NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 G 3.8764 8.3549 109.7286 44.4240 0.0000 174.5457 4 P 3.9986 0.0000 0.0000 61.6724 32.6446 173.0227 5 E 3.7858 9.6249 126.0468 59.0054 30.9229 175.6681 6 Y 4.9952 7.2587 118.5012 56.4935 39.5113 175.0463 7 K 4.6443 9.7113 126.0619 55.9101 33.3441 176.4378 8 V 4.7890 8.9552 125.6087 61.1131 34.6362 174.2554 9 A 4.8187 8.7664 126.7904 50.2031 22.9928 174.9021 10 I 5.0837 8.4817 122.0179 59.4101 40.6069 174.2493 11 L 5.2349 9.1927 129.8077 53.7906 44.2101 174.9469 12 T 4.8711 8.8213 123.6280 62.1730 70.5992 173.8507 13 V 4.6726 8.2893 126.7217 61.4272 33.6835 174.8307 14 S 4.6144 8.8524 118.3646 56.9511 66.3791 176.7175 15 D 4.3823 9.4133 129.1471 58.0057 40.6950 178.7850 16 T 3.8571 7.9842 115.3722 67.1083 68.4866 176.5525 17 V 3.7955 7.9346 119.6633 66.0703 31.3551 178.0305 18 S 4.1834 8.1752 111.8688 60.6147 62.3447 175.0774 19 A 4.3247 8.0336 121.4817 51.9832 18.9846 178.1511 20 G 3.7967 7.9999 105.9037 45.6232 0.0000 174.7849 21 A 4.2771 7.9960 120.9114 51.8028 18.6574 177.4837 22 G 3.9056 7.0375 103.3878 45.0059 0.0000 171.0011 23 P 4.6467 0.0000 0.0000 61.0554 33.4878 173.8495 24 D 4.7680 8.4157 117.6162 52.9855 40.2662 175.7182 25 R 4.4183 8.4870 125.7815 56.7819 31.5497 178.4877 26 S 4.6955 8.3111 113.1315 60.3864 63.8375 176.1653 27 G 3.9987 9.3311 110.4101 47.4315 0.0000 173.9187 28 P 4.2840 0.0000 0.0000 65.0941 31.4113 178.5757 29 R 3.9052 7.5750 117.5288 58.9548 29.8592 178.8779 30 A 3.9537 7.9957 120.4856 55.2051 18.4618 179.6553 31 V 3.5070 8.0289 117.1518 66.4271 31.4297 178.2284 32 S 4.1006 8.2720 112.7454 61.2156 61.9997 176.1578 33 V 3.4791 7.9726 120.6590 65.8883 31.4631 177.8740 34 V 3.7406 8.0720 118.1418 66.1628 31.3523 177.4980 35 D 4.3428 8.1635 118.4964 57.5537 40.6020 178.6488 36 S 4.2369 8.6392 112.6028 60.3060 62.7211 175.1158 37 S 4.6716 7.9975 116.0211 58.5067 62.8029 175.2384 38 S 4.1162 8.2002 118.0147 62.0084 62.0062 175.3984 39 E 3.9305 8.2283 121.0102 59.4268 29.2245 178.7019 40 K 4.2291 7.9518 118.3977 58.8405 32.4155 177.9125 41 L 4.2705 7.8643 117.2225 55.0881 41.9112 177.3283 42 G 3.8254 8.4684 107.6801 45.4165 0.0000 170.2584 43 G 3.6974 10.3925 116.2907 44.6350 0.0000 173.4281 44 A 4.8409 8.9528 127.5348 50.2805 22.7349 175.0733 45 K 4.6585 8.9842 120.5629 54.8623 36.3269 175.1899 46 V 4.3947 7.7015 125.3685 62.5880 31.8456 175.9563 47 V 4.4856 8.3756 119.3013 60.7421 33.4284 175.3926 48 A 4.5955 7.3124 120.8035 51.1357 22.1607 175.5912 49 T 5.2665 8.4603 110.2993 60.4447 72.6545 172.2816 50 A 4.8139 8.8657 122.2997 51.2227 23.4501 175.0744 51 V 4.9051 8.2884 118.0308 61.4937 34.4729 174.9790 52 V 4.6951 8.4703 118.7950 59.0768 36.5698 173.0781 53 P 4.8712 0.0000 0.0000 62.2899 33.0443 176.8381 54 D 4.7487 10.0769 121.6353 53.2066 39.2391 175.0480 55 E 4.6243 7.9903 120.1047 53.7017 34.2557 176.5315 56 V 3.5815 8.7436 117.7702 64.7553 31.7093 178.3935 57 E 3.9471 8.1704 117.5810 59.6589 29.4315 179.6044 58 R 3.9369 7.9876 117.8160 58.8125 30.0454 179.2007 59 I 3.8014 7.4162 119.3396 63.9506 37.3460 177.8244 60 K 3.7845 8.4741 119.6188 59.8274 31.8679 178.5978 61 D 4.3455 8.0438 118.6022 57.7496 40.7764 179.4521 62 I 3.3099 7.0954 118.4096 64.2350 37.1269 178.4214 63 L 3.9658 7.7011 119.7292 57.8290 41.2849 179.7751 64 Q 3.9368 8.2441 118.2366 58.8820 28.7779 178.5050 65 K 3.8899 8.2167 120.8807 59.5478 31.7744 178.7803 66 W 4.5606 8.6238 119.1745 59.0746 28.7027 178.8087 67 S 4.2690 7.6565 115.7517 60.8157 62.7898 175.9809 68 D 4.5219 8.8544 121.1649 56.3439 40.6939 177.5304 69 V 4.1284 7.7221 117.2375 64.6610 32.4895 176.5447 70 D 4.5033 8.1843 116.1439 54.1308 41.2857 173.6376 71 E 3.6448 7.3901 122.8619 56.3202 29.9403 174.2548 *73 D 4.7526 8.3494 120.3224 53.9814 44.1697 175.1468 74 L 4.9350 7.8798 120.8462 53.7625 45.8283 174.6870 75 I 5.1027 9.0313 127.6065 59.5893 40.2991 174.3982 76 L 5.3414 8.8566 127.4915 53.2372 44.0275 175.9285 77 T 5.1607 8.6550 113.3503 60.1147 72.2479 173.3013 78 L 4.8593 8.5102 121.9335 54.2113 45.4067 177.9512 79 G 4.1008 9.0575 108.8293 46.5877 0.0000 173.0482 80 G 4.3849 8.9530 103.8323 46.6809 0.0000 174.7930 81 T 4.6120 7.8413 107.4679 60.9984 69.9629 174.5638 82 G 4.3089 7.6429 113.2508 46.6384 0.0000 173.7970 83 F 4.5445 8.8785 117.4986 58.0609 40.3304 176.4652 84 T 4.0826 8.0002 117.8356 63.1773 68.8001 173.3388 85 P 4.3308 0.0000 0.0000 65.6254 31.5885 178.3723 86 R 4.0055 7.8790 115.9507 58.4132 30.5361 176.2980 87 D 4.4801 7.9644 118.5161 54.8003 40.7968 176.9943 88 V 4.6261 8.0621 115.2799 59.8214 34.2346 177.6082 89 T 3.8832 8.9061 121.3627 66.3352 68.0429 174.8738 90 P 4.2926 0.0000 0.0000 65.4560 31.1657 178.4174 91 E 3.9105 8.1943 116.8632 59.3296 29.2180 179.1844 92 A 3.9999 8.0654 120.8213 55.2748 18.4985 179.7263 93 T 3.7989 8.4691 114.5878 66.8910 68.3454 176.7708 94 K 4.0332 8.0422 119.1272 59.5350 32.1583 178.8203 95 K 4.2390 7.7327 116.4229 57.7915 32.1245 177.7708 96 V 4.3627 7.9679 111.0889 60.6314 33.7042 176.0372 97 I 4.1279 7.6256 112.6573 60.7193 38.3520 175.0460 98 E 4.6637 9.5167 120.6223 56.7004 32.1685 177.0647 99 R 4.6402 7.6893 117.7437 54.4460 34.1240 175.0816 100 E 4.6566 8.9165 123.4526 55.6464 31.2399 176.9240 101 T 4.6498 7.8831 109.0344 58.5937 68.6119 173.0222 102 P 4.5011 0.0000 0.0000 66.2018 31.7380 178.8155 103 G 3.7241 8.0630 105.7363 47.5989 0.0000 175.6058 104 L 4.0646 7.7419 120.5602 57.7825 41.7519 179.2967 105 L 4.1700 7.8005 117.2744 57.5287 41.6735 178.8230 106 F 4.1860 8.5657 120.3168 60.5828 40.9255 177.3250 107 V 4.0131 8.2524 120.1168 63.3916 27.6495 175.3068 *110 Q 4.1408 7.9616 123.0347 55.5448 31.6868 176.7655 111 E 3.9854 8.3469 116.6357 59.5907 29.8259 179.7647 112 S 4.2828 8.0043 113.0176 60.7471 63.2605 175.7235 113 L 4.3487 8.1023 122.5452 56.4351 41.2163 178.2656 114 K 4.1611 7.7899 117.3125 57.4515 32.3614 178.0377 115 I 4.1401 7.1935 119.3898 62.4742 38.4106 175.7728 116 T 4.4802 6.7315 108.3696 60.3800 70.5714 172.3258 117 P 4.1394 0.0000 0.0000 65.5483 31.4167 177.8446 118 F 4.0391 7.9125 115.3688 59.1296 39.5308 176.0365 119 A 4.2283 7.8015 126.7791 52.1019 16.3448 178.6141 *121 L 4.1364 7.6250 120.3275 53.9293 44.0707 177.5972 122 S 4.5105 8.0133 114.4818 58.3018 62.7808 174.1515 123 R 4.7328 8.5436 126.9754 55.5208 30.6893 176.4323 124 S 4.3590 8.0126 113.3425 59.2697 63.6654 174.0553 125 A 4.9481 8.2731 123.3668 50.4813 23.0454 174.6201 126 A 4.7842 7.5491 117.2889 51.1607 22.6292 175.9604 127 G 3.9898 8.2331 107.3127 46.5076 0.0000 171.7272 128 I 4.9950 8.4592 121.0076 59.6914 39.7193 175.4617 129 R 4.8485 8.7340 125.8060 54.8875 33.2873 175.4305 130 G 3.9506 9.1123 116.1402 47.0714 0.0000 174.0890 131 S 4.7265 9.0762 114.1213 57.8258 62.9401 173.0420 132 T 4.7005 8.3497 118.6787 62.4933 70.4887 173.5260 133 L 4.5399 8.6084 129.4093 54.6609 43.6518 175.2983 134 I 5.0662 8.8012 127.1209 59.5995 40.3880 174.5912 135 I 4.9045 8.5944 126.7208 59.6662 40.6400 175.3677 136 N 5.5629 8.5565 124.4657 51.1316 40.1761 172.7503 *138 P 4.2176 0.0000 0.0000 62.1172 32.4551 177.4368 139 G 3.8463 8.7913 109.8584 48.6071 0.0000 174.2170 140 N 4.3777 8.1631 116.9382 52.8812 39.0592 174.1726 141 P 4.2772 0.0000 0.0000 65.6464 31.8123 178.1389 142 N 4.5168 8.1958 114.9071 55.2547 38.5056 176.8483 143 A 3.9882 7.5296 122.9914 55.6278 18.2095 179.9693 144 V 3.6788 7.7970 113.8514 65.7027 31.6060 177.7541 145 A 4.1419 7.9079 120.3757 55.1173 18.3988 179.1918 146 E 4.1315 8.0141 115.2364 59.6601 29.9512 179.9084 147 C 4.0794 8.2269 113.9972 60.7525 28.0285 175.2242 *149 E 4.2315 8.1719 123.1021 56.1023 30.9431 177.3460 150 A 4.1914 7.9480 119.8934 54.4265 18.7095 178.8125 151 L 4.2939 7.7788 116.4865 56.6548 42.1331 178.4633 152 L 4.0860 8.0568 119.2587 57.8058 41.8903 176.8615 153 P 4.4433 0.0000 0.0000 64.4017 31.6128 176.4408 154 A 4.6812 8.5488 118.0047 50.4365 21.0128 177.4744 155 L 4.2677 7.9012 117.1648 57.2139 42.0335 178.6642 156 K 3.8777 7.9124 119.6114 59.9361 32.3162 177.9986 157 H 4.2293 8.2665 117.7689 59.0384 29.5326 176.7210 158 A 3.9067 8.1744 122.2063 55.4135 18.6681 179.4244 159 L 3.8955 7.8564 117.2857 57.3963 41.2921 179.6400 160 K 4.0649 7.7607 119.0458 59.7530 32.2939 178.7415 161 Q 4.0174 8.1212 119.3559 59.1498 28.5940 177.2394 *162 I 3.9656 7.2588 121.5376 59.9824 36.2972 179.8535 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 3 G 8.35 3.88 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 0.00 0.00 0.00 4 P 0.00 4.00 0.00 2.10 2.00 0.00 3.65 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 2.10 0.00 5 E 9.62 3.79 0.00 1.68 1.44 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 1.58 2.06 0.00 6 Y 7.26 5.00 0.00 3.15 2.82 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 0.00 7 K 9.71 4.64 0.00 1.80 1.69 0.00 1.58 0.00 0.00 1.53 0.00 0.00 2.75 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.42 1.38 7.81 8 V 8.96 4.79 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 1.07 0.00 0.00 1.04 0.00 0.00 9 A 8.77 4.82 0.25 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 10 I 8.48 5.08 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 1.14 1.03 0.97 0.00 0.00 11 L 9.19 5.23 0.00 1.87 1.61 0.83 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 12 T 8.82 4.87 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 13 V 8.29 4.67 2.33 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 0.80 0.00 0.00 0.92 0.00 0.00 14 S 8.85 4.61 0.00 3.89 3.66 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 15 D 9.41 4.38 0.00 2.67 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 16 T 7.98 3.86 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 17 V 7.93 3.80 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 1.00 0.00 0.00 0.95 0.00 0.00 18 S 8.18 4.18 0.00 3.83 3.99 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 0.00 0.00 0.00 19 A 8.03 4.32 1.35 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 0.00 0.00 0.00 0.00 0.00 0.00 20 G 8.00 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 21 A 8.00 4.28 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 22 G 7.04 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 0.00 0.00 0.00 23 P 0.00 4.65 0.00 2.18 2.09 0.00 3.73 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 1.91 1.93 0.00 24 D 8.42 4.77 0.00 2.65 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 25 R 8.49 4.42 0.00 1.91 1.94 0.00 3.16 0.00 0.00 3.39 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.60 0.00 26 S 8.31 4.70 0.00 4.05 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 0.00 27 G 9.33 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.28 0.00 2.28 2.33 0.00 3.74 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.06 0.00 29 R 7.57 3.91 0.00 1.95 2.03 0.00 3.29 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.80 0.00 30 A 8.00 3.95 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 31 V 8.03 3.51 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 0.98 0.00 0.00 0.93 0.00 0.00 32 S 8.27 4.10 0.00 3.94 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 33 V 7.97 3.48 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 0.86 0.00 0.00 0.97 0.00 0.00 34 V 8.07 3.74 2.24 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 1.06 0.00 0.00 1.00 0.00 0.00 35 D 8.16 4.34 0.00 3.00 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 36 S 8.64 4.24 0.00 3.82 4.09 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 37 S 8.00 4.67 0.00 4.12 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 38 S 8.20 4.12 0.00 3.98 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 39 E 8.23 3.93 0.00 2.08 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 0.00 2.39 2.41 0.00 40 K 7.95 4.23 0.00 1.80 1.88 0.00 1.80 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.48 7.81 41 L 7.86 4.27 0.00 1.95 1.80 0.94 0.85 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 42 G 8.47 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 43 G 10.39 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 44 A 8.95 4.84 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 45 K 8.98 4.66 0.00 1.76 1.58 0.00 1.61 0.00 0.00 1.55 0.00 0.00 2.77 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.31 1.37 7.81 46 V 7.70 4.39 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 0.77 0.00 0.00 0.92 0.00 0.00 47 V 8.38 4.49 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 0.82 0.00 0.00 48 A 7.31 4.60 0.81 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 0.00 0.00 49 T 8.46 5.27 4.38 0.00 0.00 0.00 0.00 0.00 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 50 A 8.87 4.81 1.44 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 51 V 8.29 4.91 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 0.96 0.00 0.00 52 V 8.47 4.70 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 0.61 0.00 0.00 0.92 0.00 0.00 53 P 0.00 4.87 0.00 2.11 2.06 0.00 3.73 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 1.96 1.98 0.00 54 D 10.08 4.75 0.00 2.48 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 55 E 7.99 4.62 0.00 1.95 1.77 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 2.28 2.31 0.00 56 V 8.74 3.58 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 0.85 0.00 0.00 0.91 0.00 0.00 57 E 8.17 3.95 0.00 1.95 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 2.38 2.33 0.00 58 R 7.99 3.94 0.00 1.92 1.92 0.00 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0.00 *138 P 0.00 4.22 0.00 2.08 2.04 0.00 3.71 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.11 0.00 139 G 8.79 3.85 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 0.00 0.00 0.00 140 N 8.16 4.38 0.00 2.77 2.77 0.00 0.00 7.17 8.03 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 0.00 141 P 0.00 4.28 0.00 2.04 2.12 0.00 3.67 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.11 0.00 142 N 8.20 4.52 0.00 2.74 2.86 0.00 0.00 7.00 7.37 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 0.00 143 A 7.53 3.99 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 0.00 144 V 7.80 3.68 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 0.90 0.00 0.00 0.95 0.00 0.00 145 A 7.91 4.14 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 E 8.01 4.13 0.00 2.07 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 2.32 2.41 0.00 147 C 8.23 4.08 0.00 3.00 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 *149 E 8.17 4.23 0.00 2.06 2.22 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 2.20 2.33 0.00 150 A 7.95 4.19 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 L 7.78 4.29 0.00 1.70 1.72 0.93 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 152 L 8.06 4.09 0.00 1.62 1.73 0.93 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 153 P 0.00 4.44 0.00 2.07 2.11 0.00 3.81 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 2.04 2.16 0.00 154 A 8.55 4.68 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 0.00 155 L 7.90 4.27 0.00 1.93 1.66 0.88 0.53 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 0.00 156 K 7.91 3.88 0.00 2.05 1.81 0.00 1.98 0.00 0.00 1.78 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.57 1.59 7.81 157 H 8.27 4.23 0.00 3.27 3.30 0.00 5.93 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 A 8.17 3.91 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 0.00 159 L 7.86 3.90 0.00 0.93 0.83 0.41 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 160 K 7.76 4.06 0.00 1.98 2.03 0.00 1.89 0.00 0.00 1.80 0.00 0.00 3.07 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.52 1.60 7.81 161 Q 8.12 4.02 0.00 2.09 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.78 6.32 0.00 0.00 0.00 0.00 0.00 2.31 2.32 0.00 *162 I 7.26 3.97 1.95 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 1.13 0.69 0.94 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.