NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3242 8.2644 123.5817 52.4079 19.7765 175.9566 2 S 4.3352 8.2980 110.5944 56.5763 65.1731 173.0262 3 A 3.6536 9.3135 126.7852 51.9743 15.6648 177.8027 4 A 5.3943 8.0206 126.2380 51.3628 22.7692 177.8870 5 K 4.5518 7.1270 119.0228 57.0507 32.3991 176.0250 6 G 3.8218 9.3974 121.2845 48.2626 0.0000 176.1939 7 D 3.5203 8.4798 114.3444 52.6318 43.5682 176.2469 8 H 3.9034 9.6478 115.8885 57.3683 28.6720 175.8703 9 G 3.8479 8.5286 107.4118 48.6235 0.0000 173.1529 10 G 3.8277 7.4729 105.2129 45.1332 0.0000 171.4565 *12 G 3.8032 8.1930 107.7721 44.9387 0.0000 173.2215 13 A 4.1269 8.7528 119.6411 55.5226 18.0179 179.7076 14 R 3.8878 8.0659 116.3156 59.8577 30.1486 178.4745 15 T 3.9113 7.9495 114.8922 66.7663 68.6272 176.5023 16 W 4.1869 7.9864 119.8663 59.2759 28.8981 178.6388 17 R 3.8849 8.0113 119.0688 58.9957 29.4978 177.9318 18 F 4.5719 8.4058 120.5376 61.6847 39.3464 177.1618 19 L 3.7551 8.0791 118.4445 57.8612 41.2911 179.6137 20 T 3.7483 7.6953 115.4977 66.6357 68.2107 176.3217 21 F 5.0370 8.1269 117.2640 58.3584 39.3488 176.8164 22 G 4.0405 8.0905 105.8528 45.0404 0.0000 173.1023 23 L 4.4789 7.2413 120.4013 54.7401 47.9102 177.0793 24 A 3.9407 8.4207 119.8707 55.9299 18.1793 179.6115 25 L 3.9906 8.3596 116.7335 57.3919 42.0973 177.9043 26 P 4.4148 0.0000 0.0000 65.4302 31.2343 178.5644 27 S 4.0951 8.5631 114.5275 61.9194 62.7283 177.1856 28 V 3.6001 7.8553 119.9083 65.2704 31.0783 178.0563 29 A 3.9922 8.0760 121.1389 55.0804 18.3122 179.4163 30 L 3.8960 7.8286 116.9424 58.3999 41.8679 179.5557 31 C 4.1857 8.2118 116.2997 62.8754 27.8380 176.3835 32 T 3.7568 7.5511 117.6668 66.0323 67.9035 176.5244 33 L 3.9627 7.8060 121.6234 58.1050 42.4589 177.9507 34 N 4.2696 8.6728 117.0304 56.9517 38.6363 176.8135 35 S 3.7851 7.4752 114.5443 60.9581 63.7006 176.5787 36 W 5.2566 7.8056 120.6741 55.9863 27.6054 175.8888 37 L 4.7627 7.4434 121.8056 57.2034 47.2123 176.4533 38 H 4.7889 8.2989 112.9998 56.5143 29.6960 177.7076 39 S 4.6453 7.2863 115.9335 56.0537 62.2158 173.6473 40 G 3.8084 9.1558 115.2168 44.5502 0.0000 172.2601 41 H 4.3424 8.6485 120.7499 55.9419 27.9383 175.1577 42 R 3.9742 8.4223 124.1359 55.5098 30.4310 176.1794 43 E 3.8327 8.9862 122.5504 56.2856 29.4532 177.3381 44 R 3.9562 8.5824 121.2069 55.4872 29.6402 175.0472 45 P 4.4467 0.0000 0.0000 61.9405 32.0405 175.7745 46 A 4.2191 8.3879 122.4099 52.0685 18.8002 177.4758 47 F 4.3305 9.0492 125.3122 58.1253 40.1901 174.8074 48 I 4.2064 6.7483 127.0480 58.9620 40.5052 175.0257 49 P 4.3895 0.0000 0.0000 62.1686 29.8038 176.8219 50 Y 4.0807 7.1277 115.4386 58.6596 38.6538 177.2377 51 H 4.4134 8.9835 120.7719 57.7228 29.2231 175.6678 52 H 4.7472 8.2480 113.2512 55.2879 29.0649 173.9141 53 L 4.7663 7.3079 119.4677 53.9455 44.7996 175.5532 54 R 3.7670 8.6093 114.9002 57.0853 27.6472 176.9802 55 I 3.8920 7.6768 117.4901 62.3996 37.7752 177.4297 56 R 4.4505 7.8910 121.4347 55.7200 31.6199 174.8099 57 T 4.1735 7.7859 110.4616 62.3840 70.0482 175.8434 58 K 4.3236 7.1625 120.8805 54.2686 34.9564 172.9249 59 P 4.1813 0.0000 0.0000 62.3262 32.0670 176.2576 60 F 3.9457 7.8160 120.2817 57.7948 39.1125 176.4389 61 S 4.3439 8.4200 118.2487 58.6750 62.3827 173.5880 62 W 5.3574 7.4036 117.8076 55.0578 32.0760 176.4359 63 G 3.7890 8.5225 108.0647 47.4597 0.0000 173.8662 64 D 4.6498 8.9252 124.0821 52.7022 39.6370 177.4491 65 G 3.7624 8.2099 106.8280 46.4898 0.0000 174.6845 66 N 4.8931 8.3745 115.5485 52.9624 40.3362 173.5263 67 H 4.9299 8.0373 114.6063 54.4670 30.6971 174.6414 68 T 3.6366 8.4818 113.9679 61.1304 69.4839 174.0496 69 F 3.5409 9.1038 124.4978 61.1661 39.4879 177.0550 70 F 4.7302 7.9212 117.2895 56.7947 38.7276 176.2041 71 H 4.3020 8.1397 120.2227 56.3047 30.5678 173.4112 72 N 4.8540 9.8919 126.6698 51.0676 38.6012 172.7929 73 P 4.2361 0.0000 0.0000 65.7509 31.6684 178.9170 74 R 4.1579 8.2576 116.5145 58.7441 29.9992 177.0655 75 V 4.5084 7.3619 105.2617 60.3860 33.5711 175.0877 76 N 4.8271 8.9524 118.8807 50.6329 38.3747 172.9211 77 P 4.3139 0.0000 0.0000 62.0717 32.4803 176.2736 78 L 4.4708 7.8162 119.7376 52.9275 42.7682 176.2349 79 P 4.2919 0.0000 0.0000 65.5734 31.2032 177.5843 80 T 4.2351 7.8692 105.9815 61.0634 69.1683 174.4008 81 G 2.3701 8.0130 109.1139 44.2059 0.0000 172.9132 82 Y 4.3440 7.4810 115.6932 58.3664 38.1947 176.8124 83 E 4.4257 8.5431 121.8650 55.0398 30.9603 177.0600 84 K 4.1277 8.5228 118.2586 57.1134 32.0566 177.2619 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 A 8.26 4.32 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 2 S 8.30 4.34 0.00 3.85 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 3 A 9.31 3.65 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 4 A 8.02 5.39 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 5 K 7.13 4.55 0.00 1.65 0.78 0.00 1.64 0.00 0.00 1.55 0.00 0.00 2.81 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.26 1.32 7.81 6 G 9.40 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 7 D 8.48 3.52 0.00 2.72 2.48 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 8 H 9.65 3.90 0.00 3.42 3.37 0.00 5.97 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 G 8.53 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 0.00 0.00 0.00 10 G 7.47 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 0.00 0.00 0.00 *12 G 8.19 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 13 A 8.75 4.13 1.40 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 0.00 0.00 0.00 0.00 0.00 0.00 14 R 8.07 3.89 0.00 1.91 1.95 0.00 3.17 0.00 0.00 3.27 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.72 0.00 15 T 7.95 3.91 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 0.79 0.00 0.00 16 W 7.99 4.19 0.00 3.40 3.24 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 0.00 17 R 8.01 3.88 0.00 2.10 2.21 0.00 3.25 0.00 0.00 3.40 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.77 0.00 18 F 8.41 4.57 0.00 3.21 3.20 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 19 L 8.08 3.76 0.00 1.86 1.62 0.13 0.29 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 20 T 7.70 3.75 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 0.63 0.00 0.00 21 F 8.13 5.04 0.00 3.16 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 22 G 8.09 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 23 L 7.24 4.48 0.00 1.55 1.60 0.87 0.94 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 24 A 8.42 3.94 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 25 L 8.36 3.99 0.00 1.81 1.86 1.20 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 26 P 0.00 4.41 0.00 2.25 2.11 0.00 3.83 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 2.22 0.00 27 S 8.56 4.10 0.00 4.14 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 28 V 7.86 3.60 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 1.02 0.00 0.00 0.99 0.00 0.00 29 A 8.08 3.99 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 30 L 7.83 3.90 0.00 1.82 1.70 0.91 0.94 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 31 C 8.21 4.19 0.00 2.98 2.88 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 32 T 7.55 3.76 4.43 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 1.43 0.00 0.00 33 L 7.81 3.96 0.00 1.75 1.93 0.91 1.11 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 34 N 8.67 4.27 0.00 2.64 2.68 0.00 0.00 7.34 7.79 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 35 S 7.48 3.79 0.00 3.59 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 36 W 7.81 5.26 0.00 3.32 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 37 L 7.44 4.76 0.00 2.01 1.66 0.98 1.05 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 38 H 8.30 4.79 0.00 3.13 3.32 0.00 5.91 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 39 S 7.29 4.65 0.00 4.22 3.60 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 40 G 9.16 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 41 H 8.65 4.34 0.00 3.18 3.31 0.00 5.71 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 R 8.42 3.97 0.00 1.84 1.91 0.00 3.27 0.00 0.00 3.25 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.69 0.00 43 E 8.99 3.83 0.00 1.96 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 2.29 0.00 44 R 8.58 3.96 0.00 1.93 1.95 0.00 2.79 0.00 0.00 3.10 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.34 0.00 45 P 0.00 4.45 0.00 2.30 2.17 0.00 3.86 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.04 0.00 46 A 8.39 4.22 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 47 F 9.05 4.33 0.00 3.13 3.10 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 48 I 6.75 4.21 1.57 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 1.31 0.87 0.17 0.00 0.00 49 P 0.00 4.39 0.00 1.96 2.12 0.00 3.49 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.58 0.00 50 Y 7.13 4.08 0.00 2.80 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 51 H 8.98 4.41 0.00 3.24 3.41 0.00 5.69 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 52 H 8.25 4.75 0.00 3.26 3.40 0.00 5.46 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 53 L 7.31 4.77 0.00 1.55 1.58 0.73 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 54 R 8.61 3.77 0.00 1.90 2.08 0.00 3.35 0.00 0.00 3.27 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.78 0.00 55 I 7.68 3.89 1.90 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 1.58 0.77 0.91 0.00 0.00 56 R 7.89 4.45 0.00 1.65 1.64 0.00 3.06 0.00 0.00 2.89 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.48 0.00 57 T 7.79 4.17 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 1.19 0.00 0.00 58 K 7.16 4.32 0.00 1.61 1.55 0.00 1.75 0.00 0.00 1.73 0.00 0.00 3.03 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.20 1.32 7.81 59 P 0.00 4.18 0.00 2.08 1.91 0.00 3.72 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.91 0.00 60 F 7.82 3.95 0.00 2.29 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 61 S 8.42 4.34 0.00 4.16 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 62 W 7.40 5.36 0.00 3.48 3.33 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 63 G 8.52 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 0.00 0.00 0.00 64 D 8.93 4.65 0.00 2.80 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 65 G 8.21 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 66 N 8.37 4.89 0.00 2.60 2.79 0.00 0.00 6.98 7.90 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 67 H 8.04 4.93 0.00 3.16 3.16 0.00 5.96 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 T 8.48 3.64 4.35 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 1.38 0.00 0.00 69 F 9.10 3.54 0.00 2.64 2.88 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 70 F 7.92 4.73 0.00 3.10 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 71 H 8.14 4.30 0.00 3.35 3.28 0.00 5.87 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 N 9.89 4.85 0.00 2.69 2.82 0.00 0.00 6.78 7.59 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 73 P 0.00 4.24 0.00 2.25 2.18 0.00 3.68 0.00 0.00 3.90 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 74 R 8.26 4.16 0.00 1.75 1.95 0.00 3.29 0.00 0.00 3.15 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.55 0.00 75 V 7.36 4.51 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 0.81 0.00 0.00 0.98 0.00 0.00 76 N 8.95 4.83 0.00 2.60 2.84 0.00 0.00 6.98 5.12 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 77 P 0.00 4.31 0.00 2.04 0.87 0.00 3.79 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.83 0.00 78 L 7.82 4.47 0.00 1.81 1.56 0.89 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 79 P 0.00 4.29 0.00 2.03 2.16 0.00 3.62 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.28 0.00 80 T 7.87 4.24 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 1.18 0.00 0.00 81 G 8.01 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 0.00 0.00 0.00 82 Y 7.48 4.34 0.00 2.95 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 83 E 8.54 4.43 0.00 2.05 1.95 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 2.34 2.41 0.00 84 K 8.52 4.13 0.00 1.74 1.74 0.00 1.68 0.00 0.00 1.75 0.00 0.00 3.12 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.45 1.51 7.81 * Residues marked with a * may have inaccurate shift predictions.