NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 56 S 4.3193 8.3344 115.4040 57.5534 64.4596 173.4555 57 S 3.9598 8.0353 115.1793 57.1671 62.5082 172.6490 58 P 4.3454 0.0000 0.0000 64.8310 32.2964 176.6258 59 G 4.0867 8.0998 107.5361 45.3666 0.0000 172.4558 60 I 4.7969 7.2716 121.0569 59.5990 38.8158 174.8805 61 W 4.9870 9.3802 127.0106 54.8132 32.9600 174.1282 62 Q 5.0660 9.2578 124.6964 54.4660 30.8066 173.9841 63 L 5.3761 8.9166 126.9336 53.3082 43.8202 175.1570 64 D 5.1691 9.1615 122.4920 52.6485 45.5327 173.2821 65 C 5.3741 8.5571 113.6145 56.8038 32.8680 173.2564 66 T 4.7486 8.9029 113.9482 61.0510 70.9758 171.9678 67 H 5.4215 8.6963 123.0322 54.1015 32.0126 173.3186 68 L 4.4244 8.8486 122.9402 55.2667 45.2393 175.0918 69 E 3.8873 9.9102 124.1570 57.4416 27.1282 175.2092 70 G 3.9178 8.4972 103.0704 46.0617 0.0000 174.1079 71 K 4.6186 8.2487 118.7690 54.1345 35.1514 174.9374 72 V 4.5395 7.7358 120.3798 61.3988 33.6301 174.4231 73 I 4.7429 8.8421 129.4641 59.5631 39.2092 174.4495 74 L 4.4995 8.4911 130.6642 54.1148 43.2756 175.3882 75 V 5.0327 8.8129 126.4539 61.0115 34.4932 173.7881 76 A 5.4456 9.6288 129.5773 50.2418 21.8779 175.0599 77 V 4.6977 9.1680 123.1095 61.0928 34.3964 174.1423 78 H 3.3057 8.7101 129.0808 55.4752 28.2556 175.6226 79 V 3.4505 7.8092 127.2969 66.0705 31.6566 178.3563 80 A 4.1547 7.5846 121.7063 54.0079 18.4296 177.9048 81 S 4.4381 7.2810 108.1604 57.4348 64.8071 175.5926 82 G 3.9036 8.3576 108.6719 44.9456 0.0000 172.9213 83 Y 4.4482 7.7545 122.2420 57.6947 39.7887 174.8940 84 I 5.1959 8.1600 118.8701 59.1476 40.9384 174.4246 85 E 4.9791 9.2582 122.2299 54.9696 33.3152 174.7375 86 A 5.4292 8.4947 122.2645 51.2191 22.5743 175.2748 87 E 4.8511 9.1541 118.1316 54.7307 34.5855 174.7017 88 V 4.7307 8.4438 122.3062 61.8744 32.3746 175.0595 89 I 4.6851 8.6718 120.8143 58.4089 40.6570 174.8582 90 P 4.0122 0.0000 0.0000 65.5825 31.4455 176.6772 91 A 4.5080 7.2129 116.5727 51.3254 21.8549 176.6151 92 E 4.2206 8.5383 120.8586 55.7691 27.7189 177.0370 93 T 4.5995 7.3440 113.0986 59.5226 72.8898 175.9012 94 G 3.6099 8.3778 108.1679 48.2783 0.0000 175.8841 95 Q 4.0320 7.9803 120.3596 58.5693 28.7473 178.7668 96 E 4.0192 7.9853 119.3593 59.7272 29.5755 179.4297 97 T 3.8329 8.0186 115.5999 66.7124 68.5000 176.5923 98 A 4.1037 8.4803 123.0528 55.1878 18.3468 179.1296 99 Y 4.0865 8.1356 118.2590 60.6989 38.9014 177.6953 100 F 4.0178 8.5618 121.7282 61.3722 39.4188 177.1745 101 L 4.0025 8.2789 118.6253 57.6351 41.4719 179.2419 102 L 3.9355 7.9384 120.3818 57.9128 41.7638 179.2188 103 K 3.7125 7.4005 117.5651 59.1276 32.2698 178.6509 104 L 3.8087 7.5118 120.2730 58.1955 41.7471 179.0467 105 A 4.1979 7.9856 119.2845 54.7068 18.3288 179.3621 106 G 3.6567 7.6545 102.7671 46.6591 0.0000 174.5934 107 R 4.2478 7.6196 117.9423 55.7975 32.1532 176.0157 108 W 5.2388 7.4877 115.2056 54.1584 33.0819 174.2716 109 P 4.5488 0.0000 0.0000 62.5104 28.5031 174.3788 110 V 4.1228 7.8374 119.5507 62.0069 32.0452 175.2149 111 K 4.3952 9.1939 129.7875 58.4783 33.6265 176.5049 112 T 5.2612 7.8966 115.0748 61.7763 73.1023 173.2374 113 V 4.9921 8.7817 118.3416 59.9744 35.1317 174.2981 114 H 5.3746 9.2974 123.6188 54.9895 30.4236 174.5930 115 T 4.6187 8.2924 112.6563 59.2008 72.1691 174.1159 116 D 4.6070 8.4559 119.5214 53.0934 39.4628 175.7040 117 N 4.2204 8.3119 116.4420 54.5795 38.1634 174.3540 118 G 4.0202 8.4873 105.1740 44.7070 0.0000 175.4884 119 S 4.2727 8.9202 116.2825 60.6716 62.5356 176.3588 120 N 4.2774 8.0299 119.4266 55.5325 36.9781 176.4180 121 F 4.5805 7.8945 119.0513 59.3055 39.3913 177.2412 122 T 4.2936 7.7203 107.3586 61.8194 69.4520 175.0529 123 S 4.3760 7.3886 117.2367 58.5577 63.9267 175.4252 124 T 4.0016 8.4570 118.8158 66.8595 68.3239 177.2669 125 T 3.8628 7.8850 117.5665 66.6334 68.4933 176.6013 126 V 3.6707 7.4826 118.6787 65.9973 31.6181 178.2809 127 K 4.1860 8.0868 117.6310 59.4312 31.8457 179.2324 128 A 4.0954 8.3971 121.1257 54.8490 18.1849 179.6001 129 A 4.0231 8.0218 119.0757 55.6684 18.4821 179.6447 130 C 4.1756 8.3603 115.3098 63.0583 28.0218 176.2206 131 D 4.3636 8.2777 120.5498 57.0966 40.2326 178.5379 132 W 4.0602 8.2677 127.4546 60.2272 30.8778 177.1041 133 A 4.4054 8.5239 117.7411 51.4956 18.5192 177.1674 134 G 3.7566 7.6355 105.2550 46.5203 0.0000 173.6150 135 I 4.5067 8.1662 120.6664 59.2386 38.8850 175.8935 136 K 4.2037 9.0868 129.5395 55.9675 32.9678 175.3263 137 Q 4.5291 8.6975 129.9534 55.5181 30.1612 174.9846 138 E 4.5955 9.5094 127.0342 54.6036 31.2863 174.3056 139 D 4.5868 8.5210 124.1273 54.5954 41.8470 177.1561 140 G 3.8008 8.9886 111.1842 45.4063 0.0000 173.2131 141 I 4.0599 7.2313 120.5772 59.2325 37.3088 174.1156 142 P 4.3368 0.0000 0.0000 62.2928 31.8335 176.4747 *152 E 4.2238 8.4377 119.8273 56.0087 31.3822 176.7722 153 S 4.4320 7.8185 111.1433 59.6204 62.5277 174.8830 154 M 4.0155 7.8474 120.7595 59.6463 32.2189 177.6057 155 N 4.4488 8.1089 116.1246 56.0584 38.7148 177.2058 156 K 3.9704 7.9624 120.8461 59.1817 32.4025 178.3949 157 E 3.9020 7.9591 119.2478 59.2028 29.6707 178.5199 158 L 3.9538 8.2746 120.7318 58.1643 42.1776 178.9664 159 K 3.9663 7.9917 118.3739 59.2535 31.7422 179.0891 160 K 3.8740 7.8685 118.7147 59.7050 32.4526 178.5561 161 I 4.1316 7.7230 121.1993 64.0345 36.5240 178.2865 162 I 3.8355 8.4228 121.1193 64.6078 35.4493 178.6596 163 G 3.6442 8.0478 106.3871 47.8441 0.0000 175.6480 164 Q 4.1581 8.2350 119.6314 57.4120 28.6965 177.7284 165 V 4.4427 7.0959 111.3452 60.6711 33.0156 177.4149 166 R 3.8491 7.8492 121.4823 59.2482 29.9874 177.3584 167 D 4.7221 8.0327 114.2405 53.8381 39.5247 176.4107 168 Q 4.4012 8.1004 117.7741 55.8430 29.5507 175.2497 169 A 4.7794 7.3480 120.7044 49.9925 21.6938 176.3809 170 E 4.0467 8.8838 121.6221 58.7188 30.0953 177.2450 171 H 5.0474 7.6764 114.1331 53.0673 32.3541 174.0464 172 L 3.9711 8.7820 124.2375 58.4630 41.7622 179.5880 173 K 3.9516 8.1364 118.0025 60.4025 32.2848 179.1092 174 T 3.8590 7.8826 116.1401 66.4552 68.4055 176.5572 175 A 4.0293 8.0030 122.2043 54.9765 18.2965 179.6526 176 V 3.5527 8.1599 117.1753 66.4450 31.5812 178.3814 177 Q 4.0630 7.9731 117.3250 59.2170 28.4708 178.6334 178 M 4.0538 8.2033 119.6270 58.3299 31.9320 178.6899 179 A 4.0489 8.2769 121.0513 55.0349 18.5632 179.8681 180 V 3.5476 8.0987 117.0866 65.9900 31.5485 177.8812 181 F 4.1381 8.6738 120.7785 61.5695 39.1111 177.1452 182 I 3.8914 8.2786 119.3808 64.6781 36.7004 177.8818 183 H 4.1123 8.2343 117.8846 59.5318 30.0748 176.8904 184 N 4.4669 8.4257 117.7010 55.6861 38.1757 176.3105 185 H 4.5861 7.6839 115.4275 54.9473 29.8060 175.1861 186 K 4.0711 7.3411 124.2689 56.2374 33.0654 175.8411 187 R 4.3681 8.6636 128.7682 56.1949 30.9285 175.0967 188 K 4.3627 9.0798 128.2311 55.4731 34.5430 176.6420 189 G 3.9001 8.6902 114.6392 46.0246 0.0000 174.2776 190 G 3.8994 8.1232 106.3948 44.1072 0.0000 174.8655 191 I 3.5365 8.2659 118.0055 63.6888 37.7410 176.6790 192 G 3.7037 7.9413 106.7178 46.2922 0.0000 173.8668 193 G 4.2968 7.5327 107.8782 45.0331 0.0000 172.5739 194 Y 5.2046 8.4014 115.9386 56.1207 42.8298 175.2916 195 S 5.3126 9.5547 115.9554 56.8268 64.8993 175.1234 196 A 4.0749 8.7835 122.1098 55.3784 17.9682 180.1384 197 G 3.6732 8.2757 104.0858 48.1487 0.0000 175.8464 198 E 4.1352 8.1358 120.7084 59.0816 29.4885 179.6703 199 R 3.7889 8.2991 118.4967 59.0787 30.0453 178.8956 200 I 3.3981 7.8912 118.7082 64.2088 37.9020 178.4540 201 V 3.6885 7.3491 111.8211 64.3494 31.1115 178.0990 202 D 4.2795 7.8657 117.2085 57.1912 41.0564 177.9875 203 I 3.9112 7.4235 119.7133 63.8668 37.3194 177.7494 204 I 4.0368 7.8338 119.3470 61.9942 37.6325 176.6385 205 A 4.0578 7.5655 122.6897 52.9919 18.5477 177.2168 206 T 4.4241 8.4310 111.2391 62.2891 70.2787 175.0213 207 D 4.6135 7.5772 120.8260 53.0675 42.3821 175.0805 208 I 4.0039 7.9748 122.9522 61.2402 37.2686 176.0452 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 56 S 8.33 4.32 0.00 3.92 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 57 S 8.04 3.96 0.00 3.94 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 58 P 0.00 4.35 0.00 2.24 2.16 0.00 3.79 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 2.00 1.96 0.00 59 G 8.10 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 0.00 0.00 0.00 60 I 7.27 4.80 1.73 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.42 0.68 0.00 0.00 61 W 9.38 4.99 0.00 3.23 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 62 Q 9.26 5.07 0.00 2.13 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.78 0.00 0.00 0.00 0.00 0.00 2.28 2.38 0.00 63 L 8.92 5.38 0.00 1.55 1.75 1.16 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 64 D 9.16 5.17 0.00 2.77 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 C 8.56 5.37 0.00 2.87 2.83 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 66 T 8.90 4.75 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 1.19 0.00 0.00 67 H 8.70 5.42 0.00 3.04 3.17 0.00 5.77 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 68 L 8.85 4.42 0.00 1.70 1.46 0.93 0.99 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 69 E 9.91 3.89 0.00 2.14 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 0.00 2.23 2.29 0.00 70 G 8.50 3.92 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 0.00 0.00 0.00 71 K 8.25 4.62 0.00 1.80 1.69 0.00 1.66 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.51 1.48 7.81 72 V 7.74 4.54 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 0.93 0.00 0.00 0.97 0.00 0.00 73 I 8.84 4.74 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 1.11 0.58 0.91 0.00 0.00 74 L 8.49 4.50 0.00 1.44 0.88 0.78 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 75 V 8.81 5.03 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 1.03 0.00 0.00 0.93 0.00 0.00 76 A 9.63 5.45 1.58 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 0.00 0.00 77 V 9.17 4.70 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 0.90 0.00 0.00 0.97 0.00 0.00 78 H 8.71 3.31 0.00 1.40 2.50 0.00 5.65 0.00 0.00 0.00 0.00 6.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 V 7.81 3.45 1.85 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 0.75 0.00 0.00 0.81 0.00 0.00 80 A 7.58 4.15 1.07 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 0.00 0.00 81 S 7.28 4.44 0.00 3.99 3.87 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 82 G 8.36 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 0.00 0.00 0.00 83 Y 7.75 4.45 0.00 3.12 2.52 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.16 5.20 1.84 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.73 0.86 0.00 0.00 85 E 9.26 4.98 0.00 2.04 1.92 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 2.49 2.60 0.00 86 A 8.49 5.43 1.28 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 0.00 0.00 87 E 9.15 4.85 0.00 2.05 1.92 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 2.54 2.81 0.00 88 V 8.44 4.73 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 0.81 0.00 0.00 0.95 0.00 0.00 89 I 8.67 4.69 1.86 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.75 0.92 0.00 0.00 90 P 0.00 4.01 0.00 2.04 2.14 0.00 3.70 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 2.01 2.07 0.00 91 A 7.21 4.51 1.17 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 92 E 8.54 4.22 0.00 1.94 1.85 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 2.19 2.23 0.00 93 T 7.34 4.60 4.32 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 1.18 0.00 0.00 94 G 8.38 3.61 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 0.00 0.00 0.00 95 Q 7.98 4.03 0.00 2.12 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.87 0.00 0.00 0.00 0.00 0.00 2.42 2.49 0.00 96 E 7.99 4.02 0.00 2.05 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 0.00 2.31 2.60 0.00 97 T 8.02 3.83 4.21 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 0.92 0.00 0.00 98 A 8.48 4.10 1.37 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 99 Y 8.14 4.09 0.00 3.19 3.19 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 0.00 100 F 8.56 4.02 0.00 3.27 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 0.00 101 L 8.28 4.00 0.00 1.98 1.76 1.14 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 102 L 7.94 3.94 0.00 1.78 1.71 0.85 0.16 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 0.00 103 K 7.40 3.71 0.00 1.53 1.57 0.00 1.56 0.00 0.00 1.26 0.00 0.00 2.58 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.05 0.74 7.81 104 L 7.51 3.81 0.00 1.25 1.49 0.34 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 105 A 7.99 4.20 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 0.00 106 G 7.65 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 0.00 0.00 0.00 107 R 7.62 4.25 0.00 1.57 1.45 0.00 3.10 0.00 0.00 3.12 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.38 0.00 108 W 7.49 5.24 0.00 3.08 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 0.00 109 P 0.00 4.55 0.00 2.17 2.10 0.00 4.09 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.16 0.00 110 V 7.84 4.12 2.04 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 0.75 0.00 0.00 0.57 0.00 0.00 111 K 9.19 4.40 0.00 2.03 1.95 0.00 1.74 0.00 0.00 1.65 0.00 0.00 2.74 0.00 0.00 2.62 0.00 0.00 0.00 0.00 1.38 1.28 7.81 112 T 7.90 5.26 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 1.33 0.00 0.00 113 V 8.78 4.99 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 0.82 0.00 0.00 0.98 0.00 0.00 114 H 9.30 5.37 0.00 3.16 3.33 0.00 5.57 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 T 8.29 4.62 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 0.67 0.00 0.00 116 D 8.46 4.61 0.00 2.83 2.83 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 0.00 117 N 8.31 4.22 0.00 2.91 2.93 0.00 0.00 7.04 7.78 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 0.00 118 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 0.00 119 S 8.92 4.27 0.00 4.06 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 0.00 120 N 8.03 4.28 0.00 2.55 3.02 0.00 0.00 6.03 7.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 F 7.89 4.58 0.00 3.25 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 0.00 122 T 7.72 4.29 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 1.33 0.00 0.00 123 S 7.39 4.38 0.00 4.02 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 0.00 124 T 8.46 4.00 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 1.23 0.00 0.00 125 T 7.89 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 0.00 126 V 7.48 3.67 2.27 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 1.27 0.00 0.00 1.03 0.00 0.00 127 K 8.09 4.19 0.00 1.93 1.90 0.00 1.77 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.74 1.75 7.81 128 A 8.40 4.10 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 A 8.02 4.02 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 0.00 130 C 8.36 4.18 0.00 3.22 3.29 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 0.00 131 D 8.28 4.36 0.00 3.00 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 0.00 132 W 8.27 4.06 0.00 3.40 3.41 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 0.00 133 A 8.52 4.41 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 G 7.64 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 0.00 0.00 0.00 135 I 8.17 4.51 1.94 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 1.32 0.69 0.97 0.00 0.00 136 K 9.09 4.20 0.00 1.85 1.86 0.00 1.64 0.00 0.00 1.59 0.00 0.00 3.00 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.58 1.41 7.81 137 Q 8.70 4.53 0.00 2.17 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.98 6.78 0.00 0.00 0.00 0.00 0.00 2.44 2.42 0.00 138 E 9.51 4.60 0.00 2.01 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 0.00 2.23 2.45 0.00 139 D 8.52 4.59 0.00 2.56 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 0.00 140 G 8.99 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 0.00 141 I 7.23 4.06 1.64 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 1.28 0.40 0.60 0.00 0.00 142 P 0.00 4.34 0.00 2.02 1.96 0.00 3.67 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.04 0.00 *152 E 8.44 4.22 0.00 1.95 2.01 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 2.19 2.31 0.00 153 S 7.82 4.43 0.00 3.93 3.81 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 0.00 154 M 7.85 4.02 0.00 2.16 2.02 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.65 0.00 155 N 8.11 4.45 0.00 2.78 2.86 0.00 0.00 6.73 6.97 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 0.00 156 K 7.96 3.97 0.00 1.82 1.96 0.00 1.73 0.00 0.00 1.75 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.51 1.50 7.81 157 E 7.96 3.90 0.00 2.24 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 0.00 2.36 2.39 0.00 158 L 8.27 3.95 0.00 1.73 1.64 0.92 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 159 K 7.99 3.97 0.00 2.09 1.86 0.00 1.74 0.00 0.00 1.58 0.00 0.00 2.96 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.47 1.57 7.81 160 K 7.87 3.87 0.00 1.77 2.06 0.00 1.82 0.00 0.00 1.72 0.00 0.00 3.19 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.47 1.50 7.81 161 I 7.72 4.13 2.02 0.00 0.00 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 1.57 1.13 1.01 0.00 0.00 162 I 8.42 3.84 2.03 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 1.47 1.17 0.92 0.00 0.00 163 G 8.05 3.64 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 0.00 0.00 0.00 164 Q 8.23 4.16 0.00 2.29 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.61 0.00 0.00 0.00 0.00 0.00 2.39 2.54 0.00 165 V 7.10 4.44 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 0.73 0.00 0.00 1.01 0.00 0.00 166 R 7.85 3.85 0.00 2.16 1.93 0.00 3.14 0.00 0.00 3.23 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 167 D 8.03 4.72 0.00 2.80 2.75 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 0.00 168 Q 8.10 4.40 0.00 2.19 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.63 0.00 0.00 0.00 0.00 0.00 2.29 2.27 0.00 169 A 7.35 4.78 1.25 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 0.00 170 E 8.88 4.05 0.00 1.79 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 2.26 2.22 0.00 171 H 7.68 5.05 0.00 3.16 3.14 0.00 5.64 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 L 8.78 3.97 0.00 1.93 1.70 0.93 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 173 K 8.14 3.95 0.00 2.05 2.09 0.00 1.57 0.00 0.00 1.84 0.00 0.00 2.97 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.53 1.57 7.81 174 T 7.88 3.86 4.42 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 1.21 0.00 0.00 175 A 8.00 4.03 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 0.00 176 V 8.16 3.55 2.28 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 1.14 0.00 0.00 1.03 0.00 0.00 177 Q 7.97 4.06 0.00 2.14 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.57 0.00 0.00 0.00 0.00 0.00 2.65 2.60 0.00 178 M 8.20 4.05 0.00 2.05 2.25 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.47 0.00 179 A 8.28 4.05 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 0.00 180 V 8.10 3.55 2.31 0.00 0.00 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 1.04 0.00 0.00 181 F 8.67 4.14 0.00 3.30 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 0.00 182 I 8.28 3.89 2.11 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.57 0.99 0.00 0.00 183 H 8.23 4.11 0.00 3.14 3.49 0.00 5.95 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 0.00 184 N 8.43 4.47 0.00 2.74 2.86 0.00 0.00 7.02 7.51 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 0.00 185 H 7.68 4.59 0.00 2.98 3.27 0.00 5.86 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 186 K 7.34 4.07 0.00 1.96 1.78 0.00 1.64 0.00 0.00 1.56 0.00 0.00 2.76 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.42 1.39 7.81 187 R 8.66 4.37 0.00 1.84 1.81 0.00 3.20 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 1.70 1.56 0.00 188 K 9.08 4.36 0.00 1.87 1.74 0.00 1.69 0.00 0.00 1.65 0.00 0.00 2.82 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.35 1.37 7.81 189 G 8.69 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 0.00 0.00 0.00 190 G 8.12 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 0.00 0.00 0.00 191 I 8.27 3.54 1.84 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 1.32 0.68 0.88 0.00 0.00 192 G 7.94 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 0.00 193 G 7.53 4.30 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 0.00 0.00 0.00 0.00 0.00 0.00 194 Y 8.40 5.20 0.00 2.82 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 0.00 195 S 9.55 5.31 0.00 4.06 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 0.00 196 A 8.78 4.07 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 0.00 197 G 8.28 3.67 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 0.00 198 E 8.14 4.14 0.00 2.32 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 0.00 2.40 2.39 0.00 199 R 8.30 3.79 0.00 1.94 1.90 0.00 3.13 0.00 0.00 3.07 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.76 0.00 200 I 7.89 3.40 1.37 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 0.67 0.73 0.35 0.00 0.00 201 V 7.35 3.69 2.12 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 0.83 0.00 0.00 1.02 0.00 0.00 202 D 7.87 4.28 0.00 2.63 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 0.00 203 I 7.42 3.91 1.98 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.63 0.87 0.00 0.00 204 I 7.83 4.04 2.06 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 1.49 0.47 1.07 0.00 0.00 205 A 7.57 4.06 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 0.00 206 T 8.43 4.42 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 1.25 0.00 0.00 207 D 7.58 4.61 0.00 2.60 2.59 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 0.00 0.00 0.00 0.00 208 I 7.97 4.00 1.86 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 1.26 0.49 0.90 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.