NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 10 F 4.7800 8.1676 119.3927 57.5705 40.6639 176.1848 11 T 3.9526 8.0951 106.9228 60.7845 67.8087 173.0188 12 S 4.7140 9.2487 116.6408 58.3908 65.1121 175.7883 13 R 4.5518 7.9598 118.1351 56.4704 32.1578 176.2398 14 L 4.4739 7.7290 116.6944 53.2491 42.3077 174.9194 15 P 4.3384 0.0000 0.0000 61.9433 31.4370 174.9903 16 P 3.8536 0.0000 0.0000 66.0167 31.4721 178.7320 17 E 3.5094 7.0953 113.3868 59.1186 29.6511 179.2627 18 I 3.7227 7.2907 124.6125 64.7654 37.9016 178.4788 19 V 3.6787 8.6286 119.8840 65.7692 31.3781 177.6553 20 A 3.8927 7.9936 119.7352 55.3580 18.0432 179.0238 21 A 3.5684 8.0805 119.1345 55.3330 18.5115 178.8698 22 L 4.2529 7.5075 113.8856 56.3882 42.3520 178.4030 23 K 4.0429 8.7112 120.8332 59.3674 32.3455 178.0499 24 R 3.9061 7.9482 117.4146 59.1227 31.2380 177.0695 *34 F 4.6602 8.0707 114.9167 55.0569 41.6000 177.3666 35 P 4.0784 0.0000 0.0000 62.8285 33.0438 176.7936 36 R 3.9897 9.0732 127.1169 61.3333 28.6491 176.8807 37 K 3.9341 8.3693 118.3987 58.9909 31.6483 178.3051 38 L 3.7591 7.8791 124.4400 59.3270 42.3441 178.5159 39 H 4.5574 8.6535 118.8635 58.4040 29.6922 176.7661 40 M 4.0590 9.5154 121.7451 58.0009 30.9174 178.7076 41 L 3.8949 8.0249 121.1370 58.0116 42.3493 178.4194 42 L 3.6894 7.7504 119.5109 58.3209 41.4812 179.7211 43 T 4.0708 7.3381 106.2253 65.3713 67.7237 174.8733 44 Y 4.4509 8.1102 122.6485 59.8827 38.6298 176.9757 45 L 3.9860 8.0008 119.6039 57.5494 41.6257 178.5757 46 A 4.9817 7.6643 119.4932 52.1615 18.5134 177.6508 47 S 4.5945 8.6510 113.1064 57.8136 63.7901 174.8266 48 N 4.6334 7.7768 120.5598 50.5278 39.5117 172.8065 49 P 4.0930 0.0000 0.0000 65.7383 31.5406 177.2953 50 Q 3.9089 7.9912 115.4930 59.3974 28.8315 179.1525 51 L 3.7510 7.9529 120.5488 57.9632 42.0885 178.7529 52 E 3.7852 8.1468 117.3858 59.6908 29.4554 179.0175 53 E 4.3047 7.9026 118.9943 58.7046 29.5242 179.2413 54 E 3.9631 7.7995 117.8612 59.3884 29.6795 179.0085 55 I 3.5154 7.2759 118.7655 63.4238 38.8489 177.2377 56 G 3.2252 8.3819 108.8257 43.8402 0.0000 171.4349 57 L 5.0467 7.4080 115.1102 55.5065 44.4595 172.6765 58 S 4.4803 7.7077 120.0021 57.1772 65.9880 172.9696 59 W 5.2878 8.5064 119.8879 55.7103 29.8254 174.7163 60 I 4.3545 7.9863 118.5967 62.7302 38.8891 177.7932 61 S 4.2196 7.4108 118.7462 58.3231 63.8700 173.2653 62 D 3.9924 7.3316 125.5497 53.3973 44.0277 177.0482 63 T 5.0591 7.2462 109.9581 60.2891 70.3254 172.0488 64 E 5.1009 9.5969 124.0941 55.0167 31.8705 174.5438 65 F 5.5682 8.4452 121.5875 54.9765 42.1212 173.9879 66 K 5.0086 9.2330 119.1164 56.0430 33.7513 175.8339 67 M 5.1471 9.2131 122.1079 54.4028 36.2365 173.5593 68 K 4.4737 7.6334 121.6319 56.7708 31.9630 179.2455 69 K 4.0211 8.2622 115.5965 55.3820 34.0877 177.4514 70 K 4.1639 8.0836 119.0598 59.2360 33.1014 177.0222 71 N 4.2173 8.0623 116.1363 56.8606 38.5971 177.3219 72 V 3.4032 7.1228 117.5678 66.2057 31.6615 177.3946 73 A 3.9349 8.1573 120.5448 54.9640 17.7248 178.9167 74 L 3.7751 7.9038 117.9305 58.6093 41.9321 179.7060 75 V 3.6025 7.7156 116.3900 66.1111 31.4477 177.0823 76 M 4.1277 7.8840 116.9170 56.2282 32.3017 176.9451 77 G 3.9760 7.6507 105.5834 45.1324 0.0000 173.7776 78 I 3.9030 7.2109 119.4515 61.1458 37.7583 175.2722 79 K 4.3940 7.7580 122.1855 54.7385 33.8567 176.0561 80 L 3.9289 8.2957 125.5211 56.9351 42.0711 179.3717 *81 N 4.1538 8.6411 114.9606 55.8747 38.4571 180.0482 82 T 4.2464 7.9427 103.7099 62.0903 68.6714 173.7239 83 L 4.7426 9.0241 124.1875 56.7350 44.1965 177.9773 84 N 4.3047 8.3906 117.1339 56.1193 38.5151 176.4296 85 V 3.9756 7.6470 119.0908 63.8338 32.5417 177.6046 86 N 4.2892 8.1627 115.1993 55.1479 38.0544 176.2114 87 L 4.0821 7.5972 122.3171 57.3018 42.1180 178.1997 88 R 4.0463 7.7524 119.1904 59.1513 30.5159 177.4100 89 D 4.9606 8.1575 117.4870 53.0326 40.7159 176.7457 90 L 4.0877 7.7357 113.0304 54.5989 42.7592 174.3196 91 A 3.7482 8.3964 117.4716 51.4194 15.8973 177.5838 92 F 5.3655 7.5481 116.0335 57.3430 40.3293 175.6652 93 E 4.6038 10.6858 124.5617 54.8944 30.5748 176.0053 94 Q 3.5380 8.8351 127.7634 55.5659 30.8576 176.4809 95 L 5.9191 7.1815 132.6996 56.5363 41.8026 173.3923 96 Q 4.5163 7.9359 119.8793 58.3703 36.9699 174.8566 97 H 5.2167 9.2305 114.9168 57.5559 30.6143 174.2954 98 D 4.7191 7.4576 118.7929 57.2409 45.0058 176.9461 99 K 3.8601 8.5365 118.9218 57.5164 29.9149 175.9266 100 G 4.0121 9.3880 111.9932 46.1275 0.0000 172.9246 101 G 3.9523 8.5865 109.5786 44.3841 0.0000 174.0504 102 W 5.1039 7.9774 119.6490 56.3080 31.5228 175.6182 103 T 4.9654 9.6520 118.0602 62.1821 72.4156 173.1021 104 Q 5.1239 8.5048 124.1513 54.9491 30.6982 174.7668 105 W 5.5999 9.1488 121.5829 55.1108 34.4240 173.2836 106 K 4.5071 8.6154 118.6849 57.3249 34.8443 173.6333 107 R 4.9343 8.3535 121.6299 56.0512 32.9909 174.2585 108 S 4.2454 8.8162 119.6824 58.5130 63.1634 174.3167 109 G 3.9131 8.6203 107.4534 46.0981 0.0000 172.5013 110 F 4.9603 8.3842 123.0791 57.0155 39.9362 174.5801 111 T 5.6862 8.9588 117.4766 59.9378 71.5580 174.9143 112 R 3.7372 7.4806 118.9396 57.6793 29.4148 177.0716 113 N 4.5496 7.7714 116.5470 54.5587 39.4586 174.6312 114 S 4.5354 8.0340 110.0974 58.9135 66.6954 176.5538 115 V 4.8945 8.0620 119.4299 64.0959 31.0740 173.5581 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 F 8.17 4.78 0.00 3.12 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 11 T 8.10 3.95 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 12 S 9.25 4.71 0.00 3.95 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 13 R 7.96 4.55 0.00 1.99 2.04 0.00 3.22 0.00 0.00 3.27 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.75 0.00 14 L 7.73 4.47 0.00 1.61 1.50 1.06 1.13 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 15 P 0.00 4.34 0.00 1.91 1.84 0.00 2.87 0.00 0.00 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.99 0.00 16 P 0.00 3.85 0.00 2.14 1.99 0.00 3.57 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 2.10 2.14 0.00 17 E 7.10 3.51 0.00 1.96 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 2.36 2.48 0.00 18 I 7.29 3.72 1.80 0.00 0.00 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.19 0.83 0.00 0.00 19 V 8.63 3.68 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 0.99 0.00 0.00 0.99 0.00 0.00 20 A 7.99 3.89 1.32 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 0.00 0.00 21 A 8.08 3.57 1.32 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 0.00 0.00 22 L 7.51 4.25 0.00 1.77 1.68 0.86 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 23 K 8.71 4.04 0.00 1.76 1.93 0.00 1.79 0.00 0.00 1.61 0.00 0.00 2.94 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.36 7.81 24 R 7.95 3.91 0.00 1.78 1.94 0.00 3.37 0.00 0.00 3.23 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.72 0.00 *34 F 8.07 4.66 0.00 3.16 3.14 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 35 P 0.00 4.08 0.00 2.34 1.22 0.00 3.91 0.00 0.00 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.14 0.00 36 R 9.07 3.99 0.00 2.10 2.24 0.00 3.08 0.00 0.00 3.38 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.84 0.00 37 K 8.37 3.93 0.00 2.07 1.72 0.00 1.70 0.00 0.00 1.53 0.00 0.00 3.08 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.45 1.48 7.81 38 L 7.88 3.76 0.00 1.29 1.83 0.39 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 39 H 8.65 4.56 0.00 3.70 3.57 0.00 5.68 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 M 9.52 4.06 0.00 2.36 2.42 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.67 0.00 41 L 8.02 3.89 0.00 1.84 1.72 0.93 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 42 L 7.75 3.69 0.00 1.53 1.27 0.09 0.20 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 43 T 7.34 4.07 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 1.42 0.00 0.00 44 Y 8.11 4.45 0.00 3.02 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 45 L 8.00 3.99 0.00 1.61 1.61 0.80 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 46 A 7.66 4.98 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 S 8.65 4.59 0.00 3.81 3.79 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 48 N 7.78 4.63 0.00 2.39 2.24 0.00 0.00 7.18 7.37 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 49 P 0.00 4.09 0.00 2.16 2.05 0.00 3.61 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 2.09 2.18 0.00 50 Q 7.99 3.91 0.00 2.01 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.86 0.00 0.00 0.00 0.00 0.00 2.44 2.37 0.00 51 L 7.95 3.75 0.00 1.96 1.49 0.72 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 52 E 8.15 3.79 0.00 2.20 2.33 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 2.49 2.40 0.00 53 E 7.90 4.30 0.00 2.01 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 2.46 2.71 0.00 54 E 7.80 3.96 0.00 2.01 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 2.28 2.42 0.00 55 I 7.28 3.52 1.63 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 1.03 0.48 0.79 0.00 0.00 56 G 8.38 3.23 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 57 L 7.41 5.05 0.00 1.35 1.36 0.49 0.40 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 58 S 7.71 4.48 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 59 W 8.51 5.29 0.00 3.60 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 60 I 7.99 4.35 2.10 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.88 0.94 0.00 0.00 61 S 7.41 4.22 0.00 3.96 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 62 D 7.33 3.99 0.00 2.51 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 63 T 7.25 5.06 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 1.22 0.00 0.00 64 E 9.60 5.10 0.00 1.99 1.83 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 2.23 2.22 0.00 65 F 8.45 5.57 0.00 3.08 2.94 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 0.00 0.00 0.00 66 K 9.23 5.01 0.00 2.02 2.18 0.00 1.38 0.00 0.00 0.61 0.00 0.00 2.16 0.00 0.00 2.53 0.00 0.00 0.00 0.00 1.22 1.33 7.81 67 M 9.21 5.15 0.00 2.26 1.70 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.37 0.00 68 K 7.63 4.47 0.00 1.37 1.37 0.00 0.97 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.59 0.00 0.00 0.00 0.00 0.47 0.21 7.81 69 K 8.26 4.02 0.00 1.86 1.73 0.00 1.84 0.00 0.00 1.94 0.00 0.00 3.53 0.00 0.00 3.60 0.00 0.00 0.00 0.00 1.57 1.77 7.81 70 K 8.08 4.16 0.00 1.80 1.69 0.00 1.57 0.00 0.00 1.79 0.00 0.00 3.22 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.50 1.63 7.81 71 N 8.06 4.22 0.00 2.85 2.97 0.00 0.00 6.51 7.68 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 72 V 7.12 3.40 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 0.51 0.00 0.00 0.75 0.00 0.00 73 A 8.16 3.93 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 74 L 7.90 3.78 0.00 1.75 1.86 0.81 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 75 V 7.72 3.60 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 0.84 0.00 0.00 1.08 0.00 0.00 76 M 7.88 4.13 0.00 1.92 2.04 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.39 0.00 77 G 7.65 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 0.00 0.00 0.00 78 I 7.21 3.90 1.82 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.50 0.97 0.00 0.00 79 K 7.76 4.39 0.00 1.67 1.77 0.00 1.60 0.00 0.00 1.64 0.00 0.00 3.02 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.40 7.81 80 L 8.30 3.93 0.00 1.67 1.46 0.94 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 *81 N 8.64 4.15 0.00 2.69 2.82 0.00 0.00 6.34 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 82 T 7.94 4.25 4.27 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 1.23 0.00 0.00 83 L 9.02 4.74 0.00 1.66 1.95 0.88 0.52 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 84 N 8.39 4.30 0.00 2.80 2.98 0.00 0.00 6.96 7.26 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 85 V 7.65 3.98 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 0.87 0.00 0.00 1.00 0.00 0.00 86 N 8.16 4.29 0.00 2.24 2.66 0.00 0.00 6.82 7.85 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 87 L 7.60 4.08 0.00 1.80 1.63 0.07 -0.26 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 88 R 7.75 4.05 0.00 1.95 2.02 0.00 3.48 0.00 0.00 3.37 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.73 0.00 89 D 8.16 4.96 0.00 2.63 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 90 L 7.74 4.09 0.00 1.50 1.49 0.85 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 91 A 8.40 3.75 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 92 F 7.55 5.37 0.00 3.15 3.02 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 93 E 10.69 4.60 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 2.45 2.50 0.00 94 Q 8.84 3.54 0.00 1.77 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 7.37 0.00 0.00 0.00 0.00 0.00 2.03 1.28 0.00 95 L 7.18 5.92 0.00 1.79 1.69 0.92 0.43 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 96 Q 7.94 4.52 0.00 1.85 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 5.82 0.00 0.00 0.00 0.00 0.00 2.12 2.28 0.00 97 H 9.23 5.22 0.00 3.23 3.51 0.00 5.61 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 D 7.46 4.72 0.00 2.50 2.27 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 99 K 8.54 3.86 0.00 1.89 2.16 0.00 1.94 0.00 0.00 1.83 0.00 0.00 3.02 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.36 1.32 7.81 100 G 9.39 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 0.00 0.00 0.00 101 G 8.59 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 0.00 102 W 7.98 5.10 0.00 3.18 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 0.00 103 T 9.65 4.97 4.96 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 0.63 0.00 0.00 104 Q 8.50 5.12 0.00 1.86 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.69 6.77 0.00 0.00 0.00 0.00 0.00 2.36 2.38 0.00 105 W 9.15 5.60 0.00 3.44 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 0.00 106 K 8.62 4.51 0.00 1.90 1.62 0.00 1.95 0.00 0.00 1.73 0.00 0.00 2.82 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.60 1.29 7.81 107 R 8.35 4.93 0.00 1.98 2.11 0.00 3.18 0.00 0.00 2.26 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.64 0.00 108 S 8.82 4.25 0.00 3.90 3.74 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 G 8.62 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 0.00 110 F 8.38 4.96 0.00 3.59 3.22 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 0.00 111 T 8.96 5.69 4.35 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 1.24 0.00 0.00 112 R 7.48 3.74 0.00 1.84 1.26 0.00 2.96 0.00 0.00 2.99 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.36 0.00 113 N 7.77 4.55 0.00 2.73 2.89 0.00 0.00 6.71 7.71 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 0.00 114 S 8.03 4.54 0.00 3.79 3.68 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 0.00 115 V 8.06 4.89 1.78 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 0.55 0.00 0.00 0.60 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.