NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.4692 8.1933 115.4062 58.3471 65.5112 175.4445 2 N 4.5045 8.2181 122.3505 54.1156 39.1414 170.4223 3 V 4.3103 7.7986 116.0151 59.7035 32.9449 172.2355 4 P 4.1880 0.0000 0.0000 62.0079 32.4733 176.7596 5 A 4.1407 8.6152 124.3957 55.4973 18.4147 179.6181 6 E 4.2381 7.9881 110.3588 57.6568 30.0681 176.6750 7 L 4.4173 7.1271 118.6750 54.1129 43.2765 176.2554 8 K 4.7495 8.4536 120.1957 55.6502 34.9659 175.1990 9 Y 5.0992 9.0679 118.3210 56.9320 42.6647 174.8500 10 S 5.0175 8.7721 118.4481 56.0779 65.5694 173.6707 11 K 4.5776 8.0186 117.0529 56.0800 32.2652 176.9025 12 E 4.1142 9.0848 125.0677 59.1489 28.5050 176.4576 13 H 4.2044 7.8788 112.8975 57.3167 26.3462 173.8974 14 E 5.2495 8.0023 116.6802 54.3682 33.1488 175.5671 15 W 5.1567 8.1045 118.0349 54.8216 31.9423 174.4937 16 L 5.4208 8.6801 119.6990 53.1998 45.6872 175.3403 17 R 4.9430 9.2262 123.9742 54.2131 32.7350 174.4762 18 K 3.8280 8.6696 128.1873 56.0295 32.8340 176.4533 19 E 4.2500 8.9311 127.3498 54.9611 30.6674 177.3720 20 A 3.8674 8.4127 123.3802 55.2285 18.4085 178.2673 21 D 4.5735 7.9817 113.1014 53.2690 39.5922 177.4781 22 G 3.8244 8.1366 109.8448 45.7365 0.0000 174.0671 23 T 4.3774 7.8270 110.2961 61.7048 70.8833 172.7623 24 Y 5.0889 9.0733 118.9960 56.5059 41.2783 175.3177 25 T 4.6919 8.9487 121.1117 62.5132 70.5626 174.0538 26 V 4.3561 7.8866 125.4007 60.1457 35.2139 174.7456 27 G 3.6598 6.1826 111.6658 45.6085 0.0000 171.4793 28 I 4.9840 8.1724 113.2974 59.2577 40.2688 175.5740 29 T 4.4583 8.5925 113.4213 60.5413 70.2521 175.4017 30 E 3.8887 8.6036 122.0274 59.9299 29.2905 178.5471 31 H 4.2191 8.4673 117.4782 58.9994 29.9797 177.0385 32 A 3.9105 7.9980 122.6225 55.1586 18.1592 179.6719 33 Q 3.9709 8.5219 116.6956 59.2499 28.4084 178.2961 34 E 3.9053 8.1338 120.7701 59.0793 29.7671 178.3320 35 L 4.0669 7.4463 119.4431 57.6833 42.1465 178.3640 36 L 4.1053 7.6110 120.2203 55.7688 42.3093 177.6745 37 G 3.8769 7.8113 104.4197 44.2150 0.0000 172.3075 38 D 4.4730 8.4125 117.4116 55.0349 41.0397 176.1139 39 M 4.4850 9.2598 124.7188 55.2620 32.9547 175.9405 40 V 4.0568 8.7266 118.4226 61.8179 33.9555 175.9745 41 F 5.1253 7.7394 117.3079 55.7409 43.6573 173.8762 42 V 4.9680 8.4447 119.8873 60.1405 34.4602 174.3426 43 D 4.8869 9.3339 123.9573 52.7972 42.5949 175.6475 44 L 4.8644 8.3996 123.8284 52.7046 43.5503 174.7756 45 P 4.5254 0.0000 0.0000 62.3333 32.9411 175.3201 46 E 4.2310 8.4429 119.0051 55.2600 30.2548 176.8315 47 V 3.7971 8.1545 123.0832 64.5220 31.9919 176.3303 48 G 3.9180 9.1545 115.8667 44.8270 0.0000 173.4575 49 A 4.1109 7.7679 123.0418 52.2820 19.4197 176.9116 50 T 4.6266 8.4747 119.6871 63.2380 69.4766 174.6936 51 V 4.6649 8.8078 119.2192 59.6984 35.6006 175.0112 52 S 4.8811 9.6057 118.8734 56.2288 64.8495 174.0195 53 A 4.2339 8.1765 126.5348 54.3482 18.4322 178.1764 54 G 4.0625 9.0018 111.2862 45.2515 0.0000 173.9277 55 D 4.6469 8.1617 120.5756 54.4472 42.0977 175.7114 56 D 4.8258 8.8225 123.0920 52.6310 39.9171 175.2839 57 C 4.8922 8.0813 118.6530 57.0469 30.7812 173.5837 58 A 4.4849 7.3085 117.7363 52.2305 22.0659 176.1843 59 V 4.6857 8.3253 119.2558 61.0898 35.2127 174.0331 60 A 5.0249 9.0715 130.0084 50.4076 21.3064 174.9986 61 E 5.1143 9.7050 124.6501 54.4803 32.1491 175.3029 62 S 5.0076 8.7008 121.4692 54.9337 66.0653 174.8120 63 V 3.3728 8.3142 114.6520 64.3406 31.0118 174.8034 *65 A 4.0837 7.7245 120.6948 51.8838 19.5012 175.3881 66 A 5.2251 8.2288 120.8312 50.9365 20.7472 177.1647 67 S 4.6441 9.1546 115.6117 56.7098 66.7341 173.4107 68 D 4.7597 8.7785 123.3520 54.3992 41.7467 175.5174 69 I 4.4368 8.3651 123.0462 59.7511 39.8707 174.3179 70 Y 5.1845 8.4212 124.4073 55.8343 40.5423 175.5948 71 A 4.4074 9.3075 125.3473 51.6982 18.7722 177.2203 72 P 4.2505 0.0000 0.0000 64.9522 32.0115 176.7805 73 V 4.5457 7.2848 109.4698 59.1243 35.8198 174.9737 74 S 4.5183 9.5114 118.4350 57.5484 63.6084 175.2360 75 G 4.0599 7.4427 110.1705 45.9578 0.0000 169.9673 76 E 5.0359 7.9075 119.9719 54.1459 32.5728 176.2944 77 I 4.3720 8.9636 128.1807 61.8189 37.3913 176.8403 78 V 4.3547 8.7997 120.9010 62.3493 32.9480 176.1165 79 A 4.8986 7.8621 120.1000 50.8406 22.6893 175.6442 80 V 4.9165 8.3432 111.4260 58.9876 35.6228 176.8211 81 N 3.6553 8.2652 121.2347 52.6517 37.4166 175.5235 82 D 4.4443 8.3016 126.9799 55.8846 41.2125 177.6535 83 A 4.0509 7.7075 120.9089 54.4920 18.0689 179.2642 84 L 4.0072 7.5849 116.7136 57.1828 41.7066 178.5365 85 S 4.3080 7.4991 114.4332 61.3047 62.9076 175.1240 86 D 4.6761 7.9704 117.3748 55.1348 42.4788 176.7628 87 S 5.0958 8.0848 113.8299 54.9625 63.4664 173.4109 88 P 4.3531 0.0000 0.0000 65.2568 31.4562 177.8178 89 E 4.0966 8.0788 116.8398 58.4036 29.3764 178.5930 90 L 4.2927 7.7943 121.9118 57.2046 41.3489 179.2879 91 V 3.5828 7.4887 117.6537 65.7622 31.4290 177.5589 92 N 4.8879 8.0632 116.5473 55.5473 38.9513 177.1282 93 S 4.4046 8.2481 115.5391 60.1875 64.5583 174.0794 94 E 5.0006 8.4083 121.1587 54.1849 30.0169 174.5786 95 P 4.3398 0.0000 0.0000 65.0957 31.9522 177.3806 96 Y 4.0229 7.7681 113.9009 57.3564 40.6645 175.3147 97 A 4.5813 8.1000 120.5809 51.9695 19.1262 178.9612 98 G 3.8804 6.8269 114.2053 48.3878 0.0000 174.8297 99 G 3.9475 8.2879 107.6399 44.8434 0.0000 174.0565 100 W 4.4767 7.9313 117.1617 57.2226 28.7168 175.3193 101 I 4.2381 8.9121 120.2489 62.5418 38.7441 175.5330 102 F 5.8759 7.4298 114.1495 55.7260 42.0368 172.3734 103 K 5.2094 9.6199 117.6419 54.6502 35.6957 175.5702 104 I 5.0542 9.0788 123.5740 59.1654 41.8597 174.1022 105 K 4.7978 9.3070 130.9948 55.1002 32.7791 175.5833 106 A 4.7393 8.8525 130.2625 52.0275 19.0167 176.8953 107 S 4.6509 8.6599 114.6699 58.1068 64.3406 174.2960 108 D 4.4258 7.7322 121.1589 52.4167 42.0431 175.0275 109 E 4.0191 8.8569 128.1236 59.2936 29.2884 179.2877 110 S 4.3341 7.7490 112.7783 61.2666 63.2144 176.3653 111 E 4.0645 8.0674 122.4031 59.3776 29.4218 178.9273 112 L 3.8686 7.9230 118.4642 58.0620 41.4726 179.0795 113 E 4.2548 8.1350 116.2031 57.9138 29.5060 178.2098 114 S 4.6857 7.4626 113.8106 57.2248 63.8630 173.9810 115 L 4.2852 7.1027 122.0489 54.5424 42.2234 177.2361 116 L 4.5126 9.4467 123.0520 54.9237 43.3216 175.5232 117 D 5.4081 8.5610 119.2889 51.1615 42.8454 176.6896 118 A 4.1072 9.0663 119.9398 56.0453 17.7543 180.0674 119 T 3.7959 7.9153 113.0319 66.8781 68.6197 176.9579 120 A 4.0283 8.0068 120.6106 55.0039 18.5979 178.7536 121 Y 4.2136 8.3737 118.7615 60.9536 38.6274 177.4983 122 E 3.8016 7.9253 118.1642 58.2883 29.6100 178.3310 123 A 4.2368 7.6028 120.1491 53.1136 18.6827 178.5120 124 L 4.1027 7.7994 118.3437 56.7823 43.0644 178.2629 125 L 3.9474 7.1500 118.4620 57.7875 41.5187 179.0179 126 E 3.9186 7.3748 115.8986 59.3858 29.4014 178.4818 127 D 4.4746 7.6068 116.8304 56.7438 41.2399 176.0191 128 E 4.2331 7.9320 122.2326 56.4434 30.5777 175.0589 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 S 8.19 4.47 0.00 4.04 4.02 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 0.00 0.00 0.00 2 N 8.22 4.50 0.00 2.85 3.02 0.00 0.00 6.54 6.79 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 3 V 7.80 4.31 2.19 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 0.74 0.00 0.00 1.00 0.00 0.00 4 P 0.00 4.19 0.00 1.72 1.75 0.00 2.79 0.00 0.00 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 1.52 0.00 5 A 8.62 4.14 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 6 E 7.99 4.24 0.00 2.06 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 2.19 2.20 0.00 7 L 7.13 4.42 0.00 1.09 1.11 0.31 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 8 K 8.45 4.75 0.00 1.64 1.71 0.00 1.69 0.00 0.00 1.71 0.00 0.00 2.87 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.63 7.81 9 Y 9.07 5.10 0.00 2.76 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 0.00 0.00 0.00 0.00 10 S 8.77 5.02 0.00 3.82 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 11 K 8.02 4.58 0.00 1.84 1.86 0.00 1.65 0.00 0.00 1.71 0.00 0.00 3.07 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.33 1.53 7.81 12 E 9.08 4.11 0.00 2.15 2.19 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 2.31 2.53 0.00 13 H 7.88 4.20 0.00 3.51 3.59 0.00 5.57 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 E 8.00 5.25 0.00 1.83 1.73 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 2.25 2.48 0.00 15 W 8.10 5.16 0.00 3.16 3.06 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 0.00 0.00 0.00 0.00 16 L 8.68 5.42 0.00 1.65 1.71 0.81 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 17 R 9.23 4.94 0.00 2.03 1.95 0.00 3.03 0.00 0.00 3.02 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.52 0.00 18 K 8.67 3.83 0.00 1.58 1.55 0.00 1.72 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.06 0.74 7.81 19 E 8.93 4.25 0.00 1.99 1.73 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 2.15 2.24 0.00 20 A 8.41 3.87 1.23 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 0.00 0.00 0.00 21 D 7.98 4.57 0.00 2.76 2.72 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 G 8.14 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 23 T 7.83 4.38 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 1.24 0.00 0.00 24 Y 9.07 5.09 0.00 2.93 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 25 T 8.95 4.69 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 1.03 0.00 0.00 26 V 7.89 4.36 0.70 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 0.15 0.00 0.00 0.68 0.00 0.00 27 G 6.18 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.17 4.98 1.91 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 1.41 0.75 0.88 0.00 0.00 29 T 8.59 4.46 4.64 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 1.53 0.00 0.00 30 E 8.60 3.89 0.00 2.22 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 2.34 2.57 0.00 31 H 8.47 4.22 0.00 3.36 3.48 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 32 A 8.00 3.91 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 33 Q 8.52 3.97 0.00 2.29 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.75 0.00 0.00 0.00 0.00 0.00 2.44 2.49 0.00 34 E 8.13 3.91 0.00 1.98 2.26 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 2.34 2.35 0.00 35 L 7.45 4.07 0.00 1.55 1.71 0.93 1.05 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 36 L 7.61 4.11 0.00 1.68 1.83 0.92 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 37 G 7.81 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 0.00 0.00 0.00 0.00 38 D 8.41 4.47 0.00 2.68 2.59 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 0.00 0.00 0.00 0.00 39 M 9.26 4.49 0.00 2.00 1.92 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.72 0.00 40 V 8.73 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 0.57 0.00 0.00 0.85 0.00 0.00 41 F 7.74 5.13 0.00 2.93 2.83 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 42 V 8.44 4.97 2.07 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 0.72 0.00 0.00 0.99 0.00 0.00 43 D 9.33 4.89 0.00 2.53 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 44 L 8.40 4.86 0.00 1.50 1.57 0.87 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 45 P 0.00 4.53 0.00 1.90 2.05 0.00 3.72 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.51 0.00 46 E 8.44 4.23 0.00 1.98 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 2.34 2.20 0.00 47 V 8.15 3.80 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 0.83 0.00 0.00 0.97 0.00 0.00 48 G 9.15 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 0.00 0.00 0.00 49 A 7.77 4.11 1.24 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 0.00 0.00 50 T 8.47 4.63 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 1.20 0.00 0.00 51 V 8.81 4.66 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 0.61 0.00 0.00 0.89 0.00 0.00 52 S 9.61 4.88 0.00 4.09 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 53 A 8.18 4.23 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 54 G 9.00 4.06 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 D 8.16 4.65 0.00 2.62 2.61 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 56 D 8.82 4.83 0.00 2.44 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 C 8.08 4.89 0.00 2.78 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 A 7.31 4.48 1.24 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 0.00 0.00 59 V 8.33 4.69 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 0.98 0.00 0.00 0.90 0.00 0.00 60 A 9.07 5.02 1.22 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 0.00 0.00 0.00 61 E 9.71 5.11 0.00 2.08 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 2.37 2.44 0.00 62 S 8.70 5.01 0.00 3.96 3.84 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 63 V 8.31 3.37 2.07 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 0.79 0.00 0.00 0.90 0.00 0.00 *65 A 7.72 4.08 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 66 A 8.23 5.23 1.23 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 0.00 0.00 0.00 67 S 9.15 4.64 0.00 3.82 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 68 D 8.78 4.76 0.00 2.24 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 0.00 0.00 0.00 69 I 8.37 4.44 1.97 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 1.02 0.98 0.00 0.00 70 Y 8.42 5.18 0.00 2.85 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 71 A 9.31 4.41 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 72 P 0.00 4.25 0.00 2.14 2.29 0.00 3.95 0.00 0.00 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.91 0.00 73 V 7.28 4.55 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 0.62 0.00 0.00 0.84 0.00 0.00 74 S 9.51 4.52 0.00 4.02 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 75 G 7.44 4.06 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 E 7.91 5.04 0.00 2.04 1.79 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 2.20 2.24 0.00 77 I 8.96 4.37 1.94 0.00 0.00 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.46 0.97 0.00 0.00 78 V 8.80 4.35 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 0.71 0.00 0.00 1.01 0.00 0.00 79 A 7.86 4.90 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 80 V 8.34 4.92 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 0.83 0.00 0.00 0.94 0.00 0.00 81 N 8.27 3.66 0.00 1.44 1.95 0.00 0.00 7.42 9.28 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 82 D 8.30 4.44 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 83 A 7.71 4.05 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 84 L 7.58 4.01 0.00 1.60 1.65 0.73 0.56 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 85 S 7.50 4.31 0.00 3.87 3.95 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 86 D 7.97 4.68 0.00 2.64 2.71 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 0.00 0.00 0.00 0.00 87 S 8.08 5.10 0.00 3.97 3.71 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 0.00 0.00 0.00 0.00 88 P 0.00 4.35 0.00 2.16 2.34 0.00 3.72 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 1.93 2.00 0.00 89 E 8.08 4.10 0.00 2.14 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 0.00 2.33 2.32 0.00 90 L 7.79 4.29 0.00 1.79 1.66 0.90 0.89 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 91 V 7.49 3.58 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 0.82 0.00 0.00 0.94 0.00 0.00 92 N 8.06 4.89 0.00 2.87 2.84 0.00 0.00 7.32 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 93 S 8.25 4.40 0.00 4.05 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 94 E 8.41 5.00 0.00 2.14 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 2.25 2.25 0.00 95 P 0.00 4.34 0.00 1.77 2.20 0.00 3.71 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.82 0.00 96 Y 7.77 4.02 0.00 2.77 2.41 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 97 A 8.10 4.58 1.17 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 0.00 0.00 0.00 0.00 0.00 0.00 98 G 6.83 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 0.00 0.00 0.00 0.00 99 G 8.29 3.95 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 0.00 0.00 0.00 100 W 7.93 4.48 0.00 3.46 3.45 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 0.00 101 I 8.91 4.24 1.67 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.92 1.04 0.00 0.00 102 F 7.43 5.88 0.00 3.28 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 0.00 103 K 9.62 5.21 0.00 1.76 1.70 0.00 1.43 0.00 0.00 1.31 0.00 0.00 2.13 0.00 0.00 2.53 0.00 0.00 0.00 0.00 1.04 1.04 7.81 104 I 9.08 5.05 2.16 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 1.22 1.83 1.15 0.00 0.00 105 K 9.31 4.80 0.00 1.87 1.73 0.00 1.70 0.00 0.00 1.67 0.00 0.00 2.87 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.42 1.43 7.81 106 A 8.85 4.74 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 0.00 107 S 8.66 4.65 0.00 3.88 3.95 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 0.00 108 D 7.73 4.43 0.00 2.65 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 0.00 109 E 8.86 4.02 0.00 2.03 2.00 0.00 0.00 0.00 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 2.34 0.00 110 S 7.75 4.33 0.00 4.05 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.07 4.06 0.00 2.12 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 2.33 0.00 112 L 7.92 3.87 0.00 1.90 1.67 0.97 0.31 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 0.00 113 E 8.13 4.25 0.00 2.10 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 2.36 2.56 0.00 114 S 7.46 4.69 0.00 3.83 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 L 7.10 4.29 0.00 1.63 1.71 0.72 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 116 L 9.45 4.51 0.00 1.84 1.76 0.99 1.28 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 0.00 117 D 8.56 5.41 0.00 2.78 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 0.00 118 A 9.07 4.11 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.92 3.80 4.44 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 1.21 0.00 0.00 120 A 8.01 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 0.00 121 Y 8.37 4.21 0.00 2.77 2.41 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 0.00 122 E 7.93 3.80 0.00 2.00 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 2.23 2.28 0.00 123 A 7.60 4.24 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 0.00 124 L 7.80 4.10 0.00 1.50 1.45 0.92 1.36 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 0.00 125 L 7.15 3.95 0.00 1.52 1.48 0.75 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 126 E 7.37 3.92 0.00 1.96 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 2.29 2.44 0.00 127 D 7.61 4.47 0.00 2.87 2.83 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 0.00 128 E 7.93 4.23 0.00 1.95 1.75 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 2.22 2.36 0.00 * Residues marked with a * may have inaccurate shift predictions.