NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 K 4.2908 8.3149 121.7956 56.0883 34.4092 176.3551 5 T 4.2591 7.7625 115.5343 62.0910 70.9310 174.1966 6 F 4.2396 9.7535 126.8464 61.9429 39.3332 177.2695 7 E 4.1870 8.4789 117.4678 59.2690 29.1379 179.1431 8 E 4.0598 8.0647 118.3706 59.4564 29.8162 179.0891 9 L 4.0392 7.9638 118.9942 57.5845 41.6481 179.4311 10 F 4.1203 8.0503 120.4499 61.5713 38.9345 177.4573 11 T 3.7716 7.7074 114.2364 66.2329 68.1517 176.7191 12 E 3.9627 7.8993 120.9227 59.4000 29.2147 179.3201 13 L 3.9982 7.6535 118.5499 57.7702 41.3929 179.5537 14 Q 3.7695 7.3901 117.2139 58.9539 28.8335 178.0340 15 H 4.3417 7.8471 118.9393 59.0802 29.7840 177.3560 16 K 4.0385 7.7634 117.9062 58.2267 31.8831 178.0692 17 A 4.3610 7.5503 119.8008 52.2337 18.9281 178.5218 18 A 4.0351 7.7490 120.1677 53.9664 19.7605 177.6033 19 N 4.8801 6.8221 112.2353 53.6798 38.4643 175.9022 *24 T 4.3203 8.2158 123.0118 64.6233 70.2711 175.9342 25 S 4.2688 7.9878 115.4745 59.3418 63.4677 175.3931 26 R 4.1755 8.5373 119.6045 56.7262 30.7862 177.0517 27 T 4.2068 8.4518 117.1641 62.9084 70.5147 174.6516 28 A 3.9058 7.6090 127.7101 52.3403 17.5743 177.9253 29 E 4.6059 8.4670 125.3458 56.1075 28.8328 177.3322 30 L 4.0389 7.6623 121.4097 57.0885 42.1521 178.8060 31 V 3.5853 7.8134 117.4267 65.9601 31.3442 177.1170 32 D 4.4413 7.4779 116.6718 57.2815 41.2320 178.1766 33 K 4.1315 7.8650 117.3603 57.5118 32.4610 176.9955 34 G 3.8722 8.3044 104.8198 44.2346 0.0000 174.1204 35 V 3.5496 8.4492 116.5245 66.3197 31.3497 177.2285 36 H 4.0068 8.3069 117.0995 59.4547 29.7013 176.9132 37 A 4.0566 7.9856 121.8995 55.1514 18.2353 179.5543 38 I 3.9329 7.7678 118.4119 64.3416 37.2065 178.8095 39 G 3.5977 8.7057 107.0088 47.6034 0.0000 175.8652 40 K 3.9490 7.9161 120.5055 59.3284 32.0114 179.6101 41 K 3.9232 7.6339 117.2985 59.2850 31.9350 179.6036 42 V 3.5817 7.9249 118.6698 66.1138 31.2747 178.3465 43 V 3.6774 7.9146 118.2281 65.7363 31.3287 177.8411 44 E 4.1261 8.4149 117.6763 59.3899 29.6384 178.9711 45 E 4.0252 8.6438 119.7234 58.9058 29.5038 179.0211 46 A 4.0431 8.2193 120.7515 55.2926 18.2362 179.6114 47 A 4.2014 7.5759 116.7032 55.3026 18.5030 179.4593 48 E 4.1049 8.0496 116.5376 59.3750 29.7810 179.2371 49 V 3.8821 8.4723 118.6899 65.7941 31.6527 178.6818 50 W 4.4763 8.1923 124.0258 58.3731 30.1876 177.0576 *52 A 4.2991 7.9797 121.8248 51.7155 19.9090 179.5403 53 A 4.0231 8.4544 117.9886 55.2055 18.7033 178.4243 54 E 4.1065 8.2770 115.3136 58.3632 29.9616 176.7072 55 Y 4.5159 7.9446 113.2980 58.0139 39.5887 175.1162 56 E 4.5757 8.1399 119.1689 54.3933 31.9975 175.8616 57 G 3.9629 8.1771 106.4882 44.0194 0.0000 174.6447 58 K 3.9714 8.5115 119.2067 59.4725 31.8660 179.1744 59 D 4.3048 8.0891 117.4744 57.3485 41.3776 177.9152 60 A 3.9829 8.0606 120.5832 55.2262 18.4107 179.3277 61 A 4.0293 8.1391 119.0342 54.9894 18.3304 179.8308 62 A 3.9575 8.0775 119.5392 55.2546 18.5881 179.3563 63 E 3.8915 8.4639 118.1484 59.6600 29.6888 178.9998 64 E 4.0770 8.2147 118.3423 59.4318 29.4074 179.4145 65 I 3.8230 8.0378 120.2686 64.3011 37.0803 178.6064 66 S 4.2235 8.5052 115.5376 61.5929 62.7833 176.6548 67 Q 4.0921 8.1140 121.2245 58.5046 28.3668 178.4224 68 L 4.0343 8.0582 121.3795 58.1866 42.1822 178.9068 69 L 4.0959 8.2986 119.2075 58.0595 41.5494 178.7184 70 Y 4.1432 8.3097 119.4522 61.4054 38.4799 178.2287 71 H 3.9090 8.0811 115.4127 58.5463 28.8025 177.7286 72 V 3.7485 7.8391 119.8854 65.9553 31.4250 177.8350 73 Q 4.2729 8.2480 117.4065 58.1427 29.8875 178.3224 74 V 3.6368 7.4078 121.5680 63.1481 28.4251 175.8862 *77 V 3.9339 7.7639 122.1087 62.2465 33.4198 177.4704 78 A 4.0214 8.2673 121.4579 54.5804 18.2267 178.1664 79 R 4.3356 7.9780 111.9642 55.5693 30.7238 176.6863 80 G 3.9068 7.7646 105.7281 46.3033 0.0000 173.7014 81 I 4.1554 7.7534 119.9201 60.1965 38.4469 176.2411 82 S 4.9272 8.5909 119.7197 56.6736 66.5055 175.4636 83 L 3.3824 8.1091 121.9569 57.8001 41.2242 179.5991 84 D 4.4653 7.9362 118.4507 57.3199 40.6111 178.2319 85 D 4.3582 7.5833 118.4654 57.3529 41.1451 178.8864 86 V 3.7182 7.4701 118.0509 66.3602 31.4855 177.6246 87 Y 4.5057 8.3135 116.5438 61.2325 37.4133 178.6262 88 A 4.0197 8.0779 120.9703 55.3913 18.7467 178.8871 89 H 4.4772 8.2728 114.2763 58.0233 28.8256 177.2281 90 L 4.2900 7.5403 118.7460 55.9663 41.3805 177.0900 91 L 4.3068 7.5809 124.2774 54.7673 41.8735 176.1358 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 4 K 8.31 4.29 0.00 1.76 1.94 0.00 1.76 0.00 0.00 1.73 0.00 0.00 2.96 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.36 1.50 7.81 5 T 7.76 4.26 4.40 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 1.33 0.00 0.00 6 F 9.75 4.24 0.00 3.13 3.19 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 7 E 8.48 4.19 0.00 2.19 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 2.76 2.69 0.00 8 E 8.06 4.06 0.00 2.20 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 2.44 2.46 0.00 9 L 7.96 4.04 0.00 1.68 1.73 0.98 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 10 F 8.05 4.12 0.00 2.90 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 11 T 7.71 3.77 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 1.18 0.00 0.00 12 E 7.90 3.96 0.00 2.11 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 2.59 2.49 0.00 13 L 7.65 4.00 0.00 1.61 1.57 0.93 1.21 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 14 Q 7.39 3.77 0.00 1.97 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.07 6.98 0.00 0.00 0.00 0.00 0.00 1.85 1.60 0.00 15 H 7.85 4.34 0.00 3.13 3.41 0.00 5.59 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 K 7.76 4.04 0.00 1.74 1.83 0.00 1.75 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.64 7.81 17 A 7.55 4.36 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 18 A 7.75 4.04 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 19 N 6.82 4.88 0.00 2.53 1.95 0.00 0.00 6.95 7.42 0.00 0.00 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 T 8.22 4.32 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 1.21 0.00 0.00 25 S 7.99 4.27 0.00 3.85 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 26 R 8.54 4.18 0.00 1.72 1.72 0.00 3.15 0.00 0.00 3.22 7.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.56 0.00 27 T 8.45 4.21 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 28 A 7.61 3.91 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 29 E 8.47 4.61 0.00 2.00 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 2.49 2.28 0.00 30 L 7.66 4.04 0.00 1.70 1.73 1.04 0.86 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 31 V 7.81 3.59 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 0.81 0.00 0.00 0.89 0.00 0.00 32 D 7.48 4.44 0.00 2.81 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 33 K 7.87 4.13 0.00 1.89 1.88 0.00 1.78 0.00 0.00 1.73 0.00 0.00 3.04 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.52 7.81 34 G 8.30 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.45 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 1.03 0.00 0.00 0.93 0.00 0.00 36 H 8.31 4.01 0.00 3.30 3.31 0.00 5.92 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 37 A 7.99 4.06 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 38 I 7.77 3.93 1.87 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 1.46 0.72 0.90 0.00 0.00 39 G 8.71 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 0.00 0.00 0.00 40 K 7.92 3.95 0.00 1.98 1.85 0.00 1.68 0.00 0.00 1.65 0.00 0.00 3.00 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.39 1.58 7.81 41 K 7.63 3.92 0.00 1.79 1.47 0.00 1.79 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.63 1.53 7.81 42 V 7.92 3.58 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 1.01 0.00 0.00 0.98 0.00 0.00 43 V 7.91 3.68 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 1.01 0.00 0.00 0.93 0.00 0.00 44 E 8.41 4.13 0.00 2.25 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 0.00 2.53 2.35 0.00 45 E 8.64 4.03 0.00 2.08 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 2.53 2.57 0.00 46 A 8.22 4.04 1.44 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 47 A 7.58 4.20 1.44 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 48 E 8.05 4.10 0.00 2.18 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 0.00 2.40 2.47 0.00 49 V 8.47 3.88 2.35 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 1.12 0.00 0.00 1.03 0.00 0.00 50 W 8.19 4.48 0.00 3.49 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 *52 A 7.98 4.30 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 53 A 8.45 4.02 1.50 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 0.00 0.00 0.00 0.00 0.00 0.00 54 E 8.28 4.11 0.00 2.09 1.80 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 1.77 1.65 0.00 55 Y 7.94 4.52 0.00 2.96 2.95 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 56 E 8.14 4.58 0.00 2.12 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 0.00 2.34 2.42 0.00 57 G 8.18 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 58 K 8.51 3.97 0.00 1.82 1.89 0.00 1.68 0.00 0.00 1.75 0.00 0.00 2.89 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.54 1.52 7.81 59 D 8.09 4.30 0.00 2.80 2.67 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 60 A 8.06 3.98 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.14 4.03 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.08 3.96 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 63 E 8.46 3.89 0.00 2.06 2.13 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 2.33 2.38 0.00 64 E 8.21 4.08 0.00 2.25 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 2.60 2.55 0.00 65 I 8.04 3.82 2.06 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 1.62 0.97 0.96 0.00 0.00 66 S 8.51 4.22 0.00 4.10 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 0.00 67 Q 8.11 4.09 0.00 2.38 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.85 0.00 0.00 0.00 0.00 0.00 2.54 2.57 0.00 68 L 8.06 4.03 0.00 1.85 1.94 1.01 0.74 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 69 L 8.30 4.10 0.00 2.05 2.02 1.05 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 70 Y 8.31 4.14 0.00 3.06 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 71 H 8.08 3.91 0.00 3.22 3.32 0.00 5.71 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 V 7.84 3.75 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 0.86 0.00 0.00 0.99 0.00 0.00 73 Q 8.25 4.27 0.00 2.13 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 7.10 0.00 0.00 0.00 0.00 0.00 2.13 2.44 0.00 74 V 7.41 3.64 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 0.98 0.00 0.00 0.19 0.00 0.00 *77 V 7.76 3.93 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 0.83 0.00 0.00 0.77 0.00 0.00 78 A 8.27 4.02 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 79 R 7.98 4.34 0.00 1.81 1.97 0.00 3.47 0.00 0.00 3.23 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.54 0.00 80 G 7.76 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 0.00 0.00 0.00 81 I 7.75 4.16 1.88 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 0.61 0.87 0.00 0.00 82 S 8.59 4.93 0.00 4.11 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 83 L 8.11 3.38 0.00 1.56 1.20 0.99 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 84 D 7.94 4.47 0.00 2.78 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 85 D 7.58 4.36 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 86 V 7.47 3.72 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 0.97 0.00 0.00 0.80 0.00 0.00 87 Y 8.31 4.51 0.00 3.05 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 88 A 8.08 4.02 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.27 4.48 0.00 3.38 3.34 0.00 5.63 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 L 7.54 4.29 0.00 1.85 1.74 1.08 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 91 L 7.58 4.31 0.00 1.61 1.53 0.91 1.00 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 * Residues marked with a * may have inaccurate shift predictions.