NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 G 3.6185 8.3544 109.7324 45.3061 0.0000 176.9298 *2 Q 3.8048 8.7787 131.0732 55.5976 28.6051 172.8249 3 Y 4.8208 7.9354 124.5734 56.0946 42.1665 173.9042 4 A 4.2715 6.9909 125.7681 51.1553 22.1261 176.0140 5 T 4.2475 8.0568 118.6281 61.7290 69.1590 175.0429 6 L 4.0903 8.2320 127.5368 54.5485 42.1914 177.5892 7 E 4.0030 8.7827 123.0227 57.3817 30.0005 176.7364 8 L 3.7349 8.2214 117.3037 55.5159 39.0416 174.7449 9 N 4.9944 8.1605 108.8089 52.8515 38.8778 173.3672 10 N 4.9139 8.4417 116.0250 51.5259 40.7330 174.6517 11 A 4.7080 8.6787 125.4894 54.5519 18.6348 177.8088 12 F 4.7672 7.6023 114.9478 57.2826 42.5112 173.4363 13 K 4.2413 8.0388 127.4751 54.4415 35.2396 175.3071 14 V 3.5539 8.1723 128.1716 62.8157 31.8538 175.7170 15 L 4.6992 8.2042 129.8740 54.5819 44.1197 175.3613 16 F 4.8871 7.3862 119.5385 56.9656 40.8037 175.0507 17 S 5.4250 8.6990 113.5652 56.9209 66.8440 174.1636 18 L 4.4442 8.9961 123.5671 54.9030 44.9088 176.5044 19 R 3.5816 9.6924 126.8354 57.6615 27.8678 176.1588 20 Q 3.7868 8.0842 109.3805 56.8038 26.4863 173.3424 21 V 5.0851 7.8401 117.3071 61.1853 34.9151 174.0064 22 Q 5.1363 9.3520 127.5923 54.3811 32.3641 173.6322 23 A 4.9985 8.8721 127.5194 50.5418 21.6407 175.6245 24 A 4.5852 8.4387 121.3404 50.4218 23.3947 175.9439 25 E 4.5798 8.3783 122.4107 54.8525 32.8287 174.6521 *27 V 4.3278 8.0322 119.0014 62.9337 33.0144 173.9889 28 I 4.7769 8.3777 128.6993 59.3685 39.3498 175.5282 29 A 4.4649 8.5477 128.4821 50.7835 19.8402 174.9475 30 P 4.2613 0.0000 0.0000 64.3427 31.7798 177.4151 31 G 3.8888 8.2188 110.2829 45.7440 0.0000 172.5244 32 D 5.1838 7.7691 119.4777 52.5073 44.3366 175.1083 33 R 5.1114 8.2491 114.5458 55.0658 32.5616 174.1458 34 E 4.5595 9.0285 119.7269 55.6802 33.3304 177.7448 35 G 3.8028 8.5717 109.7247 47.4128 0.0000 172.2432 36 G 3.9560 7.3626 108.8768 44.7223 0.0000 171.3801 37 P 4.3992 0.0000 0.0000 64.6458 31.2615 176.7187 38 D 4.7396 7.9228 117.2062 53.8994 41.6428 174.8699 39 N 4.6925 7.9922 120.2772 52.6567 39.8162 174.1412 40 R 4.9066 8.3004 124.3674 54.7340 35.3961 174.1917 41 H 5.1757 8.5580 119.0238 54.1796 29.8658 175.7284 42 R 3.9280 9.5456 122.5613 58.1366 29.8315 177.8467 43 G 4.2889 8.5660 103.9868 45.2751 0.0000 172.4774 44 A 5.0627 7.8159 121.8024 49.9197 22.5148 176.0584 45 D 4.8696 9.1790 122.6025 54.2917 42.7601 175.4103 46 Q 4.7330 9.1504 122.4794 54.2363 32.1991 174.1342 47 W 4.9779 9.5326 128.1703 55.6303 30.7009 175.0800 48 L 5.1942 9.1132 128.7052 53.2543 43.8431 174.7042 49 F 5.3501 9.3237 128.9927 56.3882 42.4213 173.9048 50 V 4.1707 7.7497 126.8746 62.0661 31.6739 176.5304 51 V 3.7674 8.6265 129.8075 65.8050 32.2290 175.2585 52 D 4.3369 8.0547 117.0183 54.4009 44.4541 175.8205 53 G 4.1725 9.2742 108.4703 44.2428 0.0000 171.5770 54 A 4.8959 8.0477 118.2251 50.6534 22.6821 176.1637 55 G 4.4716 8.5029 106.9703 45.3223 0.0000 171.0070 56 E 5.2486 9.1063 120.3787 54.6112 33.5216 175.2717 57 A 5.2105 9.0113 128.4870 50.3826 21.9442 175.4958 58 I 4.9289 8.9161 122.3217 59.4734 40.5259 174.8945 59 V 4.5791 8.8132 127.3365 60.9573 34.0649 175.3504 60 D 4.5667 9.6605 131.0867 55.4661 38.8154 175.3894 61 G 3.9575 8.2246 104.9239 45.8617 0.0000 173.2978 62 H 4.5664 8.1072 118.1913 55.3148 29.6647 174.1003 63 T 5.1331 8.2947 120.4430 62.0272 70.7637 173.9131 64 Q 4.5169 8.8293 125.8918 54.1850 32.6254 173.8150 65 A 4.4930 8.8599 128.6062 52.2896 19.3949 176.2693 66 L 4.8970 8.9713 122.0832 53.1057 45.1060 175.7324 67 Q 4.9636 9.1594 119.4279 54.4773 32.8848 173.6004 68 A 4.1533 8.3922 122.4871 53.8522 18.5651 177.9312 69 G 4.1075 8.3458 112.0593 44.9489 0.0000 174.1145 70 S 4.2674 7.9079 117.3735 58.4893 63.8244 173.0246 71 L 5.3544 8.6399 126.2076 53.3399 44.6274 175.2242 72 I 4.4582 9.1211 126.8926 59.4790 40.2044 174.6135 73 A 3.8439 8.2968 129.0952 50.3356 19.2276 176.5537 74 I 3.9409 8.3151 123.9107 60.6476 37.7765 175.4180 75 E 4.4860 8.8574 129.5405 55.4750 30.8514 176.4148 76 R 4.3500 8.3968 122.0346 57.5251 29.5635 177.0136 77 G 3.9760 8.9673 110.5636 45.0592 0.0000 173.2938 78 Q 4.4874 7.7676 118.9726 54.9953 29.7504 175.9890 79 A 4.5563 8.9560 126.7782 52.3870 19.7610 176.0469 80 H 5.4979 9.2272 117.3007 54.0317 32.2938 172.0638 81 E 5.0875 9.4059 121.5209 54.5413 33.3867 174.0369 82 I 4.8102 8.8518 126.9973 59.7135 40.2475 174.4934 83 R 4.9488 9.0867 126.8666 54.2178 32.2440 174.8955 84 N 4.9385 9.0622 123.3090 53.4617 39.7508 175.0710 85 T 4.1316 8.7958 115.6619 61.7121 70.5374 174.6859 86 G 4.2524 8.1540 112.3373 44.5083 0.0000 173.9331 87 D 4.9618 8.5977 121.1484 52.9520 39.6817 175.1911 88 T 4.8106 7.4942 107.9575 59.5341 72.2117 171.5537 89 P 4.5060 0.0000 0.0000 62.8425 32.4876 175.9914 90 L 4.5584 8.7884 125.8664 53.8527 43.4012 175.1484 91 K 4.9593 8.8152 127.5730 55.0799 33.7461 176.0168 92 T 5.2786 8.5251 114.7979 59.7351 72.0608 173.4517 93 V 4.6134 8.6918 122.3320 60.0980 34.7247 174.1727 94 N 5.3459 8.5721 119.2860 51.5088 42.9524 173.2346 95 F 5.0497 9.1455 121.9633 55.9584 42.0858 173.6889 96 Y 5.2974 9.4848 122.4787 56.7508 40.3098 174.6329 97 H 5.4019 9.3704 123.7619 53.9018 33.1541 171.1638 98 P 5.6658 0.0000 0.0000 61.3782 32.2723 174.1983 99 P 4.4993 0.0000 0.0000 62.9882 31.7472 176.3882 100 A 4.4008 8.7818 122.2799 52.0505 20.6192 176.1279 101 Y 4.9471 7.6016 112.0254 56.0106 42.0670 175.0429 102 D 4.7458 8.9677 123.0422 52.1118 41.6124 176.7086 103 A 4.1826 8.4228 120.4961 54.6276 18.4719 178.2854 104 Q 4.2239 8.3000 113.2329 55.6713 29.0744 176.4237 105 G 4.0321 8.1610 106.0536 46.2298 0.0000 173.5498 106 E 4.6191 8.4714 119.1163 53.7816 30.9087 174.2642 107 P 4.2647 0.0000 0.0000 62.4389 32.0716 176.6974 108 L 4.2287 8.1246 122.9490 53.5839 42.7766 176.2655 109 P 4.4222 0.0000 0.0000 65.1092 31.4515 179.0262 110 A 4.0053 8.0349 120.2991 54.7807 18.4362 178.9979 111 G 3.5103 7.6045 103.0395 46.6098 0.0000 174.0388 112 E 4.2240 7.7279 120.0499 55.4023 30.4139 177.2230 113 G 4.1033 8.4176 108.3735 46.1674 0.0000 173.7065 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 0 G 8.35 3.62 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 0.00 0.00 0.00 *2 Q 8.78 3.80 0.00 1.86 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.19 6.70 0.00 0.00 0.00 0.00 0.00 1.16 1.68 0.00 3 Y 7.94 4.82 0.00 2.91 2.78 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 0.00 0.00 0.00 4 A 6.99 4.27 1.26 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 0.00 0.00 5 T 8.06 4.25 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 6 L 8.23 4.09 0.00 1.56 1.65 0.76 0.89 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 7 E 8.78 4.00 0.00 1.93 2.06 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 2.30 2.31 0.00 8 L 8.22 3.73 0.00 1.76 1.71 0.94 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 9 N 8.16 4.99 0.00 2.73 2.80 0.00 0.00 6.18 8.04 0.00 0.00 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 N 8.44 4.91 0.00 2.77 2.70 0.00 0.00 6.81 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 11 A 8.68 4.71 1.32 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 0.00 0.00 12 F 7.60 4.77 0.00 2.92 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 13 K 8.04 4.24 0.00 1.65 1.34 0.00 1.68 0.00 0.00 1.57 0.00 0.00 2.81 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.15 1.25 7.81 14 V 8.17 3.55 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 0.79 0.00 0.00 0.81 0.00 0.00 15 L 8.20 4.70 0.00 1.13 0.84 0.57 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 16 F 7.39 4.89 0.00 3.09 3.21 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 0.00 0.00 0.00 0.00 17 S 8.70 5.42 0.00 3.82 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 18 L 9.00 4.44 0.00 1.87 1.54 0.92 1.42 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 19 R 9.69 3.58 0.00 1.96 1.95 0.00 3.36 0.00 0.00 3.23 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.64 0.00 20 Q 8.08 3.79 0.00 2.46 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.86 0.00 0.00 0.00 0.00 0.00 2.33 1.90 0.00 21 V 7.84 5.09 2.15 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 1.17 0.00 0.00 0.94 0.00 0.00 22 Q 9.35 5.14 0.00 2.26 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.55 0.00 0.00 0.00 0.00 0.00 2.39 2.36 0.00 23 A 8.87 5.00 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 A 8.44 4.59 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.38 4.58 0.00 1.85 1.62 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 2.16 2.16 0.00 *27 V 8.03 4.33 2.20 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 0.92 0.00 0.00 0.96 0.00 0.00 28 I 8.38 4.78 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 1.19 0.53 0.94 0.00 0.00 29 A 8.55 4.46 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 P 0.00 4.26 0.00 2.05 2.16 0.00 3.75 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.16 0.00 31 G 8.22 3.89 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 0.00 0.00 0.00 32 D 7.77 5.18 0.00 2.83 2.57 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 33 R 8.25 5.11 0.00 1.85 1.83 0.00 2.96 0.00 0.00 3.47 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.65 0.00 34 E 9.03 4.56 0.00 1.87 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 2.21 2.38 0.00 35 G 8.57 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 0.00 0.00 0.00 36 G 7.36 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 37 P 0.00 4.40 0.00 2.18 2.18 0.00 3.69 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.97 0.00 38 D 7.92 4.74 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 39 N 7.99 4.69 0.00 2.81 2.92 0.00 0.00 6.96 7.67 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 40 R 8.30 4.91 0.00 1.72 1.73 0.00 3.14 0.00 0.00 3.44 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.61 0.00 41 H 8.56 5.18 0.00 3.32 3.38 0.00 5.62 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 R 9.55 3.93 0.00 1.77 2.06 0.00 3.00 0.00 0.00 3.34 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.58 0.00 43 G 8.57 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 A 7.82 5.06 1.40 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 0.00 0.00 0.00 45 D 9.18 4.87 0.00 2.83 2.60 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 46 Q 9.15 4.73 0.00 2.12 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.85 0.00 0.00 0.00 0.00 0.00 2.12 1.67 0.00 47 W 9.53 4.98 0.00 3.44 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 48 L 9.11 5.19 0.00 1.74 1.55 0.97 0.55 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 49 F 9.32 5.35 0.00 3.30 3.04 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.75 4.17 1.90 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 0.81 0.00 0.00 0.82 0.00 0.00 51 V 8.63 3.77 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 0.85 0.00 0.00 1.07 0.00 0.00 52 D 8.05 4.34 0.00 2.79 2.42 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 53 G 9.27 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 0.00 0.00 0.00 54 A 8.05 4.90 1.18 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 0.00 0.00 55 G 8.50 4.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 9.11 5.25 0.00 1.97 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.25 0.00 57 A 9.01 5.21 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 58 I 8.92 4.93 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 1.11 0.81 0.92 0.00 0.00 59 V 8.81 4.58 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 0.96 0.00 0.00 0.93 0.00 0.00 60 D 9.66 4.57 0.00 2.85 2.72 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 0.00 0.00 0.00 61 G 8.22 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 62 H 8.11 4.57 0.00 3.40 3.24 0.00 5.78 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 T 8.29 5.13 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 1.24 0.00 0.00 64 Q 8.83 4.52 0.00 2.13 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.99 0.00 0.00 0.00 0.00 0.00 2.24 2.34 0.00 65 A 8.86 4.49 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 66 L 8.97 4.90 0.00 1.67 1.49 0.91 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 67 Q 9.16 4.96 0.00 2.03 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.98 0.00 0.00 0.00 0.00 0.00 2.21 2.13 0.00 68 A 8.39 4.15 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 G 8.35 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 0.00 0.00 0.00 70 S 7.91 4.27 0.00 3.71 3.76 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 0.00 0.00 0.00 71 L 8.64 5.35 0.00 1.93 1.69 1.39 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 72 I 9.12 4.46 1.83 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 1.15 0.61 0.84 0.00 0.00 73 A 8.30 3.84 -0.01 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 0.00 0.00 74 I 8.32 3.94 1.84 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 1.02 0.43 0.69 0.00 0.00 75 E 8.86 4.49 0.00 1.98 1.86 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 2.29 2.38 0.00 76 R 8.40 4.35 0.00 2.19 2.14 0.00 3.12 0.00 0.00 3.10 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.58 0.00 77 G 8.97 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 78 Q 7.77 4.49 0.00 2.01 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.76 0.00 0.00 0.00 0.00 0.00 2.46 2.45 0.00 79 A 8.96 4.56 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 H 9.23 5.50 0.00 3.16 3.32 0.00 5.21 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 E 9.41 5.09 0.00 1.93 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 2.18 2.34 0.00 82 I 8.85 4.81 1.90 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.01 0.92 0.00 0.00 83 R 9.09 4.95 0.00 1.68 1.80 0.00 3.25 0.00 0.00 3.09 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.53 0.00 84 N 9.06 4.94 0.00 2.77 2.78 0.00 0.00 6.55 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 85 T 8.80 4.13 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 1.21 0.00 0.00 86 G 8.15 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 87 D 8.60 4.96 0.00 2.75 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 88 T 7.49 4.81 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 89 P 0.00 4.51 0.00 1.95 2.02 0.00 3.66 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.08 0.00 90 L 8.79 4.56 0.00 1.75 1.55 0.89 0.49 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 91 K 8.82 4.96 0.00 1.74 1.71 0.00 1.66 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.37 1.36 7.81 92 T 8.53 5.28 4.33 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 1.20 0.00 0.00 93 V 8.69 4.61 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 1.13 0.00 0.00 0.58 0.00 0.00 94 N 8.57 5.35 0.00 2.66 2.30 0.00 0.00 6.78 7.74 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 95 F 9.15 5.05 0.00 2.91 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 96 Y 9.48 5.30 0.00 3.08 3.12 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 97 H 9.37 5.40 0.00 3.33 3.35 0.00 5.61 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 P 0.00 5.67 0.00 2.14 2.11 0.00 3.59 0.00 0.00 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.84 0.00 99 P 0.00 4.50 0.00 2.10 2.11 0.00 3.68 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.18 0.00 100 A 8.78 4.40 0.56 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 0.00 0.00 0.00 0.00 0.00 0.00 101 Y 7.60 4.95 0.00 2.91 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 0.00 102 D 8.97 4.75 0.00 2.88 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 0.00 103 A 8.42 4.18 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 0.00 104 Q 8.30 4.22 0.00 2.24 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.41 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00 105 G 8.16 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 0.00 106 E 8.47 4.62 0.00 2.35 1.89 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 2.32 2.44 0.00 107 P 0.00 4.26 0.00 1.93 1.74 0.00 3.69 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 1.99 2.09 0.00 108 L 8.12 4.23 0.00 1.64 1.53 0.91 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 109 P 0.00 4.42 0.00 2.14 2.10 0.00 3.84 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 2.10 2.05 0.00 110 A 8.03 4.01 1.27 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 0.00 0.00 0.00 0.00 0.00 111 G 7.60 3.51 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 0.00 0.00 0.00 112 E 7.73 4.22 0.00 2.19 1.84 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 2.28 2.39 0.00 113 G 8.42 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 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.