NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 15 Q 4.4397 8.1876 119.6409 55.8423 30.6462 173.5510 16 N 5.2951 8.4990 120.4597 50.9161 40.1171 172.1819 17 Y 4.7365 8.6288 117.4835 55.7625 42.6640 175.9614 18 L 4.4395 8.8548 125.4637 55.7104 43.0544 175.8574 19 F 4.9092 9.0994 126.4468 56.8433 43.1226 173.3302 20 G 4.3429 6.9732 109.3992 45.6336 0.0000 171.6365 21 C 4.4745 7.6061 115.0924 56.6964 33.4175 171.8637 22 E 5.1754 8.4236 119.3337 54.3791 32.0363 174.5844 23 L 4.9205 8.7845 125.6296 53.2396 45.3267 176.2598 24 K 5.2913 8.4437 119.2726 53.9708 35.3311 175.6719 25 A 4.2542 8.6320 120.9566 55.5145 18.5359 177.9415 26 D 4.4373 7.3423 115.1107 53.9634 42.4211 174.4431 27 K 5.1081 7.8377 130.5633 56.6251 33.1463 173.9646 28 D 4.6340 8.3817 125.4552 54.4907 41.9747 175.1132 29 Y 4.6023 8.9241 124.5679 56.7472 40.4995 173.6470 30 H 4.9130 8.0897 123.5247 53.9104 31.2697 173.9045 31 F 4.6868 9.2973 126.4437 56.2534 40.8078 173.9174 32 K 4.7183 7.9099 124.0817 55.0626 35.9215 175.2845 33 V 4.2460 7.7849 119.5026 62.0247 35.2952 174.8185 34 D 4.5601 7.8592 116.8874 52.1725 39.3239 172.9432 *39 E 4.2556 7.5780 118.9505 57.5293 32.0916 175.6443 40 H 5.3782 8.8070 116.3706 55.2552 30.7515 174.7604 41 Q 4.6143 9.5096 122.8102 54.2680 33.1172 173.2887 42 L 4.6868 8.6787 127.6493 53.3498 44.3305 174.7747 43 S 5.0896 8.3471 121.9223 56.4996 64.4277 172.8679 44 L 4.1637 8.8621 128.7017 55.8978 42.6634 175.6370 45 R 4.4764 8.9987 122.4686 56.0675 31.1468 176.4031 46 T 5.0669 6.4966 110.8417 60.2386 73.4432 174.8914 47 V 4.8017 8.9990 122.9833 61.6521 33.9624 174.5780 48 S 5.2723 8.9284 123.7352 56.6843 66.6216 173.2010 49 L 4.5922 7.9185 120.3794 53.6105 43.1378 177.0431 50 G 3.8021 8.6637 109.9998 45.0423 0.0000 174.5208 51 A 4.1191 8.9709 125.7665 55.2190 18.0581 179.1793 52 G 3.5990 8.1546 103.1785 48.4039 0.0000 172.6381 53 A 4.1668 7.3825 121.6825 50.7335 19.7016 177.6031 54 K 4.3131 8.3239 121.5293 55.8478 33.5126 176.6452 55 D 4.6852 8.3516 119.5250 54.3600 40.4734 175.2922 56 E 4.6879 7.5349 116.1240 53.7156 32.6413 175.5340 57 L 4.1693 8.4222 122.2506 56.1662 42.7229 175.6366 58 H 5.1679 9.7602 124.1886 54.1106 31.7390 173.7385 59 I 4.9240 9.0805 123.2103 59.6119 40.5388 174.5878 60 V 4.5696 8.5617 128.8588 61.6541 32.7542 174.7204 61 E 5.2933 9.2660 125.7764 54.4761 33.2625 174.6537 62 A 5.1336 9.4523 122.1855 50.1543 22.7485 174.4990 63 E 5.5679 9.3367 122.7179 53.8236 32.4720 174.9534 64 A 4.4744 8.1035 126.7142 51.6349 22.7520 173.7630 65 M 4.8286 8.6193 116.1070 54.9208 33.2984 176.8417 66 N 4.9269 8.7472 121.3420 51.6200 40.0985 174.7615 67 Y 4.3404 8.6122 117.7508 60.8390 39.2212 176.4151 68 E 4.2911 8.7273 119.1568 56.0590 29.5337 178.7976 69 G 4.0806 7.8041 111.3866 46.4110 0.0000 175.4070 70 S 4.5118 7.8828 115.8896 57.7103 63.9883 172.3800 71 P 5.1446 0.0000 0.0000 62.7910 32.6203 175.0502 72 I 4.7959 9.4153 114.9738 59.4504 41.7480 173.6171 73 K 5.0421 8.5872 122.0007 54.9149 33.6412 176.1617 74 V 4.5197 8.9694 124.4538 61.3729 35.4292 174.3462 75 T 4.5623 8.4481 122.9796 62.4088 68.7033 174.6987 76 L 4.3593 8.8154 127.8176 57.6398 42.3212 177.2824 77 A 4.5644 7.5603 117.3509 51.5204 22.7963 175.1839 78 T 4.9451 8.5068 115.1936 61.9563 71.3193 173.7805 79 L 5.0118 9.2504 126.5155 52.9669 45.8475 176.1861 80 K 4.4850 8.8970 123.0773 56.1986 34.7859 176.1448 81 M 3.7881 9.0614 128.6175 58.9719 32.2260 177.2811 82 S 4.5856 8.7916 110.4252 58.3913 62.8066 174.0821 83 V 4.2055 7.9281 119.3675 63.9418 33.5325 176.0722 84 Q 4.3755 7.4712 126.4173 53.7064 29.4666 173.2178 85 P 4.3761 0.0000 0.0000 64.5359 32.7514 176.2714 86 T 4.9423 7.8433 114.1876 61.5430 71.8327 173.9436 87 V 4.4474 8.6831 124.7086 61.0948 34.7837 173.8787 88 S 5.1879 8.7967 121.9638 56.6947 64.0312 173.5121 89 L 4.5053 9.4771 126.0066 53.7121 42.4102 176.4111 90 G 3.9027 8.5998 106.9410 46.5383 0.0000 173.3010 91 G 3.9467 8.2134 100.0032 46.5172 0.0000 175.3048 92 F 4.5246 8.2923 121.5133 57.8546 40.4351 174.8009 93 E 4.9758 9.0184 126.4526 55.8577 30.7446 176.3311 94 I 4.6669 8.9587 124.0412 59.8107 41.5218 174.4171 95 T 4.8322 8.5140 123.1234 61.7047 69.3190 173.3201 96 P 4.6506 0.0000 0.0000 61.6942 32.3163 174.0519 97 P 4.9536 0.0000 0.0000 62.8714 32.4132 175.7972 98 V 4.7455 8.6689 119.5717 60.1820 35.3082 174.1240 99 V 4.8284 8.9470 122.0726 61.1163 34.8626 174.1782 100 L 5.2498 9.1699 127.0674 53.0452 44.3754 175.7751 101 R 4.9949 8.9822 119.7222 54.3809 33.9016 174.0079 102 L 4.7255 8.3442 121.3999 53.4992 42.0351 175.6830 103 K 4.2987 9.0138 129.5628 59.2509 32.7037 176.7340 104 C 4.6887 8.2156 113.2542 57.7762 33.1697 172.4933 105 G 3.7576 8.8291 106.3812 44.6606 0.0000 173.3853 106 S 4.6250 8.1767 109.3078 56.3856 65.1388 175.4394 107 G 3.9102 8.3511 110.3853 45.0259 0.0000 170.7954 108 P 4.7066 0.0000 0.0000 63.5725 32.7176 176.0715 109 V 4.5353 8.5635 121.0949 61.5795 34.4108 174.1692 110 H 5.2377 8.9522 126.0370 55.4330 30.6694 174.8537 111 I 5.0095 8.4669 121.9497 59.9849 40.8683 175.2939 112 S 5.0331 9.5923 123.1782 56.4153 66.5383 173.3276 113 G 4.2369 7.5545 105.3608 44.9841 0.0000 171.2660 114 Q 5.2044 8.4659 118.3879 54.3813 33.0722 174.9164 115 H 4.7402 9.4278 121.5982 54.5986 31.4684 172.6081 116 L 4.8939 9.2070 126.7297 54.2072 43.0439 176.3511 117 V 4.6499 8.2701 121.6164 61.8640 34.9502 175.2085 118 A 4.3198 8.3923 128.5232 51.6524 18.2076 176.7251 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 15 Q 8.19 4.44 0.00 2.09 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.80 0.00 0.00 0.00 0.00 0.00 2.36 2.42 0.00 16 N 8.50 5.30 0.00 2.74 2.74 0.00 0.00 5.91 6.66 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 17 Y 8.63 4.74 0.00 3.10 2.97 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 18 L 8.85 4.44 0.00 1.72 1.64 0.93 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 19 F 9.10 4.91 0.00 3.24 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 20 G 6.97 4.34 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 0.00 21 C 7.61 4.47 0.00 2.06 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 0.00 0.00 0.00 22 E 8.42 5.18 0.00 1.89 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 0.00 2.20 2.39 0.00 23 L 8.78 4.92 0.00 1.64 1.55 0.93 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 24 K 8.44 5.29 0.00 1.71 1.74 0.00 1.83 0.00 0.00 0.86 0.00 0.00 3.00 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.35 1.32 7.81 25 A 8.63 4.25 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 26 D 7.34 4.44 0.00 2.64 2.60 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 27 K 7.84 5.11 0.00 1.95 1.91 0.00 1.62 0.00 0.00 1.74 0.00 0.00 3.02 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.22 1.28 7.81 28 D 8.38 4.63 0.00 2.65 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 29 Y 8.92 4.60 0.00 3.18 2.95 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 30 H 8.09 4.91 0.00 2.87 3.06 0.00 5.70 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 F 9.30 4.69 0.00 3.25 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 32 K 7.91 4.72 0.00 1.58 1.59 0.00 1.47 0.00 0.00 1.55 0.00 0.00 2.77 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.14 1.23 7.81 33 V 7.78 4.25 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 0.36 0.00 0.00 0.58 0.00 0.00 34 D 7.86 4.56 0.00 2.72 2.56 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 0.00 0.00 0.00 0.00 *39 E 7.58 4.26 0.00 2.01 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 2.32 2.38 0.00 40 H 8.81 5.38 0.00 3.10 3.37 0.00 5.64 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 41 Q 9.51 4.61 0.00 2.12 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.76 0.00 0.00 0.00 0.00 0.00 2.45 2.34 0.00 42 L 8.68 4.69 0.00 1.22 1.33 -1.00 -0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 43 S 8.35 5.09 0.00 3.96 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 44 L 8.86 4.16 0.00 1.61 1.56 0.76 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 45 R 9.00 4.48 0.00 1.70 1.74 0.00 3.25 0.00 0.00 3.24 7.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.72 0.00 46 T 6.50 5.07 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 1.22 0.00 0.00 47 V 9.00 4.80 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 0.97 0.00 0.00 0.95 0.00 0.00 48 S 8.93 5.27 0.00 3.78 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 L 7.92 4.59 0.00 1.50 1.49 0.86 0.53 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 50 G 8.66 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 0.00 0.00 0.00 51 A 8.97 4.12 1.30 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 0.00 0.00 52 G 8.15 3.60 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 53 A 7.38 4.17 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.32 4.31 0.00 1.92 1.77 0.00 1.75 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.45 1.43 7.81 55 D 8.35 4.69 0.00 2.62 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 56 E 7.53 4.69 0.00 2.04 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 2.17 2.16 0.00 57 L 8.42 4.17 0.00 1.65 1.62 0.93 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 58 H 9.76 5.17 0.00 3.16 3.17 0.00 5.61 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 I 9.08 4.92 1.88 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 1.13 1.10 0.93 0.00 0.00 60 V 8.56 4.57 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 1.03 0.00 0.00 0.95 0.00 0.00 61 E 9.27 5.29 0.00 2.19 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 2.18 2.23 0.00 62 A 9.45 5.13 1.09 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 63 E 9.34 5.57 0.00 2.01 1.77 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 2.22 2.07 0.00 64 A 8.10 4.47 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 65 M 8.62 4.83 0.00 1.95 2.02 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.62 0.00 66 N 8.75 4.93 0.00 3.01 3.03 0.00 0.00 6.38 8.35 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 67 Y 8.61 4.34 0.00 2.86 3.09 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 68 E 8.73 4.29 0.00 2.04 1.90 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 2.51 2.42 0.00 69 G 7.80 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 0.00 0.00 0.00 70 S 7.88 4.51 0.00 3.81 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 71 P 0.00 5.14 0.00 2.08 2.05 0.00 3.71 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.97 0.00 72 I 9.42 4.80 1.89 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.94 0.94 0.00 0.00 73 K 8.59 5.04 0.00 1.66 1.78 0.00 1.70 0.00 0.00 1.98 0.00 0.00 2.73 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.36 1.42 7.81 74 V 8.97 4.52 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 1.09 0.00 0.00 0.99 0.00 0.00 75 T 8.45 4.56 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 1.26 0.00 0.00 76 L 8.82 4.36 0.00 1.70 1.77 0.85 0.42 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 77 A 7.56 4.56 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 78 T 8.51 4.95 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 1.23 0.00 0.00 79 L 9.25 5.01 0.00 1.52 1.63 0.91 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 80 K 8.90 4.49 0.00 1.82 1.63 0.00 1.68 0.00 0.00 1.58 0.00 0.00 2.81 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.35 1.40 7.81 81 M 9.06 3.79 0.00 2.20 2.10 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.64 0.00 82 S 8.79 4.59 0.00 3.97 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 83 V 7.93 4.21 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 0.79 0.00 0.00 0.93 0.00 0.00 84 Q 7.47 4.38 0.00 2.06 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.25 6.69 0.00 0.00 0.00 0.00 0.00 2.32 2.49 0.00 85 P 0.00 4.38 0.00 2.10 2.06 0.00 3.58 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.36 0.00 86 T 7.84 4.94 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 87 V 8.68 4.45 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 0.87 0.00 0.00 0.94 0.00 0.00 88 S 8.80 5.19 0.00 3.90 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 89 L 9.48 4.51 0.00 1.72 1.80 1.03 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 90 G 8.60 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 0.00 0.00 0.00 91 G 8.21 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 92 F 8.29 4.52 0.00 3.11 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 93 E 9.02 4.98 0.00 1.98 1.91 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 2.31 2.38 0.00 94 I 8.96 4.67 1.67 0.00 0.00 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.54 0.81 0.00 0.00 95 T 8.51 4.83 4.28 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 1.25 0.00 0.00 96 P 0.00 4.65 0.00 2.19 2.32 0.00 3.84 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.14 0.00 97 P 0.00 4.95 0.00 2.10 2.06 0.00 3.72 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.95 0.00 98 V 8.67 4.75 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 0.92 0.00 0.00 0.87 0.00 0.00 99 V 8.95 4.83 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 0.97 0.00 0.00 0.80 0.00 0.00 100 L 9.17 5.25 0.00 1.78 1.61 1.02 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 101 R 8.98 4.99 0.00 1.85 2.00 0.00 3.12 0.00 0.00 3.11 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.56 0.00 102 L 8.34 4.73 0.00 1.76 1.66 1.01 0.70 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 0.00 103 K 9.01 4.30 0.00 1.81 1.93 0.00 1.98 0.00 0.00 1.76 0.00 0.00 3.01 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.46 1.41 7.81 104 C 8.22 4.69 0.00 2.97 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 0.00 105 G 8.83 3.76 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 0.00 0.00 0.00 106 S 8.18 4.62 0.00 3.97 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 0.00 107 G 8.35 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 0.00 108 P 0.00 4.71 0.00 2.09 2.32 0.00 3.74 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 2.02 1.98 0.00 109 V 8.56 4.54 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 0.99 0.00 0.00 0.88 0.00 0.00 110 H 8.95 5.24 0.00 3.07 3.10 0.00 5.61 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 0.00 111 I 8.47 5.01 1.83 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 1.29 0.92 1.01 0.00 0.00 112 S 9.59 5.03 0.00 3.90 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 0.00 113 G 7.55 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 0.00 0.00 0.00 0.00 114 Q 8.47 5.20 0.00 1.99 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.95 6.69 0.00 0.00 0.00 0.00 0.00 2.29 2.29 0.00 115 H 9.43 4.74 0.00 3.40 3.50 0.00 5.58 0.00 0.00 0.00 0.00 6.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 L 9.21 4.89 0.00 1.81 1.62 0.95 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 117 V 8.27 4.65 2.31 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 0.80 0.00 0.00 0.94 0.00 0.00 118 A 8.39 4.32 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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.