NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 N 4.9824 8.5081 117.5872 52.6051 38.7922 174.9794 2 T 3.7974 7.9307 108.8452 64.3971 68.2349 174.8195 3 Y 4.0074 7.9722 120.1352 60.8311 38.5038 179.0761 4 Q 4.0262 8.0684 119.0026 58.9063 28.7741 178.2619 5 F 4.3628 8.2186 121.5745 61.2439 39.3568 176.9688 6 K 3.5946 8.0221 119.1200 58.7692 31.6868 178.4119 7 N 4.5027 8.1922 117.2112 56.0534 38.6354 177.2958 8 M 4.1924 7.8560 119.8455 58.2266 32.0763 178.7078 9 I 3.6851 7.4707 119.8428 64.6609 37.1986 178.4462 10 Q 4.2740 7.7133 116.7458 58.9075 28.5119 178.0962 11 C 4.4999 7.7685 118.8657 59.1704 44.0504 174.9704 12 T 4.0882 7.8785 109.1047 62.3262 69.9499 174.8252 13 V 4.5898 8.3069 121.9636 60.6265 31.5114 174.3974 14 P 4.5031 0.0000 0.0000 65.4467 31.7232 177.6069 15 K 4.1332 7.7413 115.9071 57.6583 33.0331 176.4922 *17 R 4.5317 7.5659 117.6936 55.9764 31.4102 175.3299 18 S 4.3799 8.2767 116.3050 57.9381 63.2608 174.8682 19 W 4.3937 8.9753 134.8480 60.2833 30.4201 178.3107 20 W 3.8016 8.2494 119.0916 59.6524 28.2150 177.8100 21 D 4.2568 7.6992 117.5427 56.5165 40.2144 177.8062 22 F 4.6929 7.5380 115.2069 57.0376 40.1069 176.1067 23 A 3.9480 7.7395 121.7831 53.5406 18.3777 178.0239 24 D 4.4738 7.7244 116.7227 52.9678 41.4039 173.5010 25 Y 4.7546 8.1583 119.0564 56.3315 41.0849 176.0661 26 G 3.9424 7.9692 116.7261 45.8037 0.0000 172.1987 27 C 4.3777 9.2594 115.0936 58.0563 37.1928 174.7385 28 Y 4.2528 8.8830 116.2880 58.4524 39.5813 176.6820 29 C 4.7944 8.2362 114.7772 57.2679 40.9903 173.0117 30 G 3.8943 7.7389 115.2944 46.5555 0.0000 175.4826 31 R 4.2038 8.8814 116.3010 56.3004 32.1049 175.9677 32 G 4.1820 8.8431 116.3135 45.7173 0.0000 175.9632 33 G 3.9690 7.1745 107.6904 44.9503 0.0000 173.1213 34 S 4.7651 6.3929 107.7856 58.9873 65.4610 174.5628 35 G 3.8231 8.8392 106.9731 44.7156 0.0000 172.1333 36 T 4.5685 8.3229 116.5752 60.9648 69.9505 172.7536 37 P 4.6774 0.0000 0.0000 63.0504 31.7370 176.5132 38 I 3.8453 8.8784 117.4017 63.7713 37.9674 174.9405 39 D 4.5945 7.8048 118.2945 51.1113 41.6451 175.1457 40 D 4.4393 8.9078 118.5731 57.8095 40.8031 178.7559 41 L 4.1204 7.8618 120.0716 57.9185 42.3101 178.1809 42 D 4.5035 8.2922 118.0180 57.2472 41.1608 178.1810 43 R 3.9321 8.1871 119.4004 59.1715 30.0992 177.8704 44 C 4.3543 8.0975 116.6147 60.2567 38.1643 175.3973 45 C 4.4595 8.3136 117.7045 59.9878 40.7662 175.6796 46 Q 3.5951 8.0177 121.2168 59.1117 28.4980 178.6114 47 V 3.5756 7.7251 119.1512 65.8699 31.6168 177.5919 48 H 4.0918 8.0073 118.1687 59.0124 29.5174 176.9917 49 D 4.1906 8.3305 121.1426 57.3738 40.7122 178.3708 50 N 4.2831 8.0944 116.8612 56.6726 38.7174 176.4134 51 C 4.1713 8.2542 119.6516 60.2307 44.7007 175.3129 52 Y 4.0159 7.9168 117.5905 60.6756 37.2328 177.7819 53 N 4.3973 7.7788 117.1001 56.2609 38.9629 177.3054 54 S 4.2414 8.1471 116.3488 61.6806 63.1386 176.7492 55 A 4.0399 7.9052 122.7825 54.7745 17.8486 179.1940 56 R 4.3067 7.7222 114.7882 57.9038 30.1949 178.2273 57 E 4.1611 7.8811 118.9009 57.9084 29.8982 177.3389 58 Q 4.0946 7.4578 118.2851 54.9181 29.2996 175.7574 59 G 3.9194 8.6828 111.7636 47.5511 0.0000 173.0653 60 G 3.9389 8.9260 112.8783 45.6118 0.0000 173.6128 61 C 4.2006 7.9744 118.7126 57.1037 42.4103 173.3051 62 R 4.4114 7.9098 127.3897 53.2483 30.6976 175.0680 63 P 3.8275 0.0000 0.0000 65.2724 31.5937 179.1510 64 K 4.1407 8.1242 116.8472 58.6589 32.1098 178.2414 65 Q 4.4934 8.0535 115.4088 55.1585 29.7618 175.1499 66 K 4.2794 7.4495 119.8723 55.5133 32.8749 175.9658 67 T 4.3589 8.3491 123.4274 62.6716 69.5880 173.4145 68 Y 4.8701 7.8918 123.0081 55.4096 41.1602 174.4145 69 S 4.9326 10.7700 116.1016 57.4291 64.3740 173.3084 70 Y 5.5226 8.6634 121.9644 55.1402 41.2074 174.4799 71 E 4.3534 9.1278 119.9942 54.6665 33.4531 172.8909 72 C 5.3874 8.8398 126.7233 54.8722 40.0445 173.2937 73 K 4.4134 8.5601 125.4435 55.8933 34.8365 177.5775 74 A 3.8377 8.8034 126.2990 51.3399 16.9998 177.8949 75 G 4.0246 8.1579 101.5768 45.2605 0.0000 173.7578 76 T 4.3784 7.9619 111.2799 60.0136 69.4651 174.4407 77 L 5.0306 8.2134 126.3513 54.3873 43.7908 176.6022 78 S 4.5349 8.3545 112.5726 58.1912 68.0506 173.8547 79 C 5.2275 8.8848 122.9385 55.9399 40.3117 173.9951 80 S 4.4620 9.2027 120.8421 57.4500 64.1464 175.5463 81 G 4.1027 8.5268 109.6415 46.2720 0.0000 175.0146 82 S 4.5330 8.2108 118.3055 59.4919 64.2828 175.3807 83 N 4.3344 8.1328 115.9570 53.8776 38.8086 174.9555 84 N 4.7600 8.3855 118.8467 51.6771 41.0054 175.2486 85 S 4.3699 8.5999 113.1032 62.6201 62.0618 176.5645 86 C 4.1297 8.2868 119.8157 59.5647 38.5389 174.9767 87 A 3.9515 8.3686 121.7419 55.6533 17.5681 179.5722 88 A 3.9488 9.0763 119.8760 55.0795 18.4764 180.0491 89 T 3.8549 7.5368 113.9369 66.5997 68.9257 177.4434 90 V 3.3797 7.8872 120.4893 65.8376 31.3180 177.2861 91 C 2.9236 7.6113 117.9794 59.3545 38.4884 175.0489 92 D 3.9893 7.4887 118.8623 57.3104 40.7081 177.8268 93 C 4.2188 7.8105 116.8427 60.0025 38.5296 175.6145 94 D 3.6339 7.6352 119.8258 57.1157 40.4289 178.4806 95 R 3.9759 7.8965 119.2967 59.8888 30.1045 178.5393 96 L 3.9584 7.7687 117.7219 57.3547 41.4595 179.5335 97 A 3.5809 7.5715 120.5657 54.6884 18.0847 179.2677 98 A 3.6687 8.2923 118.9935 55.4030 18.6796 179.7088 99 I 3.7325 7.7169 117.9751 64.5713 37.2629 177.4811 100 C 3.9679 7.8770 119.0574 60.2273 41.6452 175.9442 101 F 4.2105 8.4619 119.0960 60.6559 38.1923 177.3931 102 A 4.2391 8.5159 119.5670 53.7318 18.3357 178.1376 103 G 3.9175 7.9577 103.9507 45.0740 0.0000 173.0804 104 A 4.6780 7.3556 123.0607 49.4388 20.5268 175.5069 105 P 4.4473 0.0000 0.0000 62.9434 32.0698 174.9939 106 Y 4.5029 8.5228 121.1652 55.6868 40.8102 174.2863 107 N 5.1010 8.8432 125.8509 51.7135 40.8078 174.9107 108 D 4.6637 8.9904 126.0931 57.5882 41.2102 178.3354 109 N 4.3469 8.4014 115.1218 55.7114 38.7452 175.1348 110 N 4.5976 7.8845 115.2236 52.7523 38.8483 173.0537 111 Y 4.4753 7.7744 119.7421 56.8904 40.5546 175.0883 112 N 3.9157 8.2458 125.5232 53.2078 37.7446 173.5188 113 I 3.9923 7.0651 109.8864 59.9930 39.4173 177.0341 114 D 4.5070 8.1822 120.2390 53.3560 39.3165 175.8481 115 L 3.8437 8.2124 125.5334 57.6333 41.6977 178.7768 116 K 3.9137 8.1570 117.0180 58.5984 32.2185 177.3805 117 A 4.6210 7.8922 118.0508 51.8210 19.7947 176.9949 118 R 4.5912 7.7159 113.4947 55.7698 31.9565 176.1514 119 C 5.0057 8.0704 114.5818 56.7216 41.5619 174.1348 120 Q 4.1812 8.2279 124.2055 56.1640 28.4920 175.7926 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 1 N 8.51 4.98 0.00 2.77 2.97 0.00 0.00 5.88 6.34 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 2 T 7.93 3.80 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 1.26 0.00 0.00 3 Y 7.97 4.01 0.00 3.05 2.90 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 4 Q 8.07 4.03 0.00 1.94 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.78 0.00 0.00 0.00 0.00 0.00 2.38 2.59 0.00 5 F 8.22 4.36 0.00 3.33 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 6 K 8.02 3.59 0.00 0.79 1.61 0.00 0.82 0.00 0.00 1.11 0.00 0.00 2.84 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.20 1.07 7.81 7 N 8.19 4.50 0.00 2.98 3.05 0.00 0.00 6.86 8.40 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 8 M 7.86 4.19 0.00 2.11 2.32 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 2.41 2.65 0.00 9 I 7.47 3.69 1.92 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.34 1.08 0.00 0.00 10 Q 7.71 4.27 0.00 2.29 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.92 0.00 0.00 0.00 0.00 0.00 2.49 2.56 0.00 11 C 7.77 4.50 0.00 3.09 3.35 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 12 T 7.88 4.09 4.27 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 1.24 0.00 0.00 13 V 8.31 4.59 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 1.26 0.00 0.00 1.04 0.00 0.00 14 P 0.00 4.50 0.00 2.25 2.24 0.00 3.93 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.01 0.00 15 K 7.74 4.13 0.00 1.99 2.09 0.00 1.30 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.42 1.47 7.81 *17 R 7.57 4.53 0.00 1.93 1.71 0.00 3.33 0.00 0.00 4.01 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.48 0.00 18 S 8.28 4.38 0.00 3.96 3.97 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 0.00 0.00 0.00 19 W 8.98 4.39 0.00 3.52 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 20 W 8.25 3.80 0.00 3.45 3.27 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 21 D 7.70 4.26 0.00 2.09 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 0.00 0.00 0.00 22 F 7.54 4.69 0.00 2.75 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 23 A 7.74 3.95 0.95 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 0.00 0.00 0.00 24 D 7.72 4.47 0.00 2.67 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 0.00 0.00 0.00 0.00 25 Y 8.16 4.75 0.00 3.19 2.63 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 26 G 7.97 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 27 C 9.26 4.38 0.00 2.85 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 28 Y 8.88 4.25 0.00 3.38 3.01 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 29 C 8.24 4.79 0.00 3.24 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 30 G 7.74 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 31 R 8.88 4.20 0.00 1.76 1.83 0.00 3.34 0.00 0.00 3.24 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.55 0.00 32 G 8.84 4.18 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 0.00 33 G 7.17 3.97 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 0.00 0.00 0.00 0.00 0.00 0.00 34 S 6.39 4.77 0.00 3.92 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 35 G 8.84 3.82 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 0.00 0.00 0.00 36 T 8.32 4.57 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 1.25 0.00 0.00 37 P 0.00 4.68 0.00 2.08 2.17 0.00 3.73 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.02 0.00 38 I 8.88 3.85 1.84 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.57 0.88 0.00 0.00 39 D 7.80 4.59 0.00 2.86 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 40 D 8.91 4.44 0.00 2.68 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 41 L 7.86 4.12 0.00 1.73 1.47 0.41 -0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 42 D 8.29 4.50 0.00 3.13 2.89 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 43 R 8.19 3.93 0.00 2.07 2.07 0.00 3.15 0.00 0.00 3.15 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.62 0.00 44 C 8.10 4.35 0.00 3.54 3.38 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 45 C 8.31 4.46 0.00 3.27 3.43 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 46 Q 8.02 3.60 0.00 1.29 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.81 0.00 0.00 0.00 0.00 0.00 1.95 1.18 0.00 47 V 7.73 3.58 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 0.89 0.00 0.00 0.98 0.00 0.00 48 H 8.01 4.09 0.00 3.29 3.35 0.00 5.66 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 D 8.33 4.19 0.00 2.96 2.73 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 50 N 8.09 4.28 0.00 2.83 2.84 0.00 0.00 6.70 7.06 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 51 C 8.25 4.17 0.00 3.21 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 52 Y 7.92 4.02 0.00 3.11 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 53 N 7.78 4.40 0.00 2.80 2.89 0.00 0.00 7.04 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 54 S 8.15 4.24 0.00 3.87 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 55 A 7.91 4.04 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 56 R 7.72 4.31 0.00 2.05 1.98 0.00 3.18 0.00 0.00 3.23 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.70 0.00 57 E 7.88 4.16 0.00 2.09 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 0.00 2.33 2.51 0.00 58 Q 7.46 4.09 0.00 2.19 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.89 0.00 0.00 0.00 0.00 0.00 2.35 2.32 0.00 59 G 8.68 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 60 G 8.93 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 61 C 7.97 4.20 0.00 2.95 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 R 7.91 4.41 0.00 1.83 1.78 0.00 3.21 0.00 0.00 3.33 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.78 0.00 63 P 0.00 3.83 0.00 1.59 0.49 0.00 3.46 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 1.89 1.73 0.00 64 K 8.12 4.14 0.00 1.79 1.87 0.00 1.77 0.00 0.00 2.08 0.00 0.00 3.22 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.62 1.48 7.81 65 Q 8.05 4.49 0.00 1.97 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.75 0.00 0.00 0.00 0.00 0.00 2.27 2.39 0.00 66 K 7.45 4.28 0.00 1.79 1.69 0.00 1.69 0.00 0.00 1.70 0.00 0.00 3.10 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.43 1.52 7.81 67 T 8.35 4.36 4.22 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 1.15 0.00 0.00 68 Y 7.89 4.87 0.00 3.22 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 69 S 10.77 4.93 0.00 3.91 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 70 Y 8.66 5.52 0.00 3.11 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 71 E 9.13 4.35 0.00 1.96 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 2.14 2.18 0.00 72 C 8.84 5.39 0.00 3.16 3.06 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 0.00 0.00 0.00 73 K 8.56 4.41 0.00 1.98 1.65 0.00 1.79 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.34 1.50 7.81 74 A 8.80 3.84 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 75 G 8.16 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 76 T 7.96 4.38 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 1.22 0.00 0.00 77 L 8.21 5.03 0.00 1.59 1.73 0.96 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 78 S 8.35 4.53 0.00 3.78 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 79 C 8.88 5.23 0.00 2.83 3.01 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 80 S 9.20 4.46 0.00 3.80 3.79 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 81 G 8.53 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 82 S 8.21 4.53 0.00 3.87 3.93 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 83 N 8.13 4.33 0.00 2.73 2.78 0.00 0.00 6.88 8.00 0.00 0.00 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 N 8.39 4.76 0.00 2.99 2.99 0.00 0.00 5.70 7.64 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 85 S 8.60 4.37 0.00 3.89 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 86 C 8.29 4.13 0.00 3.00 3.18 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 87 A 8.37 3.95 1.46 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 0.00 0.00 88 A 9.08 3.95 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 89 T 7.54 3.85 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 1.14 0.00 0.00 90 V 7.89 3.38 1.96 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 0.91 0.00 0.00 0.64 0.00 0.00 91 C 7.61 2.92 0.00 2.32 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 92 D 7.49 3.99 0.00 2.90 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 93 C 7.81 4.22 0.00 3.34 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 94 D 7.64 3.63 0.00 2.67 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 95 R 7.90 3.98 0.00 1.79 2.01 0.00 3.09 0.00 0.00 3.15 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.69 0.00 96 L 7.77 3.96 0.00 1.67 1.62 0.93 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 97 A 7.57 3.58 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 A 8.29 3.67 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 99 I 7.72 3.73 1.82 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 1.40 0.70 0.90 0.00 0.00 100 C 7.88 3.97 0.00 3.18 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 F 8.46 4.21 0.00 2.98 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 0.00 102 A 8.52 4.24 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 0.00 103 G 7.96 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 0.00 104 A 7.36 4.68 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 0.00 105 P 0.00 4.45 0.00 2.12 2.08 0.00 3.67 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 2.07 2.13 0.00 106 Y 8.52 4.50 0.00 2.95 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 0.00 107 N 8.84 5.10 0.00 2.97 2.64 0.00 0.00 6.80 8.27 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 0.00 108 D 8.99 4.66 0.00 2.88 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 0.00 109 N 8.40 4.35 0.00 2.94 2.87 0.00 0.00 6.80 8.00 0.00 0.00 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 N 7.88 4.60 0.00 2.25 1.98 0.00 0.00 6.33 7.53 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 0.00 111 Y 7.77 4.48 0.00 2.93 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 0.00 112 N 8.25 3.92 0.00 2.05 2.52 0.00 0.00 7.18 7.68 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 0.00 113 I 7.07 3.99 1.77 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.60 0.77 0.00 0.00 114 D 8.18 4.51 0.00 2.69 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 0.00 115 L 8.21 3.84 0.00 1.66 1.66 0.87 0.47 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 0.00 116 K 8.16 3.91 0.00 1.71 1.98 0.00 1.73 0.00 0.00 1.69 0.00 0.00 3.06 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.40 1.49 7.81 117 A 7.89 4.62 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 0.00 118 R 7.72 4.59 0.00 1.81 1.86 0.00 3.10 0.00 0.00 3.19 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.56 0.00 119 C 8.07 5.01 0.00 2.93 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 0.00 120 Q 8.23 4.18 0.00 2.02 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.65 0.00 0.00 0.00 0.00 0.00 2.29 2.47 0.00 * Residues marked with a * may have inaccurate shift predictions.