NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 L 4.1763 8.1429 122.4894 54.9679 43.3845 178.3343 3 E 3.5465 7.4774 112.6549 55.1606 30.1982 178.6382 4 C 4.1467 8.5028 121.3806 58.1198 41.9591 171.9851 5 D 4.8038 7.4227 119.0020 53.8404 43.7853 179.5986 6 G 3.4497 8.5580 103.0113 49.5250 0.0000 174.4114 *9 N 4.6420 8.6961 119.6397 50.6642 41.0763 176.0915 10 I 4.8163 7.7371 119.9585 60.7950 39.8518 177.1691 11 C 3.8493 8.2296 125.5062 54.4454 40.2183 172.2246 12 C 5.0128 9.6659 126.3057 54.3049 46.7120 172.2620 13 K 4.7004 7.9645 125.9583 54.9720 33.6151 176.2783 14 K 4.0787 8.3439 132.0769 54.7804 33.0727 172.6678 15 Q 5.1345 8.4090 125.3735 53.0649 30.6642 174.3870 16 F 4.9008 8.6621 128.3873 56.4411 42.7261 173.4086 17 F 4.6345 7.8628 127.5656 56.6905 41.4733 174.7884 18 V 3.8562 5.6967 122.3462 60.8161 34.7555 174.1449 19 S 4.6532 8.2624 122.2354 57.4343 63.6271 174.8414 20 F 4.5814 9.0098 125.1852 59.5129 39.4650 177.5945 21 K 4.1486 8.4860 122.8394 59.3457 32.1594 177.9818 22 D 4.7128 7.7736 115.0233 55.1323 40.2915 176.6669 23 I 4.4352 7.9614 118.6198 60.1114 39.1577 176.5052 24 G 4.2243 8.6328 107.5485 45.2301 0.0000 174.5379 25 W 5.1181 8.6619 119.3241 57.2873 29.1517 177.5313 26 N 4.5134 8.5252 117.3940 56.2038 36.5336 176.3150 27 D 4.6281 8.3445 120.4623 56.2575 41.4769 176.9295 28 W 4.7866 8.4023 114.4038 56.4739 29.1935 175.2776 29 I 4.3038 7.0068 120.3711 59.4610 37.8068 175.5553 30 I 3.9090 8.5964 127.7964 63.8764 37.5276 176.6314 31 A 4.6460 7.3140 120.4387 50.3331 21.8464 174.7792 32 P 4.6844 0.0000 0.0000 62.2286 33.4971 175.8326 33 S 4.5768 8.8163 110.8837 60.4991 63.6469 173.0929 34 G 3.8397 7.6332 106.2631 46.0552 0.0000 170.9101 35 Y 4.8571 7.0083 117.1956 56.0636 42.2672 173.7947 36 H 4.6934 8.8411 116.2769 54.4361 29.2624 175.5497 37 A 4.4211 8.2257 127.5981 50.9199 18.3365 175.1820 38 N 5.3020 8.5171 118.2276 52.5281 41.4777 173.5509 39 Y 5.0794 7.9169 118.5666 55.7002 42.5011 173.3272 40 C 5.3468 9.1385 119.7372 56.1904 40.0795 173.9532 41 E 4.9134 10.1322 122.3292 53.2545 33.2512 172.1445 42 G 4.5690 8.3709 116.7256 44.0863 0.0000 171.6296 43 E 4.2754 8.5221 122.3281 55.6626 30.4459 175.1565 44 C 5.1628 8.3338 121.0901 54.0252 43.6729 172.4123 45 P 4.2688 0.0000 0.0000 63.1884 30.8813 174.8328 46 S 4.7196 8.1212 111.6270 56.7636 63.9538 173.0727 47 H 4.3159 7.9226 123.7869 56.9947 30.2668 175.0876 48 I 3.5038 8.2039 126.0832 62.0111 37.4180 175.8815 *77 L 4.2055 8.3002 119.5823 54.1709 41.6610 183.7358 78 K 4.6475 8.8910 117.8015 53.8404 34.7472 177.8724 79 S 4.6779 8.2202 110.6054 58.8135 65.0998 172.8567 80 C 4.8677 9.5511 125.0116 57.9497 31.5529 172.7805 81 C 4.9428 8.7706 121.9664 56.4928 39.0883 172.6244 82 V 4.6371 8.7751 119.6920 58.4424 35.5224 173.4422 83 P 4.9870 0.0000 0.0000 62.9353 31.7401 176.7908 84 T 4.6568 9.2301 112.0512 61.1063 70.3282 173.7610 85 K 4.5151 7.7195 123.5405 55.6829 35.6812 173.9116 86 L 5.3228 8.6783 127.0791 52.9487 44.4846 175.7240 87 R 4.7369 8.8584 123.0037 54.1106 33.4614 173.2631 88 P 5.1452 0.0000 0.0000 61.8874 33.3767 174.5353 89 M 4.9281 8.9643 119.6590 54.1517 35.9557 173.9336 90 S 5.2130 8.7005 119.6822 57.7397 64.8323 173.4602 91 M 5.1310 9.0113 122.1472 53.5392 36.8319 174.2892 92 L 4.9615 9.2778 123.7042 53.5968 44.7657 174.7291 93 Y 5.0614 8.1285 123.7841 55.6718 42.2217 173.2963 94 Y 5.1500 8.8071 117.6074 56.6185 39.7581 175.8109 95 D 5.0250 8.2948 123.5877 51.2624 41.6703 176.0456 96 D 4.4758 8.7525 117.8532 57.0086 38.8641 181.2507 97 G 3.8265 8.0687 106.5810 44.8178 0.0000 172.8225 98 Q 3.4180 9.0861 116.3168 55.9632 27.2578 172.9198 99 N 5.1052 7.8175 115.5766 50.8134 39.6293 174.2485 100 I 3.7743 8.5043 124.1462 61.6519 37.8048 175.3695 101 I 4.4340 8.5433 127.1642 59.1297 41.2118 174.7168 102 K 4.9207 8.2559 124.1872 53.6989 34.5648 175.1048 103 K 4.7080 8.7245 127.7766 54.7735 36.4739 174.8666 104 D 5.1783 8.6636 124.9347 52.8977 41.3009 176.1001 105 I 3.9517 8.6825 126.5003 61.1646 38.0057 176.6111 106 Q 4.3715 8.9246 126.1504 55.0094 29.8355 175.7771 107 N 4.1032 7.9594 115.9268 55.3565 35.7692 174.5497 108 M 4.8477 7.9904 114.4388 55.0422 34.3569 177.7488 109 I 4.6870 7.4712 120.0773 59.5473 41.6203 174.2876 110 V 4.1590 8.6201 127.4851 62.4558 31.3233 174.8167 111 E 4.3685 9.3061 130.4682 58.1275 30.4854 176.3036 112 E 4.8385 7.9826 117.0175 54.7877 34.1066 175.2094 113 C 5.4530 8.8046 119.6778 55.6991 41.9611 173.0722 114 G 4.1210 9.2509 107.9074 46.0394 0.0000 170.5349 115 C 5.5071 8.4948 116.8234 54.8483 42.2043 174.7598 116 S 4.3876 8.5164 118.1530 59.0485 62.0531 174.3256 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 2 L 8.14 4.18 0.00 1.73 1.72 0.94 0.68 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 3 E 7.48 3.55 0.00 2.11 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 2.24 1.93 0.00 4 C 8.50 4.15 0.00 3.03 3.48 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 5 D 7.42 4.80 0.00 2.71 2.48 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 6 G 8.56 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.70 4.64 0.00 2.69 2.72 0.00 0.00 6.53 7.59 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 10 I 7.74 4.82 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 1.23 1.00 0.96 0.00 0.00 11 C 8.23 3.85 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 12 C 9.67 5.01 0.00 3.22 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 13 K 7.96 4.70 0.00 1.80 1.81 0.00 1.83 0.00 0.00 1.77 0.00 0.00 2.94 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.26 1.26 7.81 14 K 8.34 4.08 0.00 1.51 1.66 0.00 1.83 0.00 0.00 1.57 0.00 0.00 2.75 0.00 0.00 2.63 0.00 0.00 0.00 0.00 1.37 1.26 7.81 15 Q 8.41 5.13 0.00 2.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.66 0.00 0.00 0.00 0.00 0.00 2.28 2.27 0.00 16 F 8.66 4.90 0.00 3.05 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 17 F 7.86 4.63 0.00 2.69 2.53 0.00 0.00 0.00 0.00 0.00 0.00 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 V 5.70 3.86 0.68 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 0.66 0.00 0.00 0.54 0.00 0.00 19 S 8.26 4.65 0.00 4.00 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 20 F 9.01 4.58 0.00 3.34 3.20 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 0.00 21 K 8.49 4.15 0.00 1.90 1.87 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.94 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.51 1.50 7.81 22 D 7.77 4.71 0.00 2.80 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 23 I 7.96 4.44 1.81 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 1.16 0.56 0.35 0.00 0.00 24 G 8.63 4.22 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 0.00 25 W 8.66 5.12 0.00 3.57 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 26 N 8.53 4.51 0.00 3.00 3.23 0.00 0.00 6.15 8.06 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 27 D 8.34 4.63 0.00 2.84 2.88 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 28 W 8.40 4.79 0.00 3.61 3.20 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 0.00 29 I 7.01 4.30 1.14 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 -0.30 -0.36 0.47 0.00 0.00 30 I 8.60 3.91 1.84 0.00 0.00 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.12 0.86 0.00 0.00 31 A 7.31 4.65 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 32 P 0.00 4.68 0.00 2.36 2.23 0.00 3.94 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 2.36 2.10 0.00 33 S 8.82 4.58 0.00 4.16 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 0.00 34 G 7.63 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 Y 7.01 4.86 0.00 2.94 2.77 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.84 4.69 0.00 3.08 3.53 0.00 5.88 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 A 8.23 4.42 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 38 N 8.52 5.30 0.00 2.78 2.77 0.00 0.00 6.50 7.48 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 39 Y 7.92 5.08 0.00 3.02 2.98 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 0.00 0.00 0.00 40 C 9.14 5.35 0.00 2.99 3.15 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 41 E 10.13 4.91 0.00 1.62 1.75 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 2.12 2.10 0.00 42 G 8.37 4.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.52 4.28 0.00 2.02 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 2.28 0.00 44 C 8.33 5.16 0.00 3.11 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 45 P 0.00 4.27 0.00 2.17 2.13 0.00 3.75 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.98 0.00 46 S 8.12 4.72 0.00 3.85 3.79 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 47 H 7.92 4.32 0.00 3.39 3.20 0.00 5.84 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 48 I 8.20 3.50 1.88 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 1.31 0.56 0.92 0.00 0.00 *77 L 8.30 4.21 0.00 1.60 1.42 0.92 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 78 K 8.89 4.65 0.00 1.76 1.63 0.00 1.76 0.00 0.00 1.63 0.00 0.00 2.83 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.28 0.97 7.81 79 S 8.22 4.68 0.00 4.01 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 80 C 9.55 4.87 0.00 2.86 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 81 C 8.77 4.94 0.00 3.13 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 V 8.78 4.64 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 0.70 0.00 0.00 1.01 0.00 0.00 83 P 0.00 4.99 0.00 1.97 2.01 0.00 3.64 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.12 0.00 84 T 9.23 4.66 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 1.27 0.00 0.00 85 K 7.72 4.52 0.00 1.83 1.75 0.00 1.66 0.00 0.00 1.82 0.00 0.00 2.86 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.48 7.81 86 L 8.68 5.32 0.00 1.65 1.56 0.95 0.92 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 87 R 8.86 4.74 0.00 1.87 1.76 0.00 3.10 0.00 0.00 3.18 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.59 0.00 88 P 0.00 5.15 0.00 2.00 2.02 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 2.00 2.21 0.00 89 M 8.96 4.93 0.00 2.08 1.91 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.58 0.00 90 S 8.70 5.21 0.00 3.82 3.79 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 91 M 9.01 5.13 0.00 1.89 1.90 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.47 0.00 92 L 9.28 4.96 0.00 1.62 1.44 0.85 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 93 Y 8.13 5.06 0.00 3.08 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 94 Y 8.81 5.15 0.00 2.99 2.90 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 95 D 8.29 5.02 0.00 2.79 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 96 D 8.75 4.48 0.00 2.89 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 97 G 8.07 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 98 Q 9.09 3.42 0.00 1.97 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.54 0.00 0.00 0.00 0.00 0.00 2.27 2.35 0.00 99 N 7.82 5.11 0.00 2.70 2.94 0.00 0.00 7.01 7.54 0.00 0.00 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 I 8.50 3.77 1.74 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.52 0.64 0.00 0.00 101 I 8.54 4.43 0.58 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 1.00 0.94 0.76 0.00 0.00 102 K 8.26 4.92 0.00 1.61 1.60 0.00 1.55 0.00 0.00 2.61 0.00 0.00 2.84 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.43 1.17 7.81 103 K 8.72 4.71 0.00 1.97 1.78 0.00 1.85 0.00 0.00 1.92 0.00 0.00 2.89 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.49 7.81 104 D 8.66 5.18 0.00 2.62 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 0.00 105 I 8.68 3.95 1.88 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 1.21 0.86 0.91 0.00 0.00 106 Q 8.92 4.37 0.00 1.96 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.84 6.68 0.00 0.00 0.00 0.00 0.00 2.38 2.36 0.00 107 N 7.96 4.10 0.00 2.82 2.95 0.00 0.00 6.72 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 0.00 108 M 7.99 4.85 0.00 1.87 2.08 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.64 0.00 109 I 7.47 4.69 2.10 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 1.37 0.82 0.96 0.00 0.00 110 V 8.62 4.16 2.26 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 0.78 0.00 0.00 1.04 0.00 0.00 111 E 9.31 4.37 0.00 1.98 2.03 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 2.28 2.33 0.00 112 E 7.98 4.84 0.00 1.90 1.76 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 2.28 2.32 0.00 113 C 8.80 5.45 0.00 2.82 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 0.00 114 G 9.25 4.12 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 0.00 0.00 0.00 115 C 8.49 5.51 0.00 2.87 3.03 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 0.00 116 S 8.52 4.39 0.00 3.77 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 * Residues marked with a * may have inaccurate shift predictions.