.64 0.00 0.00 6.54 7.56 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 * Residues marked with a * may have inaccurate shift predictions.