NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 10 A 4.2335 8.2601 123.5797 52.4484 18.5867 176.0765 11 A 4.2938 8.3814 122.5275 51.7829 19.9837 175.5556 12 G 3.7845 8.4599 103.9580 45.4636 0.0000 172.3073 13 V 3.8005 7.6177 119.3418 62.6270 31.3084 175.5863 14 K 4.7434 8.6503 126.0452 56.2729 34.1827 175.9058 15 I 5.5870 7.8337 119.7681 58.2378 41.1119 174.1504 16 A 5.4461 8.7904 127.1142 50.2955 22.3261 175.0535 17 I 4.8894 9.2031 123.1959 60.0374 39.3426 175.3275 18 V 5.4146 8.3062 120.6787 58.4865 35.2187 176.5206 *20 G 4.0709 8.6523 106.7167 46.8576 0.0000 173.6936 21 S 4.8014 8.1810 114.8676 55.5371 67.4211 174.8702 22 K 3.8969 8.9103 124.5415 59.8763 31.8729 179.1924 23 S 4.2998 8.1060 113.5088 60.9612 63.0283 175.4644 24 D 4.6540 8.3060 122.2159 55.8089 40.3687 177.9303 25 W 4.4776 8.2348 128.8050 60.2672 30.6922 177.1609 26 A 4.2243 7.5562 118.9305 55.1287 17.9695 177.9845 27 T 4.2473 7.7154 113.1765 64.1837 68.5607 176.5564 *29 Q 2.9268 8.0294 122.1256 55.6217 30.4656 177.3106 30 F 3.7959 8.0316 117.1702 59.7972 38.7419 177.5738 31 A 4.0607 7.8619 120.1884 55.0121 18.2602 179.1942 32 A 3.1557 7.6760 118.7935 55.3446 18.4549 179.4778 33 D 4.2962 8.1717 117.4546 57.2765 40.8271 179.2370 34 V 3.6449 7.3931 117.4952 66.0682 31.5300 178.1565 35 L 4.0317 7.7506 118.7141 57.9107 41.3828 179.6084 36 T 4.0486 8.3933 116.1110 67.1729 68.2476 176.7053 37 T 4.0156 7.7953 116.1517 66.5429 68.6252 175.9691 38 L 4.2716 7.9757 117.8151 54.2920 42.3432 176.2811 39 N 4.1392 8.0818 115.4995 54.5782 36.3377 174.7734 40 V 4.3651 7.8645 118.1794 60.4518 33.5320 173.9266 41 P 4.5893 0.0000 0.0000 62.8918 32.4025 175.4998 42 F 5.3632 7.9052 116.6032 55.9995 41.2823 172.6933 43 H 5.0239 9.2740 119.8484 54.6694 32.1068 173.5080 44 V 5.0509 7.9753 123.4636 61.2927 34.3274 174.1389 45 E 4.6031 8.7610 126.5588 54.9180 33.6361 173.7825 46 V 4.2111 8.2411 126.4609 62.1245 32.5544 175.2386 47 V 4.2713 8.1803 127.3230 61.2400 34.6861 173.8429 48 S 4.6708 8.7334 123.2132 56.3012 63.4852 174.7762 49 A 4.0098 8.6537 130.7237 54.9591 18.4080 177.6665 50 H 4.7763 7.9456 111.0046 56.9826 30.1617 176.2297 51 R 4.2845 8.2589 117.7715 57.4309 31.3098 176.7168 52 T 4.7276 7.8529 107.3461 59.2967 68.8011 173.2262 53 P 4.2138 0.0000 0.0000 66.7758 31.8267 178.0920 54 D 4.2536 7.9367 118.2164 57.0544 40.7224 178.5062 55 R 3.9586 7.9571 118.8514 59.0881 30.0966 178.0511 56 L 4.0414 8.0623 120.2725 58.3602 42.0692 179.0430 57 F 4.3184 8.3869 117.4869 60.7796 38.8535 177.8840 58 S 4.1971 8.5015 114.8547 61.4937 62.4284 176.4608 59 F 3.9969 8.5244 122.2835 61.3049 39.5063 176.7537 60 A 4.1747 8.4671 120.3918 55.2807 17.9949 179.3000 61 E 3.8891 8.3461 116.3614 59.2760 29.7809 178.7544 62 Q 4.3244 7.9171 115.3120 55.6571 29.0782 177.3933 63 A 3.6578 7.4974 123.9975 55.0692 18.3774 179.5695 64 E 3.7907 8.0275 116.9811 59.4960 29.6111 178.8139 65 A 3.9502 7.8158 119.9218 55.0965 18.6204 177.7753 66 N 4.4293 8.1791 111.3015 53.9895 38.6617 176.1102 67 G 3.9446 8.1782 107.0755 45.1971 0.0000 173.7975 68 L 4.3612 7.6791 119.6953 54.9995 42.1204 176.5222 69 H 4.8529 9.2270 119.7010 56.6191 31.0582 175.4752 70 V 4.6957 7.6531 116.8685 61.3333 35.3752 173.5332 71 I 4.9944 8.8797 128.2569 59.7404 39.8221 174.4165 72 I 4.8630 8.9966 128.5120 59.6946 39.1528 174.5446 73 A 5.1502 9.3263 129.4950 50.0454 21.6864 174.7369 74 G 4.4336 8.7533 110.5993 44.8484 0.0000 172.1919 75 N 4.8948 8.6069 119.9405 52.7910 43.1291 172.9785 76 G 4.4200 8.2088 108.7168 44.2502 0.0000 175.4917 77 G 4.0320 8.8603 110.4382 46.0912 0.0000 178.0543 78 A 4.2309 8.6003 125.8112 51.1984 16.5323 176.6684 79 A 4.4571 8.0971 124.6182 51.5699 17.4930 177.1285 80 H 4.7201 8.1133 117.3746 56.1679 30.1437 177.6269 81 L 3.8934 8.0692 121.2187 57.7274 42.3259 176.2581 82 P 4.4409 0.0000 0.0000 65.6558 31.5717 179.0751 83 G 4.0040 7.5457 106.8697 45.9022 0.0000 175.7331 *85 L 4.2226 8.1923 120.3828 54.4162 43.2450 179.4932 86 A 3.9637 8.0967 120.8670 54.9503 18.4139 179.3845 87 A 3.7616 7.9519 117.8939 54.1437 18.4801 178.1778 88 K 4.3362 7.8107 112.9668 56.2885 33.2364 175.6535 89 T 4.6005 7.2870 112.0329 60.8761 70.3929 173.1935 90 L 4.4358 8.2111 123.6845 54.4768 42.2451 177.1920 91 V 3.7390 7.4851 120.4820 62.1903 32.0126 174.1568 92 P 4.4040 0.0000 0.0000 63.0049 32.7866 175.0773 93 V 4.8009 8.4444 123.0087 61.1460 34.2961 173.8269 94 L 5.2006 9.1449 128.3959 53.0061 44.2420 175.5268 95 G 4.4077 9.1741 111.0434 44.3410 0.0000 172.2023 96 V 4.6758 8.7013 124.7416 60.2609 33.9644 172.8783 97 P 4.8555 0.0000 0.0000 62.2594 32.2343 175.9388 98 V 4.1355 8.5488 126.2360 61.9905 32.4798 175.6489 99 Q 4.0063 8.6091 129.0193 56.0553 29.4577 175.8057 100 S 4.5594 8.4867 119.5638 56.9877 64.7810 174.8744 101 A 3.8849 8.4108 123.9960 55.5374 18.5979 179.2585 102 A 4.0729 8.0610 117.0117 55.1488 18.7631 178.5004 103 L 4.4177 7.8444 112.9557 53.9451 42.0722 177.0640 104 S 3.8901 8.7294 113.5730 59.5384 60.9310 173.4578 105 G 3.9082 8.3599 107.7953 45.8123 0.0000 176.5708 106 V 3.3474 7.8756 120.4824 65.4894 31.2442 177.5932 107 D 4.2937 7.8671 118.5739 56.5776 39.1014 178.5686 108 S 4.2333 7.9578 116.3204 61.0515 62.8865 176.2484 109 L 4.0029 8.1881 123.1666 58.6096 41.6863 178.6414 110 Y 4.4281 8.1930 116.8014 61.3572 37.5570 178.8822 111 S 4.2462 8.3279 115.0508 60.7114 62.9065 175.8898 112 I 4.2488 7.1878 121.7175 63.2666 37.9811 178.1287 113 V 3.9708 8.0225 120.1350 62.4817 31.5608 176.3913 114 Q 4.0754 7.2386 119.4191 54.2737 29.1890 173.5623 *116 P 4.1343 0.0000 0.0000 61.7300 32.4990 175.6168 117 R 3.7655 8.4446 118.6094 57.8856 29.9759 175.7033 118 G 4.0730 8.8423 113.1834 45.9032 0.0000 173.8854 119 I 4.4899 7.2974 119.8037 58.6747 38.2105 172.7304 120 P 4.5037 0.0000 0.0000 62.1282 32.3770 176.5909 121 V 4.4727 8.0770 119.5617 61.0576 34.3848 174.8918 122 G 3.8655 8.9745 116.0517 46.3420 0.0000 172.3378 123 T 5.1408 8.5410 122.8255 61.9946 71.2113 174.3267 124 L 4.8205 8.2438 125.1849 52.5375 44.8821 176.0505 125 A 4.1665 8.3409 121.5835 52.0321 18.9188 177.1283 126 I 4.0963 8.0250 121.0085 62.7471 38.2528 178.1325 127 G 3.7748 9.0121 113.5356 45.1815 0.0000 174.2435 128 K 3.6817 8.2833 116.8717 59.7415 32.3980 178.9254 129 A 4.0264 7.7946 121.8638 54.9976 18.2812 179.6747 130 G 4.0838 8.2067 104.8805 47.0339 0.0000 175.8216 131 A 3.9295 7.9969 122.9013 55.0335 18.4811 179.4956 132 A 4.0934 8.0250 119.2970 55.6007 18.3823 179.6946 133 N 4.2804 8.3296 114.5771 56.0953 38.4727 177.6094 134 A 3.9331 8.3093 122.5607 54.8846 18.3582 179.5223 135 A 3.8358 7.8173 118.9439 55.2404 18.3710 179.8985 136 L 3.6627 7.7998 117.5024 57.6894 41.5594 179.5569 137 L 3.8834 8.1808 120.3970 57.9527 41.9592 178.7213 138 A 3.9472 8.1887 120.7136 55.2594 18.2289 179.5107 139 A 3.9055 8.1701 119.3155 55.3563 18.1828 179.8720 140 Q 3.9180 8.2041 116.1935 59.0117 29.1207 178.8636 141 I 3.8711 8.0138 121.0257 64.4934 37.2127 178.4866 142 L 4.0634 8.2340 119.7737 57.7293 41.3181 179.3675 143 A 4.2883 8.3296 120.5627 54.4519 18.0212 179.3482 144 L 4.0445 7.6232 116.6898 57.3810 41.6075 177.4602 145 H 4.9090 8.1098 114.4431 54.5453 30.1982 174.0854 146 D 4.5844 7.9434 120.2515 52.0544 42.4944 174.8235 147 T 3.9064 8.3161 117.9467 64.3117 68.9986 176.3182 148 E 3.9534 8.1800 121.2089 59.1747 29.5664 178.6598 149 L 3.9576 8.3743 120.1876 58.0973 42.1251 178.7212 150 A 4.0997 8.3365 120.9957 55.2450 18.2676 179.9200 151 G 3.5741 8.1863 104.1583 48.0437 0.0000 176.2839 152 R 4.0671 8.1334 120.5733 58.8751 30.0118 179.1746 153 L 4.0287 8.4172 119.1221 57.7411 41.5902 179.3209 154 A 4.0583 8.2377 120.7885 55.4185 18.2088 179.2117 155 H 4.0711 8.5258 116.7882 58.9933 29.9592 177.2195 156 W 4.0675 8.5481 130.3437 60.6635 30.5661 177.9561 157 R 4.1501 8.5418 118.6974 59.5227 29.4537 178.2112 158 Q 3.9534 8.3715 119.5837 59.1106 29.0197 178.1636 159 S 3.9647 8.2316 114.7517 61.2704 61.8726 176.1692 160 Q 3.8015 7.8368 120.4339 59.3430 28.2801 178.6694 161 T 3.8450 7.9884 117.6128 66.6486 68.4789 176.4068 162 D 4.3512 8.3378 121.0485 57.4676 40.5498 178.6217 163 D 4.2895 7.9402 118.6994 57.1980 41.0569 178.7881 164 V 3.7210 7.4703 117.8740 66.0214 31.3921 178.2288 165 L 4.0495 7.8262 117.4772 57.6724 41.5249 178.6830 166 D 4.5971 8.2492 117.3579 55.3303 42.2045 176.1744 167 N 5.0766 7.8538 116.7840 51.1279 38.9797 173.4460 168 P 4.1558 0.0000 0.0000 64.5958 32.7705 176.7676 169 D 4.6987 7.8740 119.5335 51.8758 41.5255 174.6163 170 P 4.5482 0.0000 0.0000 64.1388 31.8318 177.4336 171 R 4.0881 8.3119 118.1558 58.0429 30.3497 176.3728 172 E 4.6049 7.5994 117.0444 54.2191 31.1144 175.9212 173 E 4.0480 8.5560 121.0700 56.6496 30.2773 177.1286 174 A 4.7477 8.2823 121.9818 51.7739 19.0758 177.4209 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 10 A 8.26 4.23 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 11 A 8.38 4.29 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 12 G 8.46 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 0.00 0.00 0.00 13 V 7.62 3.80 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 0.95 0.00 0.00 0.92 0.00 0.00 14 K 8.65 4.74 0.00 1.69 1.67 0.00 1.55 0.00 0.00 1.43 0.00 0.00 2.68 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.28 1.52 7.81 15 I 7.83 5.59 2.00 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 1.16 2.20 1.02 0.00 0.00 16 A 8.79 5.45 1.54 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 0.00 0.00 0.00 0.00 0.00 0.00 17 I 9.20 4.89 2.01 0.00 0.00 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.66 1.03 0.00 0.00 18 V 8.31 5.41 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 0.23 0.00 0.00 0.88 0.00 0.00 *20 G 8.65 4.07 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 0.00 0.00 0.00 21 S 8.18 4.80 0.00 3.86 3.72 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 22 K 8.91 3.90 0.00 1.81 1.84 0.00 1.70 0.00 0.00 1.87 0.00 0.00 3.01 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.56 1.51 7.81 23 S 8.11 4.30 0.00 4.12 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 24 D 8.31 4.65 0.00 2.93 2.81 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 25 W 8.23 4.48 0.00 3.35 3.25 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 0.00 26 A 7.56 4.22 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 27 T 7.72 4.25 4.38 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 1.15 0.00 0.00 *29 Q 8.03 2.93 0.00 1.35 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.69 6.91 0.00 0.00 0.00 0.00 0.00 2.01 1.62 0.00 30 F 8.03 3.80 0.00 3.22 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 31 A 7.86 4.06 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 32 A 7.68 3.16 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 33 D 8.17 4.30 0.00 2.56 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 34 V 7.39 3.64 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 0.70 0.00 0.00 0.95 0.00 0.00 35 L 7.75 4.03 0.00 1.59 2.01 0.74 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 36 T 8.39 4.05 4.52 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 37 T 7.80 4.02 4.61 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 1.47 0.00 0.00 38 L 7.98 4.27 0.00 1.64 1.71 0.70 0.84 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 39 N 8.08 4.14 0.00 2.91 2.93 0.00 0.00 6.71 7.22 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 40 V 7.86 4.37 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 0.84 0.00 0.00 0.96 0.00 0.00 41 P 0.00 4.59 0.00 2.26 1.91 0.00 3.67 0.00 0.00 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.08 0.00 42 F 7.91 5.36 0.00 3.12 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 43 H 9.27 5.02 0.00 3.36 3.34 0.00 5.72 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 V 7.98 5.05 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 0.63 0.00 0.00 1.27 0.00 0.00 45 E 8.76 4.60 0.00 2.04 1.60 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 2.14 2.24 0.00 46 V 8.24 4.21 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 0.78 0.00 0.00 0.88 0.00 0.00 47 V 8.18 4.27 1.88 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 0.85 0.00 0.00 0.62 0.00 0.00 48 S 8.73 4.67 0.00 4.04 3.69 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 49 A 8.65 4.01 1.13 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 0.00 0.00 50 H 7.95 4.78 0.00 3.14 3.34 0.00 5.71 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 R 8.26 4.28 0.00 1.77 1.97 0.00 3.10 0.00 0.00 3.28 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.57 0.00 52 T 7.85 4.73 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 1.20 0.00 0.00 53 P 0.00 4.21 0.00 2.08 2.41 0.00 3.74 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.00 0.00 54 D 7.94 4.25 0.00 2.69 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 55 R 7.96 3.96 0.00 1.95 2.09 0.00 3.34 0.00 0.00 3.33 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.80 0.00 56 L 8.06 4.04 0.00 1.82 1.98 0.98 1.13 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 57 F 8.39 4.32 0.00 3.23 3.11 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 58 S 8.50 4.20 0.00 4.10 3.98 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 0.00 0.00 0.00 59 F 8.52 4.00 0.00 3.12 3.34 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 60 A 8.47 4.17 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 61 E 8.35 3.89 0.00 2.12 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 2.30 2.40 0.00 62 Q 7.92 4.32 0.00 1.95 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.43 2.47 0.00 63 A 7.50 3.66 1.18 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 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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 1.16 0.61 0.91 0.00 0.00 73 A 9.33 5.15 1.20 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 0.00 0.00 74 G 8.75 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 75 N 8.61 4.89 0.00 2.86 2.62 0.00 0.00 6.69 7.19 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 76 G 8.21 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 77 G 8.86 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 0.00 0.00 0.00 78 A 8.60 4.23 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 79 A 8.10 4.46 1.25 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 0.00 0.00 0.00 80 H 8.11 4.72 0.00 3.15 3.34 0.00 5.65 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 2.32 2.22 0.00 *116 P 0.00 4.13 0.00 2.23 2.22 0.00 3.72 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.96 0.00 117 R 8.44 3.77 0.00 1.78 1.91 0.00 3.21 0.00 0.00 3.22 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.65 0.00 118 G 8.84 4.07 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 0.00 0.00 0.00 119 I 7.30 4.49 1.87 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 1.35 0.97 0.95 0.00 0.00 120 P 0.00 4.50 0.00 2.18 2.04 0.00 3.70 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.94 0.00 121 V 8.08 4.47 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 0.84 0.00 0.00 0.92 0.00 0.00 122 G 8.97 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 0.00 123 T 8.54 5.14 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 1.28 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0.00 0.00 0.00 0.00 7.28 6.90 0.00 0.00 0.00 0.00 0.00 2.36 2.57 0.00 141 I 8.01 3.87 2.05 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 1.53 1.05 0.94 0.00 0.00 142 L 8.23 4.06 0.00 1.84 1.73 0.93 1.18 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 0.00 143 A 8.33 4.29 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 0.00 144 L 7.62 4.04 0.00 1.76 1.67 0.94 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 145 H 8.11 4.91 0.00 3.14 3.26 0.00 5.62 0.00 0.00 0.00 0.00 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 D 7.94 4.58 0.00 2.63 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 0.00 147 T 8.32 3.91 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 1.21 0.00 0.00 148 E 8.18 3.95 0.00 2.17 2.05 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 2.41 2.37 0.00 149 L 8.37 3.96 0.00 1.89 1.84 0.92 1.07 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 0.00 150 A 8.34 4.10 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 0.00 151 G 8.19 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 0.00 0.00 0.00 152 R 8.13 4.07 0.00 2.04 2.06 0.00 3.17 0.00 0.00 3.19 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.93 0.00 153 L 8.42 4.03 0.00 1.93 1.73 0.91 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 154 A 8.24 4.06 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 0.00 155 H 8.53 4.07 0.00 3.34 3.57 0.00 5.80 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 W 8.55 4.07 0.00 3.61 3.30 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 0.00 0.00 0.00 0.00 157 R 8.54 4.15 0.00 2.12 2.03 0.00 3.22 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.75 0.00 158 Q 8.37 3.95 0.00 2.27 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.58 0.00 0.00 0.00 0.00 0.00 2.33 2.52 0.00 159 S 8.23 3.96 0.00 3.79 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 0.00 160 Q 7.84 3.80 0.00 2.08 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.59 0.00 0.00 0.00 0.00 0.00 2.55 2.38 0.00 161 T 7.99 3.84 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 1.20 0.00 0.00 162 D 8.34 4.35 0.00 2.73 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 0.00 163 D 7.94 4.29 0.00 2.71 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 0.00 164 V 7.47 3.72 2.20 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 1.02 0.00 0.00 0.91 0.00 0.00 165 L 7.83 4.05 0.00 1.64 1.70 0.91 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 166 D 8.25 4.60 0.00 2.67 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 0.00 167 N 7.85 5.08 0.00 2.70 2.68 0.00 0.00 6.61 8.05 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 0.00 168 P 0.00 4.16 0.00 2.17 2.17 0.00 3.81 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.94 0.00 169 D 7.87 4.70 0.00 2.68 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 0.00 170 P 0.00 4.55 0.00 2.21 2.14 0.00 3.81 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.98 0.00 171 R 8.31 4.09 0.00 1.93 2.02 0.00 3.14 0.00 0.00 3.22 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.59 0.00 172 E 7.60 4.60 0.00 2.11 1.85 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 2.27 2.40 0.00 173 E 8.56 4.05 0.00 1.93 1.88 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 2.31 2.37 0.00 174 A 8.28 4.75 1.21 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 * Residues marked with a * may have inaccurate shift predictions.