NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 9 S 4.5247 8.3193 117.1037 57.8557 63.9582 171.7147 10 I 4.4947 8.2379 109.7956 60.5225 39.7249 172.7961 11 I 4.4679 8.7856 127.3144 59.9674 40.1330 176.8598 12 R 4.6522 8.4571 123.1284 54.5536 31.2065 172.9833 13 F 5.0474 7.7193 115.1544 55.2699 40.9814 173.5389 14 S 4.7432 8.5602 116.7743 56.9317 64.5788 174.1437 15 V 4.5327 8.0005 121.6060 61.1995 34.2582 174.8801 16 S 4.8580 8.3597 121.8816 56.9985 64.9552 173.3122 17 L 4.4594 7.8979 122.8727 52.6559 44.8149 175.2862 18 Q 4.1252 8.5123 123.9669 55.9871 30.4806 177.6375 19 Q 3.9554 8.7442 124.5856 59.3760 28.9535 178.4330 20 N 4.4248 8.0880 116.9450 55.1269 37.5280 177.0989 21 L 4.1185 7.6903 121.5482 57.4800 41.9416 178.5478 22 L 3.9250 8.1439 120.4422 58.2699 42.0653 178.8608 23 D 4.3712 8.3789 119.1212 57.3078 40.5181 178.5593 24 E 4.0233 7.5935 117.0444 58.9589 29.6517 178.9462 25 L 4.0688 8.1600 120.6953 58.4123 42.3125 178.8837 26 D 4.4503 8.4607 118.9745 57.0254 40.4184 178.0475 27 N 4.2901 7.8726 116.8746 56.2363 38.8380 175.9965 28 R 4.4768 8.1926 117.6766 56.9331 30.8555 177.8368 29 I 3.8730 7.4205 120.2941 64.5856 36.9985 178.0979 30 I 3.8100 7.6170 119.9348 64.3918 37.1190 178.7300 31 K 4.0829 8.0904 118.1451 59.4361 32.5268 177.7805 32 N 4.7536 7.5948 113.9203 52.7567 38.9915 175.6533 33 G 3.9275 7.8114 108.6130 45.2201 0.0000 173.9668 34 Y 4.4603 7.6578 117.4434 57.8453 38.4967 176.0478 35 S 4.4937 9.2563 119.3001 60.0986 63.7922 174.4285 36 S 4.6507 7.5820 113.3225 55.6661 65.6311 175.1293 37 R 3.8079 8.5978 121.1905 59.4997 29.7209 178.4860 38 S 3.9807 7.9884 112.4884 61.6115 61.8463 175.9418 39 E 3.9961 7.8351 120.6466 59.2431 29.1765 179.2103 40 L 2.8551 7.0349 119.6909 57.5270 41.9823 179.0676 41 V 3.4910 7.6616 118.2627 65.8950 31.3663 177.6349 42 R 3.9065 7.9727 118.4459 59.9731 29.7955 178.1685 43 D 4.4278 7.8241 117.4863 57.4425 40.8391 178.6050 44 M 4.0815 8.0772 119.3079 58.3996 31.8633 178.8984 45 I 3.7387 8.1188 120.1736 64.4008 37.3352 178.5003 46 R 4.0761 8.3312 119.2681 59.3808 29.9768 178.5719 47 E 3.9382 8.3058 118.8145 59.3614 29.5745 178.8829 48 K 4.0116 8.2549 119.5621 59.4438 32.2873 178.7170 49 L 3.9950 8.3814 119.7661 57.7014 41.5246 179.7045 50 V 3.9341 8.2347 118.1309 66.2024 31.5401 177.6923 51 E 4.0280 8.2167 118.2883 59.8832 29.1810 179.2964 52 D 4.4466 8.5620 118.9765 57.3324 40.6139 178.3961 53 N 4.4097 8.3214 116.8249 56.6225 39.2364 176.7655 54 W 4.0535 8.7935 120.2023 59.5591 28.8861 178.4250 55 A 4.3033 8.2214 120.4719 54.3059 17.9144 177.8883 56 E 4.2214 7.8799 115.3889 56.5295 30.3399 176.1322 *57 D 4.2877 7.3805 117.6343 53.3664 39.7135 181.3541 58 N 3.9934 8.7044 122.5149 52.4080 39.1816 173.4880 59 P 4.1477 0.0000 0.0000 64.3835 31.8896 176.8362 60 N 4.4756 7.6411 115.1165 54.9515 38.9601 175.2692 61 D 4.3978 7.3424 118.5518 54.4964 41.5910 175.5567 62 E 4.6501 8.5628 123.6331 56.1757 31.3531 175.7803 63 S 4.7359 9.5097 112.8027 57.9169 63.9851 174.5894 64 K 4.1431 7.9073 120.9022 56.9621 32.9470 175.9071 65 I 5.2480 8.4762 122.9964 59.9828 40.6658 174.2931 66 A 4.7947 8.7388 125.3121 51.1711 23.5884 175.0680 67 V 4.7071 8.7321 119.2360 61.0474 34.5676 174.0369 68 L 4.9255 9.1745 130.6570 53.8125 43.7757 174.9305 69 V 4.8917 8.8440 127.1052 61.3699 33.7564 174.5255 70 V 5.1119 9.0024 127.3533 61.2845 35.0647 173.8575 71 I 5.1754 9.0711 128.6709 59.8139 39.7624 174.2998 72 Y 5.2002 8.3639 123.6140 55.7731 42.3279 173.5836 73 D 5.8495 9.4804 120.4731 53.3006 41.1618 176.5849 74 H 4.6411 8.8179 122.2825 57.8302 28.9627 175.8112 75 H 4.4056 8.0429 116.4972 55.7815 28.7515 175.1817 76 Q 4.2447 7.9479 122.9995 54.3830 27.9137 174.7386 77 R 3.8249 8.2911 125.3120 57.9767 30.6843 176.1882 78 E 4.0745 9.0232 124.0195 56.8920 29.9388 175.8526 79 L 3.8928 7.6844 119.5782 58.2649 41.8706 178.2198 80 N 4.1133 8.1136 116.1960 56.9144 38.9441 176.3342 81 Q 3.8916 7.9974 120.2403 59.0450 29.0896 177.9496 82 R 3.8226 8.0374 119.6741 59.7020 30.0444 178.2557 83 M 3.9524 8.0584 118.4438 58.5146 31.9745 178.7372 84 I 3.5813 7.8405 119.8552 64.5933 37.2837 178.2473 85 D 4.3632 8.5404 119.8688 57.3216 40.3864 178.9363 86 I 3.6727 7.7180 119.5294 64.3326 37.4363 177.9013 87 Q 4.1227 8.3024 120.6039 59.7211 28.7114 178.0442 88 H 4.2676 8.4575 115.9033 58.6745 28.8245 176.8580 89 A 4.3507 7.8821 120.2899 53.1221 18.7690 179.0536 90 S 4.2431 7.9516 112.8293 59.4699 63.2783 175.6321 91 G 3.9856 8.3534 110.0104 45.3253 0.0000 173.5131 92 T 4.2904 7.4804 109.3871 61.5809 69.9425 173.0083 93 H 4.9583 9.3994 122.6996 54.3747 31.9593 173.2689 94 V 4.2408 8.4496 126.3233 62.7986 31.3986 175.4582 95 L 4.2334 9.1646 129.3637 57.1172 42.8302 176.9078 96 C 4.8416 7.4495 115.1809 58.6547 34.6995 172.8592 97 T 5.2121 8.6464 114.6572 60.2725 71.6371 173.0745 98 T 4.7854 8.8670 119.6000 62.1604 72.4782 172.5370 99 H 5.4974 8.9655 121.8791 53.9252 31.9261 173.0790 100 I 4.6001 8.7905 115.6393 59.3480 41.1921 174.0362 101 H 4.7685 8.5394 121.3484 55.2070 28.8209 175.2983 102 M 4.2026 8.9209 125.0413 58.1056 32.1976 175.8215 103 D 4.5832 7.3286 115.6116 52.9532 41.3661 175.0656 104 E 3.8235 8.8695 117.1976 59.3468 29.8115 177.1858 105 H 4.9387 9.1174 114.4587 55.2780 30.4894 173.1459 106 N 5.5135 8.0431 117.4388 51.3568 42.0321 172.9079 107 C 4.9705 8.9133 123.7533 57.3106 34.8366 171.9589 108 L 5.1690 8.6689 127.5133 53.2754 44.0942 174.4746 109 E 5.2363 9.6070 127.2577 54.5029 32.9758 174.2486 110 T 5.0413 8.8332 116.6178 59.9710 71.7395 172.9979 111 I 4.8168 8.9539 126.3096 59.5732 40.3380 174.4126 112 I 4.7466 9.0039 129.0633 60.0831 38.7290 174.9549 113 L 5.2990 8.9527 126.9949 52.8945 45.4810 175.3978 114 Q 5.4937 9.3564 122.8621 52.7369 32.8587 175.4439 115 G 3.8082 7.8292 110.8510 45.3406 0.0000 171.0905 116 N 4.7192 8.1864 117.8022 52.7641 41.1689 177.0996 117 S 3.7627 8.0247 120.1143 61.3857 62.8974 176.6131 118 F 4.5454 9.1803 122.4488 60.5651 38.7591 177.2986 119 E 4.0547 8.6254 117.4352 59.6464 29.5144 179.4749 120 I 3.8237 8.0886 119.8203 64.5713 37.2578 178.3464 121 Q 4.0958 8.5301 120.4369 59.0261 28.7839 178.2596 122 R 3.8762 8.4213 120.1691 59.2335 30.1018 177.9358 123 L 3.9319 7.9863 120.2105 58.4467 41.9751 178.7354 124 Q 3.9498 7.9735 118.6980 59.2461 28.7522 178.3873 125 L 3.9798 7.6616 118.6623 57.7627 41.8834 179.1530 126 E 4.0930 8.5122 118.8088 59.4807 29.4687 179.2164 127 I 3.7574 8.0763 120.3309 64.6049 37.0323 178.7773 128 G 3.8058 8.3906 105.1251 47.1654 0.0000 175.0883 129 G 3.8029 7.6498 105.5942 44.8626 0.0000 174.0383 130 L 4.2379 7.4086 122.2986 53.8676 42.4556 176.5083 131 R 4.1245 8.3281 123.0144 57.8493 30.6681 176.6833 132 G 4.1059 9.1062 112.7815 46.2451 0.0000 172.8143 133 V 4.4981 7.3442 119.7081 62.1169 31.7926 175.5531 134 K 4.4730 9.0854 127.3752 57.8403 33.3016 176.9969 135 F 4.6685 8.0898 119.3134 57.2485 42.8788 173.0550 136 A 4.7967 7.8325 128.1091 51.1155 20.9081 175.0045 137 K 4.3400 8.9409 123.2964 55.2573 35.5535 175.1650 138 L 4.7977 8.4970 127.1167 54.4375 43.0819 176.1193 139 T 4.4001 9.0326 120.6621 62.0390 70.1513 173.7980 140 K 4.5046 8.3397 125.7977 54.6477 33.8239 175.8454 141 A 5.1475 8.6062 124.6170 50.3722 22.2992 175.8155 142 S 4.8663 9.3718 115.6579 56.2518 66.4241 176.0055 143 S 2.7900 8.4659 118.2641 60.6352 62.7270 176.5213 144 F 4.1632 7.8783 114.9323 59.2501 37.7271 176.1872 145 E 4.0093 7.2606 121.2422 58.3758 29.3180 176.8325 146 Y 4.8210 7.0078 112.1913 56.1033 39.5782 174.9002 147 N 4.6119 8.1873 123.7613 53.6341 38.7910 174.5907 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 9 S 8.32 4.52 0.00 3.65 3.78 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 10 I 8.24 4.49 1.91 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.03 0.94 0.00 0.00 11 I 8.79 4.47 1.96 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 1.31 0.56 1.01 0.00 0.00 12 R 8.46 4.65 0.00 1.81 1.69 0.00 3.25 0.00 0.00 3.28 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.16 0.00 13 F 7.72 5.05 0.00 3.08 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 14 S 8.56 4.74 0.00 3.92 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 15 V 8.00 4.53 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 0.88 0.00 0.00 1.01 0.00 0.00 16 S 8.36 4.86 0.00 3.89 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 17 L 7.90 4.46 0.00 1.53 1.47 0.92 0.74 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 18 Q 8.51 4.13 0.00 2.13 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.65 0.00 0.00 0.00 0.00 0.00 2.45 2.36 0.00 19 Q 8.74 3.96 0.00 2.15 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.92 0.00 0.00 0.00 0.00 0.00 2.43 2.48 0.00 20 N 8.09 4.42 0.00 2.95 3.06 0.00 0.00 6.29 6.67 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 21 L 7.69 4.12 0.00 1.85 1.74 0.92 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 22 L 8.14 3.92 0.00 1.74 1.84 0.95 1.32 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 23 D 8.38 4.37 0.00 2.72 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 24 E 7.59 4.02 0.00 2.12 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 2.34 2.57 0.00 25 L 8.16 4.07 0.00 1.73 1.81 0.87 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 26 D 8.46 4.45 0.00 2.84 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 27 N 7.87 4.29 0.00 2.98 3.07 0.00 0.00 7.12 6.98 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 28 R 8.19 4.48 0.00 1.98 1.97 0.00 3.47 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.66 0.00 29 I 7.42 3.87 1.90 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.92 0.96 0.00 0.00 30 I 7.62 3.81 1.89 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.62 0.92 0.00 0.00 31 K 8.09 4.08 0.00 1.92 1.97 0.00 1.58 0.00 0.00 1.88 0.00 0.00 3.04 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.59 1.57 7.81 32 N 7.59 4.75 0.00 3.17 3.06 0.00 0.00 7.25 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 33 G 7.81 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 0.00 0.00 0.00 34 Y 7.66 4.46 0.00 3.17 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 35 S 9.26 4.49 0.00 4.11 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 36 S 7.58 4.65 0.00 3.94 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 37 R 8.60 3.81 0.00 1.86 1.91 0.00 3.13 0.00 0.00 3.21 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.74 0.00 38 S 7.99 3.98 0.00 3.84 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 39 E 7.84 4.00 0.00 2.26 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 0.00 2.40 2.37 0.00 40 L 7.03 2.86 0.00 0.63 1.33 0.71 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 41 V 7.66 3.49 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 1.01 0.00 0.00 0.90 0.00 0.00 42 R 7.97 3.91 0.00 2.02 2.14 0.00 3.20 0.00 0.00 3.21 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.75 0.00 43 D 7.82 4.43 0.00 2.92 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 44 M 8.08 4.08 0.00 2.07 2.22 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 2.68 2.57 0.00 45 I 8.12 3.74 2.07 0.00 0.00 1.00 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 0.95 0.97 0.00 0.00 46 R 8.33 4.08 0.00 2.05 2.08 0.00 3.21 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.92 0.00 47 E 8.31 3.94 0.00 2.16 2.18 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 2.47 2.32 0.00 48 K 8.25 4.01 0.00 1.94 1.81 0.00 1.61 0.00 0.00 1.67 0.00 0.00 3.06 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.45 1.54 7.81 49 L 8.38 3.99 0.00 1.87 1.51 0.83 0.64 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 50 V 8.23 3.93 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 1.01 0.00 0.00 1.14 0.00 0.00 51 E 8.22 4.03 0.00 2.27 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 0.00 2.31 2.49 0.00 52 D 8.56 4.45 0.00 2.83 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 53 N 8.32 4.41 0.00 3.00 3.42 0.00 0.00 7.28 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 54 W 8.79 4.05 0.00 3.61 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 55 A 8.22 4.30 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 7.88 4.22 0.00 2.05 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 0.00 2.50 2.23 0.00 *57 D 7.38 4.29 0.00 2.76 2.58 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 58 N 8.70 3.99 0.00 2.59 2.74 0.00 0.00 6.92 7.71 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 59 P 0.00 4.15 0.00 2.21 2.20 0.00 3.48 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.12 0.00 60 N 7.64 4.48 0.00 2.91 2.87 0.00 0.00 6.89 7.94 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 61 D 7.34 4.40 0.00 2.45 2.51 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 0.00 0.00 0.00 0.00 62 E 8.56 4.65 0.00 1.90 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 2.32 2.18 0.00 63 S 9.51 4.74 0.00 3.70 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 64 K 7.91 4.14 0.00 1.53 1.24 0.00 0.61 0.00 0.00 1.22 0.00 0.00 2.22 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.03 0.70 7.81 65 I 8.48 5.25 1.97 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 1.36 1.01 0.96 0.00 0.00 66 A 8.74 4.79 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 67 V 8.73 4.71 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 0.80 0.00 0.00 0.93 0.00 0.00 68 L 9.17 4.93 0.00 1.78 1.54 0.97 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 69 V 8.84 4.89 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 1.12 0.00 0.00 1.00 0.00 0.00 70 V 9.00 5.11 2.30 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 0.95 0.00 0.00 1.00 0.00 0.00 71 I 9.07 5.18 1.99 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.49 0.94 0.00 0.00 72 Y 8.36 5.20 0.00 3.23 3.07 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 73 D 9.48 5.85 0.00 2.84 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 74 H 8.82 4.64 0.00 3.24 3.27 0.00 5.76 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 H 8.04 4.41 0.00 3.25 3.35 0.00 5.65 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 Q 7.95 4.24 0.00 2.17 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.95 6.91 0.00 0.00 0.00 0.00 0.00 2.36 2.32 0.00 77 R 8.29 3.82 0.00 1.82 1.85 0.00 3.35 0.00 0.00 3.16 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 78 E 9.02 4.07 0.00 2.28 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 0.00 2.24 2.33 0.00 79 L 7.68 3.89 0.00 1.81 1.78 0.85 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 80 N 8.11 4.11 0.00 2.81 2.80 0.00 0.00 6.80 7.49 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 81 Q 8.00 3.89 0.00 2.19 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.67 0.00 0.00 0.00 0.00 0.00 2.42 2.61 0.00 82 R 8.04 3.82 0.00 2.10 1.98 0.00 3.14 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.66 0.00 83 M 8.06 3.95 0.00 1.98 2.08 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.44 0.00 84 I 7.84 3.58 1.92 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 1.48 0.56 0.67 0.00 0.00 85 D 8.54 4.36 0.00 2.75 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 86 I 7.72 3.67 1.98 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 0.54 0.95 0.00 0.00 87 Q 8.30 4.12 0.00 2.14 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.77 0.00 0.00 0.00 0.00 0.00 2.39 2.57 0.00 88 H 8.46 4.27 0.00 3.09 3.34 0.00 5.72 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 A 7.88 4.35 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 90 S 7.95 4.24 0.00 4.09 4.15 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 91 G 8.35 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 0.00 0.00 0.00 92 T 7.48 4.29 4.39 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 1.27 0.00 0.00 93 H 9.40 4.96 0.00 3.17 3.29 0.00 5.59 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 94 V 8.45 4.24 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 0.89 0.00 0.00 0.96 0.00 0.00 95 L 9.16 4.23 0.00 1.47 1.65 0.90 -0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 96 C 7.45 4.84 0.00 2.93 2.68 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 97 T 8.65 5.21 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 1.23 0.00 0.00 98 T 8.87 4.79 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 1.21 0.00 0.00 99 H 8.97 5.50 0.00 2.94 3.19 0.00 5.84 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 I 8.79 4.60 1.83 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.86 0.88 0.00 0.00 101 H 8.54 4.77 0.00 2.97 3.15 0.00 5.72 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 M 8.92 4.20 0.00 1.97 2.16 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.42 0.00 103 D 7.33 4.58 0.00 2.85 2.76 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 0.00 104 E 8.87 3.82 0.00 1.80 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 2.37 0.00 105 H 9.12 4.94 0.00 3.10 3.28 0.00 5.55 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 N 8.04 5.51 0.00 2.60 2.62 0.00 0.00 6.30 7.54 0.00 0.00 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 C 8.91 4.97 0.00 2.56 1.84 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 0.00 108 L 8.67 5.17 0.00 1.67 1.44 0.84 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 109 E 9.61 5.24 0.00 2.13 1.89 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 2.15 2.07 0.00 110 T 8.83 5.04 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 1.22 0.00 0.00 111 I 8.95 4.82 1.89 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.68 0.93 0.00 0.00 112 I 9.00 4.75 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.97 0.90 0.00 0.00 113 L 8.95 5.30 0.00 1.63 1.58 0.98 0.56 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 0.00 114 Q 9.36 5.49 0.00 2.04 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.80 0.00 0.00 0.00 0.00 0.00 2.43 2.33 0.00 115 G 7.83 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 0.00 116 N 8.19 4.72 0.00 2.89 2.80 0.00 0.00 7.39 8.38 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 0.00 117 S 8.02 3.76 0.00 4.15 3.39 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 0.00 118 F 9.18 4.55 0.00 3.33 3.04 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 0.00 119 E 8.63 4.05 0.00 2.21 2.14 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 2.59 2.50 0.00 120 I 8.09 3.82 2.22 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.33 1.17 0.00 0.00 121 Q 8.53 4.10 0.00 2.47 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.81 0.00 0.00 0.00 0.00 0.00 2.44 2.47 0.00 122 R 8.42 3.88 0.00 2.03 2.15 0.00 3.18 0.00 0.00 3.12 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.64 0.00 123 L 7.99 3.93 0.00 1.94 1.92 0.93 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 124 Q 7.97 3.95 0.00 2.17 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.59 0.00 0.00 0.00 0.00 0.00 2.31 2.50 0.00 125 L 7.66 3.98 0.00 1.84 1.71 0.93 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 126 E 8.51 4.09 0.00 1.99 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 2.33 2.57 0.00 127 I 8.08 3.76 1.86 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.85 0.89 0.00 0.00 128 G 8.39 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 0.00 129 G 7.65 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 0.00 130 L 7.41 4.24 0.00 1.73 1.57 0.87 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 131 R 8.33 4.12 0.00 1.77 1.85 0.00 3.37 0.00 0.00 3.37 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.58 0.00 132 G 9.11 4.11 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 V 7.34 4.50 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 0.87 0.00 0.00 0.95 0.00 0.00 134 K 9.09 4.47 0.00 1.84 1.94 0.00 2.00 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.47 1.48 7.81 135 F 8.09 4.67 0.00 3.14 2.85 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 0.00 136 A 7.83 4.80 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 0.00 137 K 8.94 4.34 0.00 1.06 1.53 0.00 1.62 0.00 0.00 1.65 0.00 0.00 2.83 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.27 1.25 7.81 138 L 8.50 4.80 0.00 1.44 1.40 0.90 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 139 T 9.03 4.40 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 1.18 0.00 0.00 140 K 8.34 4.50 0.00 0.99 0.74 0.00 1.13 0.00 0.00 0.61 0.00 0.00 2.69 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.30 0.73 7.81 141 A 8.61 5.15 1.45 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 0.00 142 S 9.37 4.87 0.00 3.37 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 0.00 143 S 8.47 2.79 0.00 3.71 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 0.00 144 F 7.88 4.16 0.00 3.07 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 0.00 145 E 7.26 4.01 0.00 1.89 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 0.00 1.83 1.47 0.00 146 Y 7.01 4.82 0.00 2.93 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 0.00 147 N 8.19 4.61 0.00 2.77 2.74 0.00 0.00 6.77 8.29 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 * Residues marked with a * may have inaccurate shift predictions.