NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 12 V 3.9780 8.0549 120.3127 61.9066 32.7264 175.0612 13 R 3.3208 7.0078 118.2690 51.6871 29.0008 174.0701 14 Q 4.7225 8.6821 122.3941 53.6696 32.9325 174.5933 15 V 4.2095 8.1564 121.0623 62.7502 32.3359 175.9445 16 S 4.4929 8.9941 122.4010 57.3869 62.8257 174.9801 17 K 4.1604 8.5045 124.8658 58.9030 32.8024 177.0733 18 H 4.7231 8.2401 116.1537 55.5277 29.8995 176.2147 19 A 4.0049 7.7963 125.3390 55.5868 18.2786 179.1482 *20 F 4.5009 8.1645 114.0237 58.7415 39.2140 178.9800 21 S 4.7521 7.3956 115.3754 57.9569 62.4772 176.2791 22 L 4.2392 8.0849 126.9107 55.6334 42.2042 176.4265 23 K 4.4298 8.5160 128.0098 53.3266 32.8313 171.9642 24 Q 4.7954 8.1430 122.6363 52.8590 31.2831 175.4866 25 L 4.2530 8.2310 123.4430 54.7534 42.5262 176.7325 26 D 4.5265 8.6152 120.9939 53.5001 42.0293 175.6280 27 N 4.1270 8.4155 114.9519 53.8843 35.9972 173.2245 28 P 4.4922 0.0000 0.0000 62.2677 32.7282 176.5603 29 A 4.1909 8.5986 125.2876 52.7213 19.1025 178.0180 30 R 4.6052 8.4052 121.1008 56.2965 30.1840 176.9436 31 I 4.3997 8.7096 127.3817 58.8486 37.0465 174.7360 32 P 4.6241 0.0000 0.0000 62.1279 32.3330 175.7287 33 P 4.4692 0.0000 0.0000 64.7674 31.5415 175.5723 34 C 2.6649 7.0628 111.9687 57.8354 32.2510 173.8331 35 G 3.6160 7.8092 105.0901 45.7937 0.0000 173.9997 36 W 4.4935 6.9760 118.2048 56.4737 29.7343 175.4728 37 K 4.8166 8.2295 120.1114 54.7601 34.7062 175.4057 38 C 4.4507 8.9087 125.7660 59.4795 31.8846 174.6072 39 S 4.2351 8.6117 120.9826 59.6574 62.9141 174.7455 40 K 4.3705 7.4430 119.4015 56.7854 33.5370 175.0100 41 C 4.7324 7.4646 110.8773 57.1387 32.2086 173.0008 42 D 4.5739 8.6135 117.6047 55.7931 40.9766 177.0252 43 M 4.1551 8.0184 119.7730 56.1729 32.3305 176.7014 44 R 4.8298 8.5933 118.8036 55.7367 31.9157 174.7291 45 E 4.7005 7.5845 116.2867 54.8801 33.9627 174.2309 46 N 4.1314 8.4837 115.2506 55.0607 37.2736 173.1848 47 L 5.2536 7.2766 117.2070 52.9166 45.1166 177.0237 48 W 4.8475 9.4189 122.7065 54.7139 32.5443 174.2553 49 L 4.8142 8.8040 127.0619 53.3364 43.3525 174.7915 50 N 5.0939 8.9946 126.8162 53.2574 39.3629 176.0089 51 L 4.3025 9.0614 127.3459 57.5996 42.4199 178.9422 52 T 4.0218 8.6127 116.4516 65.9251 68.4677 175.9702 53 D 4.8279 8.2313 116.4022 52.4760 40.4070 176.9981 54 G 3.4418 8.4497 108.5282 45.2687 0.0000 173.9895 55 S 4.2941 8.3696 115.4645 58.2831 64.6052 173.3963 56 I 4.8659 8.3482 123.0793 59.7963 39.3780 174.4504 57 L 5.2672 8.9837 126.8050 52.7098 46.4267 176.1734 58 C 4.9561 8.8359 116.1851 58.0346 31.4372 173.2533 59 G 4.3401 9.1307 108.5631 45.8830 0.0000 173.0684 60 R 4.4089 8.2582 116.2952 56.0277 30.8730 175.4240 61 R 4.7053 8.1637 120.4086 55.5693 31.5795 174.9500 62 Y 4.8005 8.6570 122.8010 55.7750 40.7267 176.9214 63 F 4.2093 9.3062 116.1932 59.9155 37.9353 175.9121 64 D 3.9922 6.9786 118.0623 53.3044 39.4137 177.0133 65 G 3.8765 8.2335 109.5513 45.3096 0.0000 173.8853 66 S 4.3507 8.2805 115.2930 57.7220 64.4633 173.8033 67 G 4.4523 8.7365 107.4488 44.7931 0.0000 173.7079 68 G 4.1736 7.7731 111.6342 46.0362 0.0000 174.7484 69 N 4.7731 8.5991 120.2844 52.9957 39.4002 175.2034 70 N 4.3897 8.4808 113.2621 54.7161 37.1575 176.2419 71 H 4.3501 7.6616 118.5758 58.7391 28.6948 177.6442 72 A 4.1229 8.4033 123.2639 55.1484 18.2624 180.1132 73 V 3.1326 7.6898 117.2466 64.7469 31.7821 178.3549 74 E 3.9203 8.2374 119.3072 59.2435 29.1321 178.7563 75 H 4.1580 8.1004 118.1416 59.2151 29.9422 176.6878 76 Y 3.8665 7.5768 121.2458 60.6726 38.3323 177.8976 77 R 3.5174 7.6104 118.3236 59.2179 30.0852 177.6061 78 E 3.9712 7.5649 117.9709 58.3378 29.8406 177.6235 79 T 3.9020 7.7451 108.3260 60.7662 69.9202 175.8748 80 G 3.4821 7.7654 108.4905 45.0484 0.0000 172.7903 81 Y 4.6347 7.2692 118.1420 57.1009 37.6751 173.8627 82 P 4.4476 0.0000 0.0000 64.9444 32.8343 176.2061 83 L 5.2087 8.0280 119.3282 52.9269 44.3331 175.6611 84 A 5.4165 8.9547 123.6920 50.4214 23.2399 175.1599 85 V 4.8526 8.8682 120.9471 59.6004 34.4924 174.8308 86 K 3.3531 8.3245 125.8623 55.2090 32.8203 176.3406 87 L 3.4277 7.7867 128.8078 55.9693 41.8341 177.7060 88 G 4.0431 8.6987 111.1237 45.4237 0.0000 173.7565 89 T 4.4088 7.3453 108.4576 61.0026 69.6946 173.8182 90 I 4.3346 7.5292 124.4298 61.4571 37.1085 175.0204 91 T 4.7776 8.9261 114.8732 59.0292 72.0406 172.9468 92 P 4.5099 0.0000 0.0000 65.5233 31.3535 177.8063 93 D 4.5856 7.5734 117.7200 55.0895 41.9672 177.3057 94 G 3.9373 7.1908 105.5677 47.3662 0.0000 171.0829 95 A 4.8891 7.8482 122.2195 52.2515 21.7174 175.8273 96 D 4.6959 8.3660 120.3165 53.8312 41.8369 175.9625 97 V 4.9156 8.4516 124.2066 61.1803 33.8329 173.5141 98 Y 4.9743 9.5290 129.0157 55.7327 42.0445 173.8958 99 S 4.6457 7.2975 120.4470 56.5774 63.8311 174.4678 100 Y 3.6146 8.0854 126.2208 60.9252 37.8120 177.3296 101 D 4.5228 7.7933 118.5097 57.6692 41.2075 177.5109 102 E 4.0106 8.0254 116.4102 56.5780 30.2310 175.7339 103 D 4.2810 7.0451 115.6097 51.9854 40.0342 171.6570 104 D 4.6024 6.2106 117.8170 53.5144 45.1490 175.3401 105 M 4.8065 9.0334 124.0053 55.8418 32.5644 175.9486 106 V 4.6887 8.7955 117.1900 59.3736 35.8635 174.2062 107 L 4.6973 8.7644 122.7894 53.6356 44.7469 174.9243 108 D 4.8841 8.5709 125.0289 51.6285 42.4337 174.0098 109 P 4.2548 0.0000 0.0000 64.9372 31.8274 177.7026 110 S 4.6534 8.0319 112.9980 58.1987 63.2499 175.5916 111 L 4.2405 8.4501 126.4754 57.7268 41.6521 178.7695 112 A 3.9946 8.0348 119.8715 55.2757 18.1215 179.1232 113 E 3.8421 8.0200 117.0748 59.7966 29.6485 178.4427 114 H 4.5222 7.8505 116.2901 58.4756 28.9745 177.4859 115 L 4.4779 8.4979 121.0373 57.7793 41.5112 179.5071 116 S 4.1234 8.1404 115.2053 61.8243 62.4709 175.9330 117 H 4.0513 7.7019 120.2813 58.6722 29.5517 175.6201 118 F 4.7436 8.1590 117.5200 56.8548 38.9999 176.5646 119 G 4.0788 8.5247 108.7160 46.3896 0.0000 173.5997 120 I 4.1956 7.8460 119.9673 59.6447 38.1945 174.8189 121 D 4.8086 8.4927 125.0215 52.5029 41.5523 175.4910 122 M 4.1646 8.7416 127.5863 58.5189 32.6932 177.8669 123 L 4.2135 8.1914 122.0282 54.6132 40.4474 177.7743 124 K 4.2714 7.7698 123.5550 55.1314 31.5686 177.5374 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 12 V 8.05 3.98 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 0.92 0.00 0.00 0.94 0.00 0.00 13 R 7.01 3.32 0.00 1.86 2.02 0.00 3.19 0.00 0.00 3.27 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.75 0.00 14 Q 8.68 4.72 0.00 1.94 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 7.11 0.00 0.00 0.00 0.00 0.00 2.35 2.26 0.00 15 V 8.16 4.21 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 0.73 0.00 0.00 0.93 0.00 0.00 16 S 8.99 4.49 0.00 3.90 3.72 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 17 K 8.50 4.16 0.00 1.81 1.85 0.00 1.50 0.00 0.00 1.64 0.00 0.00 3.03 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.47 1.02 7.81 18 H 8.24 4.72 0.00 3.28 3.37 0.00 5.85 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 A 7.80 4.00 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 F 8.16 4.50 0.00 2.30 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 0.00 0.00 0.00 0.00 21 S 7.40 4.75 0.00 3.76 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 22 L 8.08 4.24 0.00 1.77 1.54 0.90 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 23 K 8.52 4.43 0.00 1.81 1.58 0.00 1.82 0.00 0.00 1.70 0.00 0.00 2.92 0.00 0.00 2.62 0.00 0.00 0.00 0.00 1.30 1.01 7.81 24 Q 8.14 4.80 0.00 1.60 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 7.01 0.00 0.00 0.00 0.00 0.00 2.37 2.19 0.00 25 L 8.23 4.25 0.00 1.57 1.61 0.92 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 26 D 8.62 4.53 0.00 2.55 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 27 N 8.42 4.13 0.00 2.84 2.85 0.00 0.00 6.95 8.02 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 28 P 0.00 4.49 0.00 1.97 1.80 0.00 3.66 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.23 0.00 29 A 8.60 4.19 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 30 R 8.41 4.61 0.00 1.61 1.75 0.00 3.26 0.00 0.00 3.22 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.23 0.00 31 I 8.71 4.40 1.98 0.00 0.00 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 1.37 1.04 1.03 0.00 0.00 32 P 0.00 4.62 0.00 2.18 2.19 0.00 3.89 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.04 0.00 33 P 0.00 4.47 0.00 2.03 2.19 0.00 3.69 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 2.04 2.13 0.00 34 C 7.06 2.66 0.00 2.74 2.49 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.81 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 36 W 6.98 4.49 0.00 3.50 2.99 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 37 K 8.23 4.82 0.00 1.71 1.67 0.00 1.80 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.36 1.56 7.81 38 C 8.91 4.45 0.00 3.07 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.61 4.24 0.00 4.04 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 40 K 7.44 4.37 0.00 1.41 1.49 0.00 1.61 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.30 1.35 7.81 41 C 7.46 4.73 0.00 3.07 2.99 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 42 D 8.61 4.57 0.00 2.72 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 43 M 8.02 4.16 0.00 2.14 2.07 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.63 0.00 44 R 8.59 4.83 0.00 1.78 1.94 0.00 3.16 0.00 0.00 3.23 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.84 0.00 45 E 7.58 4.70 0.00 1.93 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 2.23 2.30 0.00 46 N 8.48 4.13 0.00 2.97 2.89 0.00 0.00 6.75 6.66 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 47 L 7.28 5.25 0.00 1.49 1.49 1.07 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 48 W 9.42 4.85 0.00 3.38 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 49 L 8.80 4.81 0.00 1.44 1.47 0.49 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 50 N 8.99 5.09 0.00 3.01 3.02 0.00 0.00 6.78 6.49 0.00 0.00 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 L 9.06 4.30 0.00 1.72 1.81 1.00 1.11 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 52 T 8.61 4.02 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 0.30 0.00 0.00 53 D 8.23 4.83 0.00 2.87 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 G 8.45 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 0.00 0.00 0.00 55 S 8.37 4.29 0.00 3.85 4.04 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 56 I 8.35 4.87 1.89 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 1.18 0.73 0.97 0.00 0.00 57 L 8.98 5.27 0.00 1.63 1.55 0.89 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 58 C 8.84 4.96 0.00 3.11 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 59 G 9.13 4.34 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 0.00 60 R 8.26 4.41 0.00 1.62 1.88 0.00 2.22 0.00 0.00 2.64 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.75 0.00 61 R 8.16 4.71 0.00 2.00 1.91 0.00 3.19 0.00 0.00 3.23 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.66 0.00 62 Y 8.66 4.80 0.00 3.06 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 63 F 9.31 4.21 0.00 3.18 3.25 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 64 D 6.98 3.99 0.00 2.44 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 0.00 0.00 0.00 65 G 8.23 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 66 S 8.28 4.35 0.00 3.99 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 67 G 8.74 4.45 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 0.00 68 G 7.77 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 69 N 8.60 4.77 0.00 2.62 2.66 0.00 0.00 6.89 6.92 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 70 N 8.48 4.39 0.00 2.87 2.85 0.00 0.00 7.07 7.77 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 71 H 7.66 4.35 0.00 3.20 3.35 0.00 5.64 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 72 A 8.40 4.12 1.56 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 73 V 7.69 3.13 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 0.84 0.00 0.00 0.91 0.00 0.00 74 E 8.24 3.92 0.00 2.06 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 2.29 2.55 0.00 75 H 8.10 4.16 0.00 3.39 3.52 0.00 5.79 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 Y 7.58 3.87 0.00 2.33 2.46 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 77 R 7.61 3.52 0.00 1.72 2.02 0.00 3.24 0.00 0.00 3.08 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.50 0.00 78 E 7.56 3.97 0.00 2.00 1.93 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 2.16 2.20 0.00 79 T 7.75 3.90 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 0.81 0.00 0.00 80 G 7.77 3.48 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 81 Y 7.27 4.63 0.00 3.13 3.03 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 82 P 0.00 4.45 0.00 1.94 2.47 0.00 3.82 0.00 0.00 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.71 0.00 83 L 8.03 5.21 0.00 1.65 1.64 0.96 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 84 A 8.95 5.42 1.53 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 0.00 0.00 0.00 0.00 0.00 0.00 85 V 8.87 4.85 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 0.82 0.00 0.00 0.88 0.00 0.00 86 K 8.32 3.35 0.00 0.79 1.02 0.00 1.17 0.00 0.00 1.32 0.00 0.00 2.64 0.00 0.00 2.79 0.00 0.00 0.00 0.00 0.80 0.22 7.81 87 L 7.79 3.43 0.00 1.01 0.13 0.11 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 88 G 8.70 4.04 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 0.00 0.00 0.00 89 T 7.35 4.41 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 1.06 0.00 0.00 90 I 7.53 4.33 1.84 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.38 0.91 0.00 0.00 91 T 8.93 4.78 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 1.28 0.00 0.00 92 P 0.00 4.51 0.00 2.07 2.17 0.00 3.67 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 2.12 0.00 93 D 7.57 4.59 0.00 2.86 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 94 G 7.19 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 0.00 0.00 0.00 95 A 7.85 4.89 1.15 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 0.00 0.00 96 D 8.37 4.70 0.00 2.48 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 97 V 8.45 4.92 2.32 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 1.07 0.00 0.00 0.98 0.00 0.00 98 Y 9.53 4.97 0.00 2.88 2.39 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 99 S 7.30 4.65 0.00 3.77 3.37 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 0.00 100 Y 8.09 3.61 0.00 1.50 1.64 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 0.00 101 D 7.79 4.52 0.00 2.72 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 0.00 102 E 8.03 4.01 0.00 1.91 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 2.27 2.24 0.00 103 D 7.05 4.28 0.00 2.74 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 D 6.21 4.60 0.00 2.89 2.37 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 0.00 105 M 9.03 4.81 0.00 2.04 2.08 0.00 0.00 0.00 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.65 0.00 106 V 8.80 4.69 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 0.65 0.00 0.00 0.94 0.00 0.00 107 L 8.76 4.70 0.00 1.73 1.62 0.93 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 108 D 8.57 4.88 0.00 2.84 2.55 0.00 0.00 0.00 0.00 0.00 0.00 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 4.25 0.00 2.07 2.11 0.00 3.71 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 2.12 0.00 110 S 8.03 4.65 0.00 3.82 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 0.00 111 L 8.45 4.24 0.00 1.95 1.70 0.93 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 112 A 8.03 3.99 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 0.00 113 E 8.02 3.84 0.00 2.01 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 2.36 2.38 0.00 114 H 7.85 4.52 0.00 3.39 3.41 0.00 5.69 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 L 8.50 4.48 0.00 1.75 1.82 0.95 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 116 S 8.14 4.12 0.00 4.06 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 0.00 117 H 7.70 4.05 0.00 2.87 2.90 0.00 5.93 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 F 8.16 4.74 0.00 3.30 3.05 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 0.00 0.00 0.00 0.00 119 G 8.52 4.08 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 I 7.85 4.20 2.15 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 1.42 0.79 0.98 0.00 0.00 121 D 8.49 4.81 0.00 2.64 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 0.00 122 M 8.74 4.16 0.00 2.24 2.14 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.59 0.00 123 L 8.19 4.21 0.00 1.78 1.66 0.93 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 124 K 7.77 4.27 0.00 1.94 1.67 0.00 1.84 0.00 0.00 1.74 0.00 0.00 2.94 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.25 0.99 7.81 * Residues marked with a * may have inaccurate shift predictions.