NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 E 4.2827 8.4331 121.4722 55.5325 29.6365 174.7719 3 G 3.4453 8.4197 114.1550 44.3855 0.0000 169.8288 4 D 4.7449 9.6981 124.7009 52.1945 43.5299 175.5345 5 A 4.1693 8.5763 129.9649 54.8864 18.3102 178.8565 6 A 3.9518 8.1688 119.7214 55.3267 18.4678 180.0192 7 K 3.9661 8.3003 116.7515 59.4538 32.2067 179.6014 8 G 3.6782 8.2639 106.2289 47.7520 0.0000 175.1682 9 E 2.5400 7.7365 120.6170 58.5329 29.8121 178.9081 10 K 4.0596 7.4339 117.9201 59.5540 32.1527 179.3170 11 E 4.0301 8.1692 118.6545 59.0015 29.2458 178.8492 12 F 4.0874 8.2191 120.3602 60.3279 39.1346 176.4986 13 N 4.2806 7.9382 115.2925 56.2413 38.3614 176.4634 14 K 4.0728 7.9629 118.0417 57.8418 32.6078 177.7172 15 C 4.1454 7.5711 117.2155 60.0083 29.2614 175.6710 16 K 4.8619 7.6496 117.8311 58.0956 32.6011 178.6774 17 A 3.9048 7.9377 123.1928 54.9342 18.6258 178.3786 18 C 4.4925 7.8479 111.7778 60.2810 31.0121 173.9227 19 H 5.3614 8.3311 115.4850 53.9948 31.9000 173.5066 20 M 4.9818 8.6528 118.7615 53.8548 34.8565 174.8802 21 V 4.7197 8.7054 118.5355 61.1903 33.8971 173.6364 22 Q 4.9681 9.2232 128.6411 53.8514 31.5738 175.1105 23 A 2.9373 8.7947 129.5858 50.7413 19.0578 176.4419 24 P 4.1523 0.0000 0.0000 65.2736 31.4096 177.3053 25 D 4.5199 7.8669 115.5131 53.1544 39.5192 177.2481 26 G 3.8887 8.2207 109.3236 45.5823 0.0000 174.2451 27 T 3.8967 7.9640 118.0873 63.3876 68.7271 173.3902 28 D 4.7595 8.5695 127.1855 54.2704 41.5813 176.2148 29 I 3.9155 8.7646 126.3677 63.2778 37.8201 176.4047 30 V 4.4054 7.3713 121.0929 60.4977 34.2048 174.2657 31 K 4.3688 8.9015 130.3202 56.9101 32.7983 175.9803 32 G 4.1272 8.2773 112.8908 45.6172 0.0000 171.8904 33 G 4.1448 8.4775 108.2094 45.0812 0.0000 173.9838 34 K 4.7237 8.3551 115.9101 56.3028 33.3327 177.9402 35 T 4.0374 8.3972 118.6103 65.9184 68.8411 174.5182 36 G 4.0741 8.0797 107.1677 43.1230 0.0000 171.8059 37 P 4.2804 0.0000 0.0000 61.4426 32.0669 175.8285 38 N 4.4625 8.5651 117.9106 54.5174 39.3893 174.5915 39 L 4.4363 8.7304 124.0213 54.3847 42.5736 175.8937 40 Y 3.9550 8.1981 120.5171 59.0583 38.9500 176.0890 41 G 3.6660 7.7705 114.3289 45.9159 0.0000 175.0236 42 V 3.6456 7.3883 121.4505 63.9673 31.6077 176.6533 43 V 3.9196 7.3192 121.0485 64.1312 31.2821 176.0025 44 G 3.9573 9.3552 116.6442 45.0805 0.0000 172.7637 45 R 4.2976 8.0728 121.2074 55.0634 31.4642 175.5638 46 K 4.1771 8.8111 126.7143 57.0408 32.6614 176.1531 47 I 3.2977 7.8444 126.9837 62.1796 37.4739 176.0967 48 A 2.5800 8.3636 129.0127 53.5254 15.5453 177.0435 49 S 4.7013 7.6694 110.4625 57.5390 64.8556 174.7169 50 V 3.7908 8.3208 122.9965 62.5939 31.5928 174.9698 51 E 4.1657 8.9004 128.3505 58.0719 29.7058 177.0117 52 G 4.0331 9.0586 114.2565 45.4188 0.0000 173.2050 53 F 3.9817 7.7547 121.7835 57.6135 39.7757 175.5312 54 K 4.1201 6.8163 127.6167 55.1704 30.8438 176.0632 55 Y 4.6015 8.1874 121.1840 57.1705 38.9195 176.7567 56 G 4.0190 8.6982 108.6687 44.4877 0.0000 174.6765 57 D 4.5708 8.7223 120.4896 57.0532 40.8508 179.4542 58 G 3.6535 8.0833 105.8323 47.9963 0.0000 175.7182 59 I 3.9079 7.9174 121.2004 63.5712 38.0000 177.7602 60 L 3.9847 7.9047 119.9886 57.6433 41.3907 179.0563 61 E 3.9258 8.3185 119.4312 58.9638 29.4190 178.8868 62 V 3.4606 7.9053 118.1934 66.0266 31.3605 177.9479 63 A 3.8842 7.5717 118.7234 55.0199 18.2852 178.8026 64 E 3.9876 8.2354 117.1337 59.3260 29.8600 178.7028 65 K 4.3256 7.9829 115.7345 56.8860 33.9071 177.0803 66 N 4.9654 7.5261 116.7137 50.2838 38.9501 173.0245 67 P 4.2506 0.0000 0.0000 64.9644 31.9934 177.2530 68 D 4.6127 7.8099 114.8045 53.3515 40.3817 175.9493 69 M 4.1945 7.9862 122.3784 55.8870 33.1717 175.4249 70 V 4.8136 8.0417 117.6772 58.8984 36.4229 175.6523 71 W 4.5201 8.9539 122.3132 56.5030 29.0017 176.9012 72 S 4.7890 8.6642 120.0310 57.2180 64.1885 175.3725 73 E 3.9586 8.8625 120.4226 59.5709 29.1842 179.5833 74 A 4.0744 7.9978 120.2692 55.3752 18.5285 179.3140 75 D 4.7004 8.4540 117.4715 57.5136 40.8622 178.9429 76 L 3.7776 8.4692 119.8419 57.8222 41.6560 179.6082 77 I 3.7227 7.9461 119.6502 64.3903 37.0294 178.4038 78 E 4.0280 8.2211 119.1304 59.6133 29.1672 178.7857 79 Y 3.8791 7.9367 118.5589 60.6931 39.1047 177.8967 80 V 3.5939 8.1135 119.5202 66.1842 31.3108 178.1998 81 T 4.1818 7.5648 116.1185 65.0866 69.2878 174.4778 82 D 4.3991 7.8411 119.5357 51.6943 43.1358 173.6426 83 P 3.9655 0.0000 0.0000 64.7664 31.4043 177.8916 84 K 4.0227 8.0071 118.1045 59.1555 32.2308 177.0226 85 P 4.3320 0.0000 0.0000 65.2791 31.1992 178.0561 86 W 4.1519 8.0379 127.2062 60.4922 30.6245 177.8762 87 L 4.1130 8.4143 118.8806 57.8412 41.0878 179.6429 88 V 3.7074 8.0656 118.2581 65.9115 31.2276 177.5712 89 E 3.8194 8.1648 118.2051 59.4294 29.5675 178.7535 90 K 3.8474 7.4916 117.0120 58.8074 32.1201 178.8743 91 T 4.1780 7.9465 109.3213 61.7067 69.1601 175.9742 92 G 3.7359 8.0030 108.3830 45.6297 0.0000 172.4577 93 D 4.7956 7.8537 119.8540 51.7093 42.2667 176.9065 94 S 4.1413 8.8485 122.1141 60.6868 63.0830 174.8812 95 A 4.5343 8.3080 122.5884 51.5508 18.8375 176.3685 96 A 3.9638 7.7076 120.0710 54.1736 19.1614 179.0618 97 K 4.4378 8.6831 122.0949 55.4047 32.4391 175.1891 98 T 4.8331 8.0666 117.2454 61.5312 69.9760 172.8041 99 K 4.2735 8.9053 123.1187 56.4378 33.2744 176.7332 100 K 4.3875 7.8103 120.1218 55.4056 31.2264 175.7744 101 T 4.4995 8.2372 114.7966 60.5105 69.9594 174.1643 102 F 3.9440 8.3259 124.7233 58.9096 39.6144 173.9774 103 K 4.3051 7.6037 126.7550 54.2384 33.7241 175.0668 104 L 4.2854 8.3297 125.8133 53.4662 42.9451 177.1311 105 G 3.8070 8.5050 114.8073 46.4762 0.0000 172.9160 106 K 4.5763 7.5684 116.8142 56.4638 35.4702 174.5293 107 N 4.2865 8.7978 113.1380 54.8270 36.2236 177.2849 108 Q 3.9775 8.2229 118.7286 59.1193 28.8424 177.8212 109 A 4.0626 8.0061 121.2812 55.0738 18.4030 179.2785 110 D 4.4075 8.0740 117.2816 57.6107 40.9715 179.1774 111 V 3.7892 7.8490 119.6844 64.9461 31.2661 178.5551 112 V 3.5539 8.0762 118.7033 65.5658 31.2764 177.8249 113 A 3.9835 8.3437 120.8777 55.0147 18.0811 179.4263 114 F 4.1510 8.2905 119.1763 61.5070 39.2923 177.3910 115 L 3.6177 7.9701 117.3514 57.6094 41.6624 179.1012 116 A 3.9863 8.2448 121.1440 55.0113 18.0621 179.3005 117 Q 3.8137 7.9019 117.3840 58.9374 29.1953 177.3973 118 H 4.7145 7.4037 115.7135 55.1674 31.2268 175.2452 119 S 4.4165 7.4652 113.7085 56.3872 62.8621 173.6462 120 P 4.3228 0.0000 0.0000 64.7926 31.8098 177.6719 121 D 4.8202 7.7549 117.2295 53.7413 41.2806 175.8779 122 A 3.9205 7.6644 123.2499 52.1777 18.8808 178.8200 *123 G 3.7341 8.5604 110.0193 45.8372 0.0000 172.6754 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 8.43 4.28 0.00 1.93 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 2.19 2.38 0.00 3 G 8.42 3.45 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 4 D 9.70 4.74 0.00 2.67 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 5 A 8.58 4.17 1.41 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 0.00 0.00 6 A 8.17 3.95 1.41 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 0.00 0.00 7 K 8.30 3.97 0.00 1.97 1.86 0.00 1.78 0.00 0.00 1.82 0.00 0.00 2.94 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.52 1.63 7.81 8 G 8.26 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 E 7.74 2.54 0.00 1.54 1.88 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 2.07 1.72 0.00 10 K 7.43 4.06 0.00 2.03 1.80 0.00 1.69 0.00 0.00 1.62 0.00 0.00 2.93 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.41 1.60 7.81 11 E 8.17 4.03 0.00 2.12 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 2.32 2.47 0.00 12 F 8.22 4.09 0.00 3.16 3.02 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 13 N 7.94 4.28 0.00 2.79 2.84 0.00 0.00 7.01 7.01 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 14 K 7.96 4.07 0.00 1.85 1.95 0.00 1.83 0.00 0.00 1.84 0.00 0.00 3.05 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.53 1.48 7.81 15 C 7.57 4.15 0.00 1.23 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 0.00 0.00 0.00 0.00 16 K 7.65 4.86 0.00 2.02 2.12 0.00 1.90 0.00 0.00 1.87 0.00 0.00 2.90 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.59 1.37 7.81 17 A 7.94 3.90 1.19 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 0.00 0.00 18 C 7.85 4.49 0.00 2.67 2.77 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 0.00 0.00 0.00 19 H 8.33 5.36 0.00 3.14 3.27 0.00 5.58 0.00 0.00 0.00 0.00 6.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 M 8.65 4.98 0.00 2.13 2.34 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.55 0.00 21 V 8.71 4.72 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 0.81 0.00 0.00 0.54 0.00 0.00 22 Q 9.22 4.97 0.00 2.04 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.71 0.00 0.00 0.00 0.00 0.00 2.17 2.40 0.00 23 A 8.79 2.94 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 P 0.00 4.15 0.00 1.95 2.08 0.00 3.21 0.00 0.00 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.96 0.00 25 D 7.87 4.52 0.00 2.73 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 26 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 27 T 7.96 3.90 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 1.18 0.00 0.00 28 D 8.57 4.76 0.00 2.66 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 29 I 8.76 3.92 1.86 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 1.14 0.66 0.61 0.00 0.00 30 V 7.37 4.41 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 1.22 0.00 0.00 1.00 0.00 0.00 31 K 8.90 4.37 0.00 1.81 1.73 0.00 1.85 0.00 0.00 1.76 0.00 0.00 2.91 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.44 1.53 7.81 32 G 8.28 4.13 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 G 8.48 4.14 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 K 8.36 4.72 0.00 1.62 1.83 0.00 1.77 0.00 0.00 1.73 0.00 0.00 2.92 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.36 1.45 7.81 35 T 8.40 4.04 4.20 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 1.22 0.00 0.00 36 G 8.08 4.07 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 0.00 37 P 0.00 4.28 0.00 1.97 1.18 0.00 3.43 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.40 0.00 38 N 8.57 4.46 0.00 2.73 2.83 0.00 0.00 6.94 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 39 L 8.73 4.44 0.00 1.76 1.59 0.79 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 40 Y 8.20 3.95 0.00 2.98 2.98 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 41 G 7.77 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 42 V 7.39 3.65 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 0.53 0.00 0.00 0.66 0.00 0.00 43 V 7.32 3.92 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 0.75 0.00 0.00 0.88 0.00 0.00 44 G 9.36 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 45 R 8.07 4.30 0.00 2.21 2.06 0.00 3.20 0.00 0.00 3.15 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.63 0.00 46 K 8.81 4.18 0.00 1.79 1.72 0.00 1.83 0.00 0.00 1.69 0.00 0.00 2.90 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.36 1.56 7.81 47 I 7.84 3.30 1.64 0.00 0.00 -0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.56 0.67 0.00 0.00 48 A 8.36 2.58 0.57 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 0.00 0.00 49 S 7.67 4.70 0.00 3.98 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 50 V 8.32 3.79 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 1.00 0.00 0.00 1.05 0.00 0.00 51 E 8.90 4.17 0.00 2.03 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 2.35 2.38 0.00 52 G 9.06 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 53 F 7.75 3.98 0.00 2.91 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 54 K 6.82 4.12 0.00 1.60 1.57 0.00 1.91 0.00 0.00 1.70 0.00 0.00 2.91 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.40 1.02 7.81 55 Y 8.19 4.60 0.00 3.11 3.02 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 56 G 8.70 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 57 D 8.72 4.57 0.00 2.75 2.77 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 0.00 0.00 0.00 58 G 8.08 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.92 3.91 2.12 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.54 1.17 0.00 0.00 60 L 7.90 3.98 0.00 1.90 1.73 1.09 1.23 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 61 E 8.32 3.93 0.00 2.14 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 0.00 2.28 2.30 0.00 62 V 7.91 3.46 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 0.78 0.00 0.00 0.95 0.00 0.00 63 A 7.57 3.88 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 64 E 8.24 3.99 0.00 2.02 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 0.00 2.31 2.35 0.00 65 K 7.98 4.33 0.00 1.81 1.79 0.00 1.67 0.00 0.00 1.84 0.00 0.00 2.98 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.42 1.44 7.81 66 N 7.53 4.97 0.00 2.66 2.60 0.00 0.00 6.84 7.88 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 67 P 0.00 4.25 0.00 2.01 2.10 0.00 3.62 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 2.00 2.05 0.00 68 D 7.81 4.61 0.00 2.75 2.74 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 0.00 0.00 0.00 0.00 69 M 7.99 4.19 0.00 2.01 1.90 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.32 0.00 70 V 8.04 4.81 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 0.84 0.00 0.00 0.93 0.00 0.00 71 W 8.95 4.52 0.00 3.46 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 72 S 8.66 4.79 0.00 4.07 4.05 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 73 E 8.86 3.96 0.00 2.06 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 0.00 2.41 2.40 0.00 74 A 8.00 4.07 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 75 D 8.45 4.70 0.00 3.00 3.13 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 0.00 0.00 0.00 0.00 76 L 8.47 3.78 0.00 1.84 1.60 0.87 0.12 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 77 I 7.95 3.72 2.07 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 1.54 1.09 0.94 0.00 0.00 78 E 8.22 4.03 0.00 2.50 2.34 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 2.47 2.62 0.00 79 Y 7.94 3.88 0.00 2.00 2.56 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 80 V 8.11 3.59 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 0.97 0.00 0.00 0.90 0.00 0.00 81 T 7.56 4.18 4.41 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 1.20 0.00 0.00 82 D 7.84 4.40 0.00 2.62 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 83 P 0.00 3.97 0.00 2.20 1.17 0.00 3.50 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.59 0.00 84 K 8.01 4.02 0.00 1.92 1.84 0.00 1.69 0.00 0.00 1.95 0.00 0.00 3.17 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.55 1.62 7.81 85 P 0.00 4.33 0.00 2.38 2.34 0.00 3.90 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 2.30 2.18 0.00 86 W 8.04 4.15 0.00 3.66 3.73 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 0.00 0.00 0.00 87 L 8.41 4.11 0.00 2.15 1.86 1.18 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 88 V 8.07 3.71 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 1.03 0.00 0.00 1.03 0.00 0.00 89 E 8.16 3.82 0.00 1.98 1.97 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 0.00 2.13 2.26 0.00 90 K 7.49 3.85 0.00 1.18 1.36 0.00 1.30 0.00 0.00 1.29 0.00 0.00 2.30 0.00 0.00 2.62 0.00 0.00 0.00 0.00 0.30 0.21 7.81 91 T 7.95 4.18 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 1.24 0.00 0.00 92 G 8.00 3.74 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 D 7.85 4.80 0.00 2.66 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 94 S 8.85 4.14 0.00 4.02 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 95 A 8.31 4.53 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 96 A 7.71 3.96 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 97 K 8.68 4.44 0.00 1.77 1.83 0.00 1.74 0.00 0.00 1.78 0.00 0.00 2.83 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.49 1.45 7.81 98 T 8.07 4.83 4.41 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 1.33 0.00 0.00 99 K 8.91 4.27 0.00 1.81 1.88 0.00 1.73 0.00 0.00 1.67 0.00 0.00 2.87 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.40 1.50 7.81 100 K 7.81 4.39 0.00 1.88 1.90 0.00 1.77 0.00 0.00 1.77 0.00 0.00 3.35 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.49 1.67 7.81 101 T 8.24 4.50 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 1.25 0.00 0.00 102 F 8.33 3.94 0.00 2.96 3.02 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 0.00 103 K 7.60 4.31 0.00 1.47 1.64 0.00 1.67 0.00 0.00 1.55 0.00 0.00 2.91 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.30 1.46 7.81 104 L 8.33 4.29 0.00 1.73 1.60 0.96 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 105 G 8.50 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 0.00 0.00 0.00 106 K 7.57 4.58 0.00 1.81 1.73 0.00 1.71 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.29 1.45 7.81 107 N 8.80 4.29 0.00 2.98 2.95 0.00 0.00 6.82 7.50 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 0.00 108 Q 8.22 3.98 0.00 2.14 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.90 0.00 0.00 0.00 0.00 0.00 2.43 2.47 0.00 109 A 8.01 4.06 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 0.00 110 D 8.07 4.41 0.00 2.92 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 0.00 111 V 7.85 3.79 2.16 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 0.84 0.00 0.00 1.18 0.00 0.00 112 V 8.08 3.55 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 1.08 0.00 0.00 1.00 0.00 0.00 113 A 8.34 3.98 1.41 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 0.00 0.00 114 F 8.29 4.15 0.00 3.25 3.28 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 0.00 115 L 7.97 3.62 0.00 1.72 1.56 0.87 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 116 A 8.24 3.99 1.31 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 0.00 0.00 0.00 0.00 0.00 0.00 117 Q 7.90 3.81 0.00 2.04 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 7.38 0.00 0.00 0.00 0.00 0.00 1.97 2.26 0.00 118 H 7.40 4.71 0.00 2.69 3.04 0.00 5.61 0.00 0.00 0.00 0.00 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 S 7.47 4.42 0.00 3.76 3.56 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 0.00 120 P 0.00 4.32 0.00 2.17 2.15 0.00 3.38 0.00 0.00 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.06 0.00 121 D 7.75 4.82 0.00 2.67 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 0.00 122 A 7.66 3.92 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 *123 G 8.56 3.73 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 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.