NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 98 E 4.2185 8.2876 120.2053 56.0523 31.3488 175.5957 99 S 4.3151 7.9033 113.1727 57.8843 63.2844 173.3097 100 C 4.7118 8.4028 124.1617 56.1239 44.2985 174.7982 101 N 4.7110 8.4891 128.1366 49.5039 37.2967 176.3347 102 G 4.1351 7.1500 108.3022 46.2786 0.0000 169.4997 103 L 4.4431 7.9749 122.1086 54.1833 42.6736 175.0314 104 Y 5.2705 8.8145 124.2854 55.8947 40.9131 173.8258 105 Y 4.7471 8.8891 127.9254 57.6933 42.4762 174.3768 106 Q 3.0639 8.8791 127.0246 57.1463 25.9496 174.1216 107 G 4.4222 7.5869 100.5255 46.5861 0.0000 172.8552 108 S 4.9723 7.2709 114.6220 56.4422 67.2070 172.1293 109 C 5.5800 9.2665 123.2169 55.2821 44.2436 172.1479 110 Y 4.9075 9.8225 125.6898 56.9517 39.1341 174.6289 111 I 4.7792 8.7343 126.6790 59.3993 39.2843 175.1419 112 L 3.3240 8.5669 129.9022 54.8670 42.8334 175.6515 113 H 4.5311 8.2382 124.0450 53.7624 30.1175 175.1562 114 S 3.9918 8.4743 118.6522 59.3694 63.4083 174.3411 115 D 4.5728 7.6083 121.7899 52.9672 40.0386 175.5646 116 Y 4.4792 8.6767 121.3335 58.2592 39.8045 173.4025 117 Q 4.5553 8.8952 125.8247 55.6423 30.4808 176.7213 *119 F 2.9884 8.9021 127.3603 58.7511 40.7525 176.5021 120 S 3.6472 7.8294 115.8698 61.8400 62.4520 176.5671 121 D 4.1604 7.7481 120.4958 56.9879 40.6144 178.5448 122 A 2.9491 7.3244 120.5802 54.5687 18.3535 179.1921 123 A 3.5356 7.2898 119.3779 55.2318 18.2640 179.7697 124 A 3.8108 7.7203 119.1367 55.2086 17.8855 179.4937 125 N 4.2116 8.0827 115.1043 56.8043 38.6543 177.0359 126 C 4.3554 8.1412 117.7455 60.2855 36.1074 176.2271 127 T 4.0231 8.2652 118.5042 66.0471 67.7713 176.5118 128 A 4.0920 8.1433 121.9878 54.3067 18.3412 178.2812 129 E 4.4938 7.5019 114.8003 55.7568 30.9007 176.1162 130 S 3.7223 7.9149 112.3940 59.9811 61.0601 171.4915 131 S 5.0270 8.5202 115.1016 57.2589 67.9668 173.3322 132 T 4.7632 8.3595 109.3805 60.1831 72.4574 173.4591 133 L 4.9089 8.4093 121.5885 53.5908 43.0066 175.3273 134 P 4.5908 0.0000 0.0000 62.8733 33.1169 175.2022 135 N 5.1308 8.5916 118.8562 51.2524 40.4326 176.0023 136 K 3.8548 8.9323 124.3807 59.8460 32.3414 178.7449 137 S 4.2070 7.9807 113.2248 61.1741 63.0731 175.1118 138 D 4.5694 8.1074 119.8073 56.5056 41.0234 177.6155 139 V 3.7533 6.8965 113.4439 59.7561 29.9056 176.1336 *141 I 4.0115 7.3522 123.8456 60.6096 39.1726 175.5131 142 T 4.6075 7.2999 112.2941 59.9703 70.1316 174.0287 143 W 4.3886 8.4575 121.5427 58.5990 28.6282 178.3075 144 L 3.0359 6.5842 119.5291 57.1419 40.8349 178.4337 145 I 3.4881 7.2578 118.3735 64.4170 37.4655 177.5476 146 D 4.4931 7.5085 118.4924 57.1102 40.6133 177.7446 147 Y 4.2874 7.9320 116.5716 60.4306 38.5964 177.7345 148 V 4.0243 7.5299 111.9324 61.5777 32.1388 176.0988 149 E 4.3826 7.3452 117.1077 57.8508 29.6823 177.0810 150 D 4.5714 9.3414 120.7385 54.6394 39.4900 173.8461 151 T 4.6890 7.6005 109.8149 59.0615 71.9004 173.9006 152 W 5.0998 8.4320 122.9204 58.1292 29.7107 176.2577 153 G 4.4322 9.6586 112.3402 44.5536 0.0000 174.8948 154 S 4.5973 9.0351 115.3729 60.2979 63.0678 174.7821 155 D 4.5614 8.1710 119.8888 53.0770 39.2705 177.2911 156 G 2.2116 7.5480 107.0781 44.9571 0.0000 173.1808 157 N 5.4101 7.7246 116.3244 50.4680 42.3833 172.4860 158 P 4.8925 0.0000 0.0000 62.6415 32.6044 176.1960 159 I 4.2961 8.5941 123.8807 61.3797 38.2426 175.3036 160 T 4.9024 8.2561 115.3936 59.6157 71.4570 174.2404 161 K 3.9680 8.7987 122.0925 59.5849 32.3235 177.5385 162 T 4.2921 7.5382 112.1152 61.6060 69.2323 173.7023 163 T 4.6151 7.8691 115.1107 62.0069 68.5592 173.0647 164 S 4.2856 7.2885 117.6651 58.7111 63.0233 171.1151 165 D 4.5884 8.2318 115.7322 55.5721 43.1185 175.8563 *169 S 4.0798 7.6246 112.2429 57.5784 63.3004 172.7925 170 D 4.4283 8.7211 126.4471 54.9462 40.9316 175.7283 171 V 4.5559 8.2680 118.7182 60.9140 33.0320 177.8990 172 S 4.2647 7.9544 115.5852 60.7182 62.9684 175.0615 173 Q 4.5124 8.1019 118.0533 55.6547 28.7521 174.9618 174 E 4.7273 7.8941 117.7742 55.2285 31.2534 175.6818 175 V 5.1982 8.0848 112.7509 60.2481 35.2311 175.1705 176 R 4.7937 9.1423 121.6938 54.9783 35.6381 174.5594 177 K 4.9295 8.1520 120.3602 56.6178 34.1323 175.2977 178 Y 5.1918 7.5397 117.0576 56.6219 41.4962 173.3286 179 F 5.2158 9.2134 118.9400 56.0678 41.8003 175.4830 180 C 5.0521 9.2692 121.0299 55.5522 37.6102 172.8212 181 V 4.6152 8.9519 124.1293 61.1814 33.6067 174.4193 182 K 4.7945 8.3200 126.7194 55.2053 36.0489 176.0047 183 T 4.3503 8.3220 123.3826 63.1780 70.1276 174.3324 *185 N 4.5124 8.4742 118.7026 53.9918 39.0334 174.7200 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 98 E 8.29 4.22 0.00 2.04 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 2.25 2.29 0.00 99 S 7.90 4.32 0.00 4.05 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 0.00 100 C 8.40 4.71 0.00 2.94 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 0.00 101 N 8.49 4.71 0.00 2.78 2.79 0.00 0.00 7.01 7.65 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 0.00 102 G 7.15 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 0.00 103 L 7.97 4.44 0.00 1.56 1.22 0.05 0.35 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 0.00 104 Y 8.81 5.27 0.00 3.12 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 0.00 105 Y 8.89 4.75 0.00 2.69 2.49 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 0.00 0.00 0.00 0.00 106 Q 8.88 3.06 0.00 1.70 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.30 0.00 0.00 0.00 0.00 0.00 1.16 1.33 0.00 107 G 7.59 4.42 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 0.00 108 S 7.27 4.97 0.00 3.95 3.57 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 0.00 109 C 9.27 5.58 0.00 3.18 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 0.00 110 Y 9.82 4.91 0.00 2.84 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 0.00 111 I 8.73 4.78 1.98 0.00 0.00 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 1.21 1.03 0.90 0.00 0.00 112 L 8.57 3.32 0.00 0.94 1.34 0.07 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 113 H 8.24 4.53 0.00 1.79 2.62 0.00 5.86 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 S 8.47 3.99 0.00 3.84 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 0.00 115 D 7.61 4.57 0.00 2.91 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 0.00 116 Y 8.68 4.48 0.00 3.05 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 0.00 117 Q 8.90 4.56 0.00 2.16 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.88 6.39 0.00 0.00 0.00 0.00 0.00 2.83 2.56 0.00 *119 F 8.90 2.99 0.00 1.51 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 0.00 120 S 7.83 3.65 0.00 3.76 3.77 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 0.00 121 D 7.75 4.16 0.00 2.58 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 0.00 122 A 7.32 2.95 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 A 7.29 3.54 0.64 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 0.00 0.00 0.00 0.00 0.00 0.00 124 A 7.72 3.81 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 0.00 125 N 8.08 4.21 0.00 2.82 2.93 0.00 0.00 7.04 7.45 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 0.00 126 C 8.14 4.36 0.00 3.06 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 0.00 127 T 8.27 4.02 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 128 A 8.14 4.09 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 0.00 129 E 7.50 4.49 0.00 2.00 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 2.31 2.53 0.00 130 S 7.91 3.72 0.00 4.03 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 0.00 131 S 8.52 5.03 0.00 3.78 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 0.00 132 T 8.36 4.76 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 1.19 0.00 0.00 133 L 8.41 4.91 0.00 1.69 1.84 0.94 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 134 P 0.00 4.59 0.00 2.23 2.28 0.00 3.99 0.00 0.00 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.34 0.00 135 N 8.59 5.13 0.00 2.98 2.76 0.00 0.00 6.46 7.57 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 0.00 136 K 8.93 3.85 0.00 1.81 1.85 0.00 1.73 0.00 0.00 1.83 0.00 0.00 2.90 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.52 1.50 7.81 137 S 7.98 4.21 0.00 3.92 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 0.00 138 D 8.11 4.57 0.00 2.91 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 0.00 139 V 6.90 3.75 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 0.47 0.00 0.00 0.94 0.00 0.00 *141 I 7.35 4.01 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 1.29 0.75 0.92 0.00 0.00 142 T 7.30 4.61 3.88 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 0.66 0.00 0.00 143 W 8.46 4.39 0.00 3.61 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 0.00 144 L 6.58 3.04 0.00 0.80 0.81 -0.51 -1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 145 I 7.26 3.49 1.92 0.00 0.00 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 1.47 1.17 0.94 0.00 0.00 146 D 7.51 4.49 0.00 2.53 2.53 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 0.00 0.00 0.00 0.00 147 Y 7.93 4.29 0.00 2.76 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 0.00 148 V 7.53 4.02 2.03 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 0.28 0.00 0.00 0.85 0.00 0.00 149 E 7.35 4.38 0.00 2.09 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 2.58 2.28 0.00 150 D 9.34 4.57 0.00 2.81 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 0.00 151 T 7.60 4.69 4.47 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 1.34 0.00 0.00 152 W 8.43 5.10 0.00 3.49 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 0.00 153 G 9.66 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 0.00 0.00 0.00 0.00 154 S 9.04 4.60 0.00 4.07 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 0.00 155 D 8.17 4.56 0.00 2.76 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 0.00 156 G 7.55 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 0.00 0.00 0.00 157 N 7.72 5.41 0.00 2.74 2.74 0.00 0.00 6.98 9.27 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 0.00 158 P 0.00 4.89 0.00 1.88 1.78 0.00 3.73 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.80 0.00 159 I 8.59 4.30 2.10 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.07 0.91 0.00 0.00 160 T 8.26 4.90 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 0.00 161 K 8.80 3.97 0.00 1.75 1.90 0.00 1.72 0.00 0.00 1.61 0.00 0.00 2.79 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.42 1.55 7.81 162 T 7.54 4.29 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 0.00 163 T 7.87 4.62 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 0.00 164 S 7.29 4.29 0.00 3.87 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 0.00 165 D 8.23 4.59 0.00 2.64 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 *169 S 7.62 4.08 0.00 3.91 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 0.00 170 D 8.72 4.43 0.00 2.69 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 0.00 171 V 8.27 4.56 2.45 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 1.08 0.00 0.00 1.12 0.00 0.00 172 S 7.95 4.26 0.00 4.09 4.01 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 0.00 173 Q 8.10 4.51 0.00 2.11 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.92 0.00 0.00 0.00 0.00 0.00 2.33 2.33 0.00 174 E 7.89 4.73 0.00 2.22 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 2.35 2.43 0.00 175 V 8.08 5.20 2.36 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 0.88 0.00 0.00 0.99 0.00 0.00 176 R 9.14 4.79 0.00 0.67 1.44 0.00 2.21 0.00 0.00 2.69 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.26 0.00 177 K 8.15 4.93 0.00 1.47 1.53 0.00 1.44 0.00 0.00 1.56 0.00 0.00 2.67 0.00 0.00 2.54 0.00 0.00 0.00 0.00 0.96 0.55 7.81 178 Y 7.54 5.19 0.00 3.26 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179 F 9.21 5.22 0.00 3.05 3.15 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 0.00 180 C 9.27 5.05 0.00 2.95 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 0.00 181 V 8.95 4.62 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 0.19 0.00 0.00 0.45 0.00 0.00 182 K 8.32 4.79 0.00 1.84 1.57 0.00 1.70 0.00 0.00 1.66 0.00 0.00 2.83 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.34 1.57 7.81 183 T 8.32 4.35 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 1.29 0.00 0.00 *185 N 8.47 4.51 0.00 2.77 2.80 0.00 0.00 6.67 7.56 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 * Residues marked with a * may have inaccurate shift predictions.