NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 26 T 4.2707 8.1744 110.9421 61.4967 70.3050 172.2598 27 R 5.1570 8.1091 121.5538 53.4167 32.5352 171.0142 28 E 4.8820 9.2381 125.8376 55.1207 34.6806 174.7116 29 C 4.5521 7.9051 116.4759 55.4309 45.4860 173.7172 30 I 4.1279 8.5340 122.4808 62.1833 37.3651 174.7668 31 Y 4.9016 9.4591 130.7624 56.6787 41.8078 174.5846 *32 Y 4.8693 7.5098 124.3543 56.0353 42.2001 172.2562 33 N 5.1533 9.1600 122.2113 51.7918 41.9205 174.6919 34 A 4.3544 8.5913 127.1240 52.9579 19.7039 177.3097 35 N 4.7927 8.3953 113.2900 53.0765 39.7727 173.8979 36 W 4.4935 8.4987 114.6687 56.1357 27.9975 176.2514 *38 L 4.1208 7.5489 115.6182 54.8132 43.3766 174.7987 39 E 4.7763 8.6989 117.6020 54.3182 32.7439 176.8737 40 R 3.9384 8.7580 116.7148 59.1571 29.3150 174.4244 41 T 4.3501 7.5404 111.2889 61.7649 67.7927 174.2439 42 N 4.6736 8.7389 126.1234 52.8613 39.4076 174.6568 43 Q 4.2027 7.6960 119.2841 57.9847 29.2857 176.5520 44 S 5.5512 7.2360 109.3549 54.8842 66.0833 171.6715 45 G 4.1878 8.3394 106.3508 42.9500 0.0000 172.8374 46 L 4.8345 8.0397 121.2694 55.0180 42.7583 175.8491 47 E 4.3502 9.3557 119.5783 54.2447 32.2601 174.4343 48 R 3.9153 8.6279 128.3517 56.8488 30.8415 176.3662 49 C 4.6937 8.7778 127.3441 56.4459 40.9302 173.4802 50 E 4.8031 9.8326 119.5631 53.2964 33.9990 174.2667 51 G 4.3692 7.7317 109.9261 48.0233 0.0000 176.4680 52 E 4.3067 8.6760 124.5549 55.3259 31.6674 176.2736 53 Q 3.5384 9.1710 115.5799 59.2612 27.4357 178.0276 54 D 4.7818 9.1777 114.5874 53.8677 40.9969 178.8538 55 K 4.3070 7.4730 122.1868 57.2877 32.6483 177.8854 56 R 4.1727 8.1231 123.5419 57.5583 29.8752 172.9896 57 L 4.8458 8.2650 120.5954 53.1584 45.2041 175.1709 58 H 5.0909 8.9792 117.1724 54.9601 34.1819 171.2450 59 C 5.7869 9.8249 117.0183 55.8822 42.5831 172.3804 60 Y 5.2361 9.0910 117.4840 56.7318 41.7992 173.3099 61 A 5.3248 8.4430 117.1706 51.2836 23.1791 175.7482 62 S 5.1790 9.2909 115.2596 57.0085 67.1738 173.5783 63 W 6.1278 8.0109 119.4746 57.8655 31.2550 173.4234 *69 T 4.3703 8.3719 110.7069 61.1830 69.3303 168.9134 70 I 4.3393 8.4786 129.3632 59.8822 38.4861 175.6563 71 E 4.5766 8.7060 120.9906 53.8146 31.3667 172.5117 72 L 4.7037 8.5224 125.7166 53.4983 41.4136 177.4630 73 V 3.8856 8.6617 125.0690 64.9927 32.1573 175.6583 74 K 5.0137 8.5905 118.3238 55.4299 37.2021 174.4491 75 K 4.9670 9.5798 121.8855 54.3099 36.9090 176.1587 76 G 4.1552 6.5092 107.3935 46.5138 0.0000 171.1568 77 C 5.0504 9.0661 117.8328 56.7158 41.5105 173.7689 78 W 5.2519 10.5237 131.1422 55.5332 33.4910 174.8306 79 L 4.5114 8.5191 126.7655 54.5732 42.1252 176.0373 80 D 4.3701 8.4859 119.0054 54.3238 42.1340 176.7360 *82 F 4.9820 8.7824 129.4595 58.9625 41.1048 176.9741 83 N 4.6726 8.6962 118.5918 55.1053 37.4084 179.5689 84 C 4.5983 7.7034 110.8426 59.0285 29.4951 179.8724 85 Y 3.7977 7.5589 116.9033 58.3822 34.7791 175.1122 *89 E 3.9661 7.6363 119.6913 56.0909 31.2450 176.6349 90 C 4.6029 8.4144 121.9681 55.7653 44.3797 172.3365 91 V 4.8495 8.3062 125.1709 60.9839 35.1419 174.0447 92 A 4.6860 8.7625 128.7906 51.6909 20.4903 177.9665 93 T 4.1944 8.6010 114.3663 62.3625 70.0925 172.1087 94 E 4.0347 8.1888 125.0454 56.5897 29.5242 177.3930 95 E 4.0462 8.6388 121.1067 56.8913 30.3416 172.7156 96 N 4.3744 9.0961 120.7219 52.5823 37.3767 171.9235 97 P 4.5094 0.0000 0.0000 62.8366 32.0489 175.6126 98 Q 4.2276 8.3619 115.9287 56.0732 29.9143 175.9619 99 V 4.1511 7.4338 118.5758 61.1941 32.5966 174.8903 *100 Y 3.8014 7.7310 128.4284 57.3633 37.8063 172.1212 101 F 4.9531 7.6222 122.9979 56.7532 42.7792 172.0112 102 C 4.9512 8.3492 119.2522 53.7372 45.6312 172.3484 103 C 4.6190 7.9902 119.1824 58.0101 33.9604 171.7817 104 C 4.9594 9.2840 119.8714 53.9210 45.2856 172.3012 105 E 4.8854 8.6442 120.4967 55.4674 32.0252 175.9306 106 G 3.9492 9.0682 112.5908 45.5063 0.0000 172.8111 107 N 4.4109 8.9759 121.0498 55.2863 39.0009 175.1822 108 F 4.0344 8.7054 120.1738 58.3068 37.2357 174.7737 109 C 4.3216 8.1165 118.8228 58.4040 41.3895 175.4857 110 N 4.1022 8.0570 115.9600 54.4003 37.3542 175.3973 111 E 3.9987 8.0623 123.0330 59.3406 29.7763 177.6605 112 R 4.3890 7.1795 115.7216 54.1690 31.3516 176.9085 113 F 5.1446 6.9854 115.4722 54.4665 41.4633 173.2430 114 T 4.6444 8.3435 114.8636 63.5396 73.2404 171.3437 115 H 5.4242 8.8727 121.8897 54.9563 32.1449 172.7395 116 L 4.7829 8.2212 126.5943 54.0733 45.7326 173.4518 117 P 5.0764 0.0000 0.0000 61.1519 34.5186 171.6304 118 E 4.4155 8.4421 113.0296 57.1821 30.3753 176.3977 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 26 T 8.17 4.27 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 1.23 0.00 0.00 27 R 8.11 5.16 0.00 1.96 1.73 0.00 3.19 0.00 0.00 3.28 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.57 0.00 28 E 9.24 4.88 0.00 1.28 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 2.22 2.30 0.00 29 C 7.91 4.55 0.00 2.64 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 30 I 8.53 4.13 2.05 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.83 0.94 0.00 0.00 31 Y 9.46 4.90 0.00 2.95 3.02 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 *32 Y 7.51 4.87 0.00 2.00 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 0.00 0.00 0.00 0.00 33 N 9.16 5.15 0.00 2.58 2.84 0.00 0.00 6.87 8.53 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 34 A 8.59 4.35 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 35 N 8.40 4.79 0.00 2.73 2.86 0.00 0.00 7.15 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 36 W 8.50 4.49 0.00 4.01 3.28 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 *38 L 7.55 4.12 0.00 1.56 1.68 0.87 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 39 E 8.70 4.78 0.00 2.10 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 2.26 2.41 0.00 40 R 8.76 3.94 0.00 1.85 1.93 0.00 3.26 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 1.56 1.22 0.00 41 T 7.54 4.35 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 1.52 0.00 0.00 42 N 8.74 4.67 0.00 2.81 2.70 0.00 0.00 7.06 7.69 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 43 Q 7.70 4.20 0.00 1.19 1.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.12 6.63 0.00 0.00 0.00 0.00 0.00 2.23 2.26 0.00 44 S 7.24 5.55 0.00 3.70 3.63 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.34 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.04 4.83 0.00 1.79 1.90 1.01 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 47 E 9.36 4.35 0.00 1.89 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 2.07 1.96 0.00 48 R 8.63 3.92 0.00 1.83 1.79 0.00 3.45 0.00 0.00 3.22 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.63 0.00 49 C 8.78 4.69 0.00 2.95 3.01 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 50 E 9.83 4.80 0.00 1.95 1.72 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 2.11 1.83 0.00 51 G 7.73 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 0.00 0.00 0.00 0.00 52 E 8.68 4.31 0.00 1.91 1.83 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 2.31 1.87 0.00 53 Q 9.17 3.54 0.00 2.06 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.90 7.13 0.00 0.00 0.00 0.00 0.00 2.29 1.98 0.00 54 D 9.18 4.78 0.00 2.69 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 55 K 7.47 4.31 0.00 1.62 1.81 0.00 1.72 0.00 0.00 1.78 0.00 0.00 3.09 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.85 1.43 7.81 56 R 8.12 4.17 0.00 1.63 1.74 0.00 3.20 0.00 0.00 3.22 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.50 0.00 57 L 8.26 4.85 0.00 1.41 1.51 0.96 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 58 H 8.98 5.09 0.00 3.38 3.32 0.00 5.56 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 C 9.82 5.79 0.00 2.78 2.91 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 60 Y 9.09 5.24 0.00 2.98 3.09 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 0.00 0.00 0.00 0.00 61 A 8.44 5.32 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 62 S 9.29 5.18 0.00 3.99 4.18 0.00 0.00 0.00 0.00 0.00 0.00 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 W 8.01 6.13 0.00 3.32 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 *69 T 8.37 4.37 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 70 I 8.48 4.34 1.97 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 1.39 1.06 1.14 0.00 0.00 71 E 8.71 4.58 0.00 1.85 1.81 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 2.20 1.85 0.00 72 L 8.52 4.70 0.00 1.70 1.74 0.98 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 73 V 8.66 3.89 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 0.98 0.00 0.00 1.01 0.00 0.00 74 K 8.59 5.01 0.00 1.96 1.90 0.00 1.79 0.00 0.00 1.83 0.00 0.00 3.08 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.47 1.51 7.81 75 K 9.58 4.97 0.00 1.66 1.73 0.00 1.83 0.00 0.00 1.69 0.00 0.00 3.17 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.52 1.43 7.81 76 G 6.51 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 0.00 0.00 0.00 0.00 77 C 9.07 5.05 0.00 2.90 3.09 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 0.00 0.00 0.00 0.00 78 W 10.52 5.25 0.00 4.01 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 79 L 8.52 4.51 0.00 1.36 1.56 0.84 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 80 D 8.49 4.37 0.00 2.72 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 *82 F 8.78 4.98 0.00 3.25 3.18 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.70 4.67 0.00 2.78 2.73 0.00 0.00 6.45 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 84 C 7.70 4.60 0.00 2.71 2.85 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 0.00 0.00 0.00 85 Y 7.56 3.80 0.00 2.41 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 *89 E 7.64 3.97 0.00 1.96 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 2.19 2.29 0.00 90 C 8.41 4.60 0.00 3.01 3.16 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 0.00 91 V 8.31 4.85 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 0.91 0.00 0.00 0.94 0.00 0.00 92 A 8.76 4.69 1.45 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 93 T 8.60 4.19 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 94 E 8.19 4.03 0.00 1.93 1.94 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 2.32 2.38 0.00 95 E 8.64 4.05 0.00 1.99 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 2.23 1.86 0.00 96 N 9.10 4.37 0.00 2.87 2.96 0.00 0.00 7.16 7.69 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 97 P 0.00 4.51 0.00 2.11 2.00 0.00 3.77 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 2.06 0.00 98 Q 8.36 4.23 0.00 2.01 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.65 6.95 0.00 0.00 0.00 0.00 0.00 2.25 2.24 0.00 99 V 7.43 4.15 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 0.70 0.00 0.00 0.88 0.00 0.00 *100 Y 7.73 3.80 0.00 2.07 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 0.00 0.00 0.00 0.00 101 F 7.62 4.95 0.00 2.69 2.67 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 0.00 0.00 0.00 102 C 8.35 4.95 0.00 3.16 3.44 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 0.00 103 C 7.99 4.62 0.00 2.21 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 0.00 104 C 9.28 4.96 0.00 2.92 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 0.00 105 E 8.64 4.89 0.00 1.77 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 2.12 2.46 0.00 106 G 9.07 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 0.00 107 N 8.98 4.41 0.00 2.96 2.95 0.00 0.00 7.15 8.13 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 0.00 108 F 8.71 4.03 0.00 3.29 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 0.00 109 C 8.12 4.32 0.00 3.14 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 N 8.06 4.10 0.00 2.93 2.99 0.00 0.00 5.94 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 0.00 111 E 8.06 4.00 0.00 2.12 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 2.37 2.43 0.00 112 R 7.18 4.39 0.00 1.77 1.67 0.00 3.27 0.00 0.00 3.27 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.41 0.00 113 F 6.99 5.14 0.00 2.06 2.65 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.34 4.64 4.28 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 1.23 0.00 0.00 115 H 8.87 5.42 0.00 3.30 3.30 0.00 5.88 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 L 8.22 4.78 0.00 1.80 1.65 0.91 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 117 P 0.00 5.08 0.00 2.08 1.74 0.00 3.84 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 1.82 1.53 0.00 118 E 8.44 4.42 0.00 1.93 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 2.13 1.85 0.00 * Residues marked with a * may have inaccurate shift predictions.