NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 T 4.2418 8.1744 117.3716 63.5923 69.7412 173.5166 3 N 4.6231 8.4152 125.1282 51.9951 40.4165 171.2056 4 R 4.8558 8.5463 125.4749 54.6739 33.6495 172.9272 5 L 4.7956 9.5232 128.8933 53.1376 45.2275 175.0913 6 V 4.7736 8.3987 124.9245 61.0872 33.9618 174.2291 7 L 4.8806 9.2091 130.4434 53.3018 45.3166 175.2991 8 S 5.1497 8.8166 120.1825 56.7364 65.8794 174.3922 9 G 3.9251 7.6785 107.0565 46.2176 0.0000 170.7346 10 T 4.9629 7.7086 113.9907 59.7521 70.4820 174.6091 11 V 4.2225 8.6295 129.2536 63.7001 32.2636 175.5409 12 C 4.7407 8.9021 122.4863 58.0138 30.4869 173.6544 13 R 4.6904 7.7826 119.2565 54.7991 32.6883 174.3115 14 A 4.1069 8.8943 127.9527 51.9548 18.9507 175.3654 15 P 4.7058 0.0000 0.0000 62.9316 32.3847 175.6677 16 L 4.7593 9.5309 125.0127 53.1614 43.8065 175.6799 17 R 5.2543 8.5069 122.1956 54.7610 32.9969 175.2384 18 K 4.6522 8.8642 120.1226 55.5329 37.5237 174.8158 19 V 4.8995 8.1293 121.3588 60.9289 33.9724 175.6674 20 S 4.4219 9.2091 123.0569 57.3736 63.7138 173.2201 21 P 4.2655 0.0000 0.0000 65.9888 31.0436 178.0779 22 S 4.2076 7.9338 110.3761 59.1339 63.3125 174.7230 23 G 4.0930 8.4714 108.9563 44.7990 0.0000 173.6624 24 I 4.1330 7.6720 114.9300 59.9221 38.9254 173.7720 25 P 5.0051 0.0000 0.0000 62.7663 33.1771 174.6891 26 H 5.4236 9.6062 118.9098 54.2475 33.1260 171.9167 27 C 5.2235 9.0794 122.4566 57.8027 34.4792 172.4677 28 Q 5.1949 9.3349 125.7706 54.3333 32.0260 174.9557 29 F 5.0270 8.2758 116.8289 56.0834 42.0714 172.5122 30 V 4.6118 8.6784 117.1744 61.1290 34.2773 174.0582 31 L 4.9926 8.4586 129.1518 53.3799 44.3571 174.1639 32 E 4.8498 9.0229 128.3588 55.2440 31.2791 174.0749 33 H 5.2115 9.1640 127.0114 54.5513 33.0707 172.8136 34 R 5.3342 7.7411 122.4183 54.9585 34.0797 174.3022 35 S 4.5516 8.8103 115.9526 57.9463 66.9154 174.9112 36 V 4.5623 8.4688 121.1161 61.7527 32.2192 174.9551 37 Q 4.7726 8.6238 126.5686 54.0890 31.9630 174.7127 38 E 4.5956 8.6731 121.6273 54.6343 30.7275 175.2287 39 E 4.3155 8.5866 127.5540 54.9056 29.7144 175.3078 40 A 3.7363 9.5967 125.4480 52.2523 16.8372 178.2988 41 G 4.2264 8.1693 106.1831 45.3274 0.0000 172.6600 42 F 5.0053 7.5269 123.9098 57.9794 43.1214 173.1758 43 H 3.9182 9.0773 124.6367 54.8963 29.0158 171.7314 44 R 3.5331 8.5322 132.6322 55.7317 29.6134 174.1794 45 Q 4.5588 8.4168 127.3143 54.5315 29.9011 174.4140 46 A 4.5830 8.9494 130.2390 51.1284 20.1272 175.7766 47 W 6.1451 8.6227 130.9824 56.7120 34.1289 173.2839 48 C 3.2794 6.9035 117.2673 57.2425 31.6724 172.4290 49 Q 4.9582 7.4800 118.3552 52.6797 31.8777 173.0923 *51 P 4.2276 0.0000 0.0000 62.5272 33.3485 175.9530 52 V 4.6162 8.4059 122.4528 60.8870 35.1469 174.0681 53 I 4.7595 8.1145 120.3258 58.9239 40.9620 174.3592 54 V 4.4838 8.9776 125.7608 61.4690 33.4464 174.2007 55 S 5.2281 8.8941 123.8802 57.8989 65.4381 174.8564 56 G 3.9737 8.5549 109.7246 45.3506 0.0000 172.9173 57 H 4.2720 8.1595 116.0912 58.7705 29.2393 176.2149 58 E 4.8186 7.8730 125.0022 55.2258 26.9469 176.5634 59 N 5.2270 7.8701 133.2691 54.1582 38.8639 175.8461 60 Q 4.1081 7.8621 119.0863 58.6631 29.0010 177.0111 61 A 3.9848 8.1125 121.8106 55.5953 18.4209 179.1599 62 I 3.6903 7.7850 115.7154 64.1495 37.9855 177.9886 63 T 3.8475 7.5804 116.5161 67.1179 68.0513 175.9401 64 H 4.3977 7.9894 116.5361 58.0679 28.7160 176.3466 65 S 4.5511 7.6656 115.5728 58.3407 62.7637 173.5457 66 I 4.3139 7.3286 122.0812 59.6875 38.8622 174.8276 67 T 4.5620 8.7889 118.3697 59.7527 70.8121 172.8127 68 V 3.8280 8.1360 123.4788 64.7249 31.6459 175.9687 69 G 4.0271 9.1794 115.7548 45.2308 0.0000 174.0817 70 S 4.1958 8.2204 117.0675 58.8979 64.0324 173.6237 71 R 5.0521 8.5660 123.4107 54.9621 31.6101 175.4709 72 I 4.9262 8.7765 116.9041 59.6820 42.2885 173.9887 73 T 5.0459 8.3534 117.5337 61.7945 72.1672 173.2984 74 V 4.9062 9.1082 126.2412 61.0464 34.8291 173.8975 75 Q 4.9495 8.6999 128.0185 54.7726 31.8631 174.2848 76 G 4.6046 8.6557 112.8932 47.7082 0.0000 171.6428 77 F 5.6556 8.1067 115.3033 55.0032 41.2105 174.5925 78 I 4.8758 8.9657 114.7667 60.1152 39.2780 174.7923 79 S 4.7320 8.7068 117.4993 57.4881 65.8125 172.7578 80 C 5.0903 8.6045 122.3039 58.3935 29.4509 172.8230 81 H 4.9123 9.1376 120.7637 53.4036 31.6697 173.3882 82 K 4.2988 8.7721 123.4255 55.2909 32.1998 177.9682 83 A 4.6148 8.6717 135.0000 51.7275 17.8772 178.1527 84 K 4.5331 8.7036 117.9018 59.9461 35.1556 177.1916 85 N 4.9517 7.9260 116.7306 52.4104 35.8374 175.5737 86 G 3.7653 8.2830 103.2314 46.3361 0.0000 173.0747 87 L 4.3101 7.7445 122.8394 53.9013 43.6364 176.9194 88 S 4.5198 8.6200 118.1809 58.8418 63.9082 173.4243 89 K 4.6555 9.7834 121.9912 55.6081 35.5021 174.5210 *91 V 4.0831 8.2299 116.3897 62.7417 33.4514 175.1879 92 L 4.5956 8.3542 129.3542 54.0020 43.5980 175.2459 93 H 4.4024 8.7344 125.6894 54.1954 29.2129 174.8911 94 A 4.1933 8.2809 126.4424 52.4731 18.4292 176.5356 95 E 4.6294 9.5208 121.0385 57.2615 32.9279 176.4001 96 Q 4.8871 7.8764 116.4316 54.2263 33.5086 174.4154 97 I 5.0028 8.3505 122.5477 59.6243 41.1887 173.9823 98 E 4.5461 8.8414 128.1252 53.8004 31.4971 176.3651 99 L 3.9888 8.8497 127.1815 55.3393 42.4070 176.4666 100 I 3.9575 7.7595 122.5452 61.7680 39.9669 172.8457 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 2 T 8.17 4.24 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 3 N 8.42 4.62 0.00 2.77 2.70 0.00 0.00 6.82 6.77 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 4 R 8.55 4.86 0.00 1.83 1.76 0.00 3.24 0.00 0.00 3.17 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.65 0.00 5 L 9.52 4.80 0.00 1.72 1.44 0.88 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 6 V 8.40 4.77 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 0.85 0.00 0.00 1.00 0.00 0.00 7 L 9.21 4.88 0.00 1.65 1.39 0.67 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 8 S 8.82 5.15 0.00 3.92 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 9 G 7.68 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 0.00 0.00 0.00 10 T 7.71 4.96 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 1.24 0.00 0.00 11 V 8.63 4.22 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 0.70 0.00 0.00 0.69 0.00 0.00 12 C 8.90 4.74 0.00 3.07 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 13 R 7.78 4.69 0.00 1.83 1.86 0.00 3.28 0.00 0.00 3.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.67 0.00 14 A 8.89 4.11 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 15 P 0.00 4.71 0.00 1.96 2.08 0.00 3.62 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 2.09 1.93 0.00 16 L 9.53 4.76 0.00 1.59 1.58 0.98 -0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 17 R 8.51 5.25 0.00 1.69 1.84 0.00 3.29 0.00 0.00 3.25 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.65 0.00 18 K 8.86 4.65 0.00 1.70 1.67 0.00 1.61 0.00 0.00 1.58 0.00 0.00 2.81 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.38 1.40 7.81 19 V 8.13 4.90 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 0.88 0.00 0.00 0.94 0.00 0.00 20 S 9.21 4.42 0.00 4.07 4.08 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 0.00 0.00 0.00 0.00 21 P 0.00 4.27 0.00 2.07 2.20 0.00 3.70 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.12 0.00 22 S 7.93 4.21 0.00 3.99 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 23 G 8.47 4.09 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 I 7.67 4.13 1.80 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.09 0.90 0.00 0.00 25 P 0.00 5.01 0.00 2.14 2.21 0.00 3.68 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.05 0.00 26 H 9.61 5.42 0.00 3.01 3.16 0.00 5.56 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 C 9.08 5.22 0.00 3.19 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 28 Q 9.33 5.19 0.00 1.94 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.24 0.00 0.00 0.00 0.00 0.00 2.16 2.23 0.00 29 F 8.28 5.03 0.00 3.17 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 30 V 8.68 4.61 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 0.95 0.00 0.00 0.93 0.00 0.00 31 L 8.46 4.99 0.00 1.93 1.49 1.07 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 32 E 9.02 4.85 0.00 2.15 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 2.38 2.36 0.00 33 H 9.16 5.21 0.00 3.22 2.97 0.00 5.61 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 R 7.74 5.33 0.00 1.71 1.81 0.00 3.41 0.00 0.00 3.35 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 2.00 0.00 35 S 8.81 4.55 0.00 3.86 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 36 V 8.47 4.56 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 0.67 0.00 0.00 0.89 0.00 0.00 37 Q 8.62 4.77 0.00 1.97 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 6.43 0.00 0.00 0.00 0.00 0.00 2.31 2.43 0.00 38 E 8.67 4.60 0.00 1.93 1.87 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 2.24 2.32 0.00 39 E 8.59 4.32 0.00 2.05 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 2.32 2.30 0.00 40 A 9.60 3.74 1.39 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 0.00 0.00 0.00 41 G 8.17 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 0.00 0.00 0.00 0.00 42 F 7.53 5.01 0.00 2.89 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 43 H 9.08 3.92 0.00 3.02 2.79 0.00 6.07 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 44 R 8.53 3.53 0.00 2.04 2.12 0.00 3.26 0.00 0.00 3.23 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.65 0.00 45 Q 8.42 4.56 0.00 2.07 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.64 0.00 0.00 0.00 0.00 0.00 2.27 2.46 0.00 46 A 8.95 4.58 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 47 W 8.62 6.15 0.00 3.27 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 48 C 6.90 3.28 0.00 2.56 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 49 Q 7.48 4.96 0.00 1.75 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.57 0.00 0.00 0.00 0.00 0.00 2.26 2.02 0.00 *51 P 0.00 4.23 0.00 1.95 1.87 0.00 3.42 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 1.92 2.00 0.00 52 V 8.41 4.62 0.67 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 0.70 0.00 0.00 0.66 0.00 0.00 53 I 8.11 4.76 1.73 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.13 0.67 0.00 0.00 54 V 8.98 4.48 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 1.00 0.00 0.00 1.03 0.00 0.00 55 S 8.89 5.23 0.00 3.84 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 56 G 8.55 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.16 4.27 0.00 3.21 3.25 0.00 5.65 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 58 E 7.87 4.82 0.00 1.98 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 2.33 0.00 59 N 7.87 5.23 0.00 2.81 2.94 0.00 0.00 7.24 7.08 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 60 Q 7.86 4.11 0.00 2.43 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.52 0.00 0.00 0.00 0.00 0.00 2.35 2.35 0.00 61 A 8.11 3.98 1.34 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 0.00 0.00 62 I 7.78 3.69 1.87 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 1.62 1.31 0.97 0.00 0.00 63 T 7.58 3.85 4.46 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 1.10 0.00 0.00 64 H 7.99 4.40 0.00 3.26 3.34 0.00 5.65 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 S 7.67 4.55 0.00 3.95 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 66 I 7.33 4.31 1.75 0.00 0.00 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 1.01 0.63 0.34 0.00 0.00 67 T 8.79 4.56 4.19 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 1.17 0.00 0.00 68 V 8.14 3.83 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 0.83 0.00 0.00 0.91 0.00 0.00 69 G 9.18 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 70 S 8.22 4.20 0.00 3.65 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 71 R 8.57 5.05 0.00 1.79 1.85 0.00 3.25 0.00 0.00 3.38 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 72 I 8.78 4.93 1.96 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 1.24 1.32 0.84 0.00 0.00 73 T 8.35 5.05 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 1.27 0.00 0.00 74 V 9.11 4.91 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 0.96 0.00 0.00 1.04 0.00 0.00 75 Q 8.70 4.95 0.00 2.12 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.32 0.00 0.00 0.00 0.00 0.00 2.26 2.29 0.00 76 G 8.66 4.60 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 77 F 8.11 5.66 0.00 3.17 3.21 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 78 I 8.97 4.88 1.87 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.71 0.88 0.00 0.00 79 S 8.71 4.73 0.00 4.05 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 80 C 8.60 5.09 0.00 2.86 2.82 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 81 H 9.14 4.91 0.00 3.04 3.18 0.00 5.81 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 K 8.77 4.30 0.00 1.77 1.77 0.00 1.80 0.00 0.00 1.71 0.00 0.00 2.93 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.42 1.40 7.81 83 A 8.67 4.61 1.10 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 0.00 0.00 84 K 8.70 4.53 0.00 1.69 1.79 0.00 1.78 0.00 0.00 1.76 0.00 0.00 3.02 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.31 1.38 7.81 85 N 7.93 4.95 0.00 2.87 1.95 0.00 0.00 5.83 7.00 0.00 0.00 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 G 8.28 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 0.00 0.00 0.00 87 L 7.74 4.31 0.00 1.67 1.59 0.92 0.90 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 88 S 8.62 4.52 0.00 4.06 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 89 K 9.78 4.66 0.00 1.83 1.61 0.00 1.61 0.00 0.00 1.55 0.00 0.00 2.73 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.29 1.32 7.81 *91 V 8.23 4.08 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 0.63 0.00 0.00 0.79 0.00 0.00 92 L 8.35 4.60 0.00 1.67 1.50 0.84 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 93 H 8.73 4.40 0.00 1.40 2.49 0.00 5.68 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 94 A 8.28 4.19 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 95 E 9.52 4.63 0.00 2.11 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 2.34 2.40 0.00 96 Q 7.88 4.89 0.00 1.92 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.87 0.00 0.00 0.00 0.00 0.00 2.36 2.34 0.00 97 I 8.35 5.00 1.90 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.64 0.95 0.00 0.00 98 E 8.84 4.55 0.00 2.05 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 2.41 2.22 0.00 99 L 8.85 3.99 0.00 1.61 1.66 0.92 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 100 I 7.76 3.96 1.94 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 1.15 1.00 0.91 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.