NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 E 4.3850 8.4449 121.4817 55.8348 30.7315 178.8333 3 R 4.1055 8.7357 113.7205 53.3601 30.4297 173.3387 4 P 4.7221 0.0000 0.0000 62.2478 33.5164 175.8238 5 K 4.4456 8.5329 118.1147 56.7402 33.3452 176.5532 6 L 4.9675 7.7623 118.5369 52.7038 45.4986 175.7087 7 G 4.4827 8.7731 108.5261 44.3017 0.0000 171.4064 8 L 4.8876 8.8349 123.9393 52.8249 44.4905 175.6084 9 I 4.4898 8.3855 127.5128 61.3785 37.8586 175.6202 10 V 4.4516 8.6845 126.7313 61.2480 34.4595 175.3975 11 R 4.3221 8.6725 126.2045 55.5921 31.0871 175.9387 12 E 4.4440 8.3512 119.7412 55.5350 30.2950 176.2104 13 P 4.2586 0.0000 0.0000 64.4895 31.6187 177.8904 14 Y 4.1728 6.6706 117.0300 61.3532 37.8132 177.8668 15 A 3.9823 7.9761 121.2582 55.6140 18.4422 179.7260 16 S 4.0431 8.3055 112.9002 61.9265 62.9202 177.0589 17 L 4.0256 8.1306 121.6488 57.8518 41.2364 179.7761 18 I 3.9191 8.2242 120.0842 64.6001 36.7426 178.8299 19 V 3.6916 7.9885 112.4058 63.2684 31.1046 177.1791 20 D 4.9004 7.9047 117.5485 53.3927 41.0120 176.9692 21 G 3.9592 7.9283 107.5082 46.1910 0.0000 175.0539 22 R 4.1949 8.1539 119.5225 56.4205 30.6705 176.4851 23 K 4.5448 7.9978 118.3833 54.7158 34.1063 175.4877 24 V 4.4316 8.4616 118.2620 61.0607 33.7649 175.1337 25 W 5.4782 8.2414 119.8429 54.8656 31.6797 174.2300 26 E 4.3898 9.3284 127.7613 55.1543 30.5028 175.1477 27 I 4.6897 8.1473 127.9327 60.8752 38.3510 175.3732 28 R 4.5660 9.1062 124.4196 54.7599 34.5863 176.2013 29 R 4.2488 8.7293 118.6988 57.1639 30.7305 176.8225 30 R 4.9974 7.7630 115.6949 54.3122 34.0499 175.0740 31 K 4.1894 7.9581 119.7143 56.2559 33.7863 175.7820 32 T 4.3106 7.1629 110.6705 62.6024 69.5153 172.7445 33 R 4.2987 8.5407 126.1452 56.0467 30.2091 175.5364 34 H 4.3059 7.4816 116.1146 55.6819 30.3211 174.8982 35 R 4.5539 8.0219 124.2237 55.6228 33.9959 174.8451 36 G 3.7467 9.1972 107.3000 43.0363 0.0000 170.0447 37 P 4.6822 0.0000 0.0000 62.5897 32.0421 175.9490 38 L 4.7526 9.4281 126.0892 52.9879 45.0588 175.8839 39 G 4.0287 9.1719 114.7966 46.4575 0.0000 171.6873 40 I 4.7567 8.5375 123.6617 59.4926 39.2708 174.7291 41 V 4.8856 8.6495 128.4593 61.1296 33.6659 174.5127 42 S 4.7232 8.8665 122.0705 57.0532 66.2627 173.8666 43 G 4.0642 9.7054 113.8444 46.7706 0.0000 173.6783 44 G 4.0184 8.4910 102.5424 45.8321 0.0000 174.1872 45 R 4.6283 7.8235 117.3745 53.8532 33.9281 174.6675 46 L 4.7890 9.2331 125.1131 54.1452 41.6022 176.8664 47 I 4.1381 8.1501 120.4311 61.1159 39.1580 176.0424 48 G 2.4380 7.0654 107.9857 45.8833 0.0000 171.0295 49 Q 4.9057 6.7644 117.3602 55.6435 32.6700 173.1533 50 A 4.8200 8.6611 120.0567 50.9257 23.4955 174.7117 51 D 5.1917 9.0751 119.7078 52.6248 43.1370 176.0802 52 L 4.4978 8.9099 127.2989 55.0055 41.9971 177.0346 53 V 4.2456 8.3685 120.6911 62.5521 33.3747 176.0762 54 G 3.9766 7.3902 105.5876 46.0358 0.0000 171.9696 55 V 4.4639 7.7824 118.8068 60.4321 34.6778 173.0086 *86 P 4.0555 0.0000 0.0000 62.4818 30.7643 175.2282 87 L 4.8934 7.6253 123.4282 53.5921 46.2353 174.9610 88 Y 5.0066 9.4413 118.0531 56.2425 42.2864 174.8931 89 A 5.0802 8.5021 123.2881 49.8441 20.7722 175.9857 90 W 4.2654 9.4679 123.2891 57.4484 30.6445 176.0137 91 V 4.5979 8.5680 125.5941 61.9287 32.1808 174.4522 92 L 5.4607 9.0973 128.7710 53.2809 43.7480 175.8859 93 E 4.7488 8.8326 121.2276 54.6543 34.3912 174.9601 94 N 4.4158 8.8944 115.1026 54.3569 36.3315 174.7209 95 A 4.6386 8.0580 118.0776 52.2020 19.7210 177.8426 96 F 5.0505 8.3043 113.8147 56.3213 41.7585 172.8808 97 R 4.7305 8.5556 121.0627 54.9220 31.1635 175.7410 98 Y 4.7465 8.3882 125.1171 57.7026 38.5881 175.9280 99 E 4.1826 9.1658 121.4627 58.7993 29.6637 177.7553 100 K 4.6178 7.8136 117.2319 53.2704 35.5854 173.7799 101 P 4.6841 0.0000 0.0000 62.8664 31.7896 176.2032 102 L 4.3217 9.0924 125.4419 54.7904 42.9362 176.0621 103 H 5.0884 8.6919 121.8851 55.2565 31.7442 174.1089 104 V 4.5995 8.3504 120.2215 60.3043 34.5149 173.4438 105 P 4.3186 0.0000 0.0000 62.5117 31.9634 175.9110 *113 F 4.7457 8.1603 118.1210 57.4660 39.9762 175.0124 114 V 3.9539 8.3965 123.8531 61.6193 31.9176 175.0953 115 D 4.4006 8.8275 127.4124 54.7982 41.2432 175.3119 116 L 4.6540 8.3782 125.6173 54.3901 42.3009 178.4663 117 S 4.0757 8.3719 115.1789 60.6609 63.1069 174.9569 118 E 4.4307 7.9317 119.1263 55.7919 29.7122 175.7042 119 V 3.8731 7.6104 119.6189 62.8796 32.2163 176.2301 120 R 4.2143 8.3942 123.3392 56.3877 30.1683 176.2774 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 E 8.44 4.39 0.00 1.97 1.16 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 2.23 2.46 0.00 3 R 8.74 4.11 0.00 1.95 1.89 0.00 3.59 0.00 0.00 3.33 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.76 0.00 4 P 0.00 4.72 0.00 2.46 2.09 0.00 3.85 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.10 0.00 5 K 8.53 4.45 0.00 1.81 1.95 0.00 1.74 0.00 0.00 1.74 0.00 0.00 3.03 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.41 1.41 7.81 6 L 7.76 4.97 0.00 1.52 1.54 0.92 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 7 G 8.77 4.48 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 0.00 0.00 0.00 8 L 8.83 4.89 0.00 1.82 1.56 0.92 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 9 I 8.39 4.49 1.86 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 0.53 0.91 0.00 0.00 10 V 8.68 4.45 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 0.87 0.00 0.00 0.98 0.00 0.00 11 R 8.67 4.32 0.00 2.01 1.87 0.00 3.34 0.00 0.00 3.36 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.65 0.00 12 E 8.35 4.44 0.00 1.90 1.78 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 2.29 2.20 0.00 13 P 0.00 4.26 0.00 1.99 2.06 0.00 2.75 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 1.65 0.00 14 Y 6.67 4.17 0.00 3.23 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 15 A 7.98 3.98 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 16 S 8.31 4.04 0.00 4.06 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 17 L 8.13 4.03 0.00 1.88 1.76 0.90 1.09 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 18 I 8.22 3.92 2.06 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 1.58 0.77 0.91 0.00 0.00 19 V 7.99 3.69 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 0.85 0.00 0.00 0.97 0.00 0.00 20 D 7.90 4.90 0.00 2.71 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 21 G 7.93 3.96 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 0.00 0.00 0.00 22 R 8.15 4.19 0.00 1.93 2.00 0.00 3.10 0.00 0.00 3.14 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.56 0.00 23 K 8.00 4.54 0.00 1.74 1.84 0.00 1.95 0.00 0.00 1.85 0.00 0.00 3.10 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.40 1.51 7.81 24 V 8.46 4.43 2.25 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 0.75 0.00 0.00 0.91 0.00 0.00 25 W 8.24 5.48 0.00 3.04 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 26 E 9.33 4.39 0.00 2.08 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 1.98 1.88 0.00 27 I 8.15 4.69 1.74 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.93 0.91 0.00 0.00 28 R 9.11 4.57 0.00 1.27 1.55 0.00 2.67 0.00 0.00 2.78 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.55 0.50 0.00 29 R 8.73 4.25 0.00 1.84 1.99 0.00 3.12 0.00 0.00 3.21 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.61 0.00 30 R 7.76 5.00 0.00 1.94 1.88 0.00 3.49 0.00 0.00 3.30 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.66 0.00 31 K 7.96 4.19 0.00 1.36 1.39 0.00 1.46 0.00 0.00 1.23 0.00 0.00 2.49 0.00 0.00 2.65 0.00 0.00 0.00 0.00 0.55 0.21 7.81 32 T 7.16 4.31 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 33 R 8.54 4.30 0.00 1.72 1.75 0.00 3.24 0.00 0.00 3.07 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.40 0.00 34 H 7.48 4.31 0.00 3.00 2.98 0.00 5.94 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 35 R 8.02 4.55 0.00 1.65 1.65 0.00 3.40 0.00 0.00 3.20 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.44 0.00 36 G 9.20 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 37 P 0.00 4.68 0.00 2.00 2.26 0.00 3.70 0.00 0.00 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.14 0.00 38 L 9.43 4.75 0.00 1.77 1.67 1.01 1.13 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 39 G 9.17 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 0.00 0.00 0.00 40 I 8.54 4.76 1.77 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 1.00 1.32 0.88 0.00 0.00 41 V 8.65 4.89 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 1.03 0.00 0.00 0.96 0.00 0.00 42 S 8.87 4.72 0.00 3.96 3.60 0.00 0.00 0.00 0.00 0.00 0.00 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 9.71 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 0.00 0.00 0.00 44 G 8.49 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 0.00 0.00 0.00 45 R 7.82 4.63 0.00 1.94 1.75 0.00 3.20 0.00 0.00 3.04 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.32 0.00 46 L 9.23 4.79 0.00 1.75 1.79 1.06 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 47 I 8.15 4.14 1.84 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 1.17 0.72 0.96 0.00 0.00 48 G 7.07 2.44 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 49 Q 6.76 4.91 0.00 2.08 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.56 0.00 0.00 0.00 0.00 0.00 1.16 1.78 0.00 50 A 8.66 4.82 1.22 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 51 D 9.08 5.19 0.00 2.77 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.91 4.50 0.00 1.85 1.55 1.03 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 53 V 8.37 4.25 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 0.72 0.00 0.00 0.98 0.00 0.00 54 G 7.39 3.98 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 0.00 0.00 0.00 55 V 7.78 4.46 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.00 0.00 0.55 0.00 0.00 *86 P 0.00 4.06 0.00 2.13 2.05 0.00 3.71 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 1.82 1.95 0.00 87 L 7.63 4.89 0.00 1.41 1.48 0.88 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 88 Y 9.44 5.01 0.00 3.09 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 89 A 8.50 5.08 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 W 9.47 4.27 0.00 3.26 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 91 V 8.57 4.60 2.19 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 1.11 0.00 0.00 0.65 0.00 0.00 92 L 9.10 5.46 0.00 1.61 1.62 1.01 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 93 E 8.83 4.75 0.00 1.90 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 2.28 2.32 0.00 94 N 8.89 4.42 0.00 3.05 3.00 0.00 0.00 6.93 7.35 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 95 A 8.06 4.64 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 96 F 8.30 5.05 0.00 3.08 3.11 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 97 R 8.56 4.73 0.00 1.81 1.90 0.00 3.26 0.00 0.00 3.24 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.72 0.00 98 Y 8.39 4.75 0.00 3.14 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 99 E 9.17 4.18 0.00 2.12 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 0.00 2.37 2.42 0.00 100 K 7.81 4.62 0.00 1.74 1.74 0.00 1.77 0.00 0.00 1.77 0.00 0.00 3.06 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.35 1.42 7.81 101 P 0.00 4.68 0.00 2.08 2.11 0.00 3.80 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.01 0.00 102 L 9.09 4.32 0.00 1.68 1.63 0.71 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 103 H 8.69 5.09 0.00 3.18 3.16 0.00 5.67 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 V 8.35 4.60 2.13 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 0.88 0.00 0.00 0.97 0.00 0.00 105 P 0.00 4.32 0.00 2.05 1.93 0.00 3.72 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.08 0.00 *113 F 8.16 4.75 0.00 3.11 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 0.00 114 V 8.40 3.95 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 0.80 0.00 0.00 0.99 0.00 0.00 115 D 8.83 4.40 0.00 2.72 2.64 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 0.00 116 L 8.38 4.65 0.00 1.70 1.61 0.90 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 117 S 8.37 4.08 0.00 3.89 3.94 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 0.00 118 E 7.93 4.43 0.00 1.97 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 2.22 2.20 0.00 119 V 7.61 3.87 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 0.75 0.00 0.00 0.94 0.00 0.00 120 R 8.39 4.21 0.00 1.82 1.80 0.00 3.29 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.59 0.00 * Residues marked with a * may have inaccurate shift predictions.