NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 26 S 4.2148 8.3231 115.4147 57.3360 64.8978 171.6814 27 G 3.5868 9.1717 113.4554 44.8230 0.0000 170.6816 28 K 4.5659 8.0142 124.2041 54.1503 37.2143 175.1828 29 V 3.9839 8.3852 122.3862 62.4286 31.2725 176.0421 30 V 4.2962 8.3520 127.5550 62.8475 32.8693 175.5646 31 K 5.0171 8.1635 118.1617 57.2588 35.0344 174.5129 32 F 4.9777 7.7401 114.3340 56.2888 41.0312 172.6952 33 S 4.9085 8.7653 115.4120 56.8269 66.0889 172.7164 34 Y 4.4572 8.6837 125.6584 55.7803 41.1801 173.6093 35 M 4.8657 7.8797 126.1737 53.4681 34.5186 174.5162 36 W 5.0108 9.3857 135.0000 56.0476 33.9060 173.6134 37 T 4.9342 8.7998 123.8412 61.9066 70.2255 173.9726 38 I 4.2775 8.5921 127.2232 59.5489 39.3020 175.1272 39 N 4.7720 8.8972 124.5549 52.3398 40.0316 174.6447 40 N 4.9116 8.4996 115.3221 53.2211 36.6154 175.7586 41 F 4.1635 8.9564 123.4575 61.4457 39.9732 177.0116 42 S 4.0378 8.4508 112.7926 60.2521 62.7006 174.6229 43 F 4.3670 7.9637 118.6849 57.2039 39.2690 175.8117 44 C 4.0498 7.7074 120.0123 60.2106 28.1311 174.4198 45 R 4.0701 8.5623 120.8651 57.9758 29.7456 176.9236 46 E 4.2045 8.0439 117.6867 56.3576 29.8934 176.5452 47 E 4.4789 8.8316 122.6596 54.1868 31.6935 174.7412 48 M 4.6071 7.8344 117.9723 57.0101 32.2594 176.5361 49 G 4.5923 9.4835 114.4583 45.1997 0.0000 173.7932 50 E 4.3988 8.3002 119.9419 55.8029 30.4339 175.7038 51 V 4.8879 8.0759 119.7523 60.1070 34.8455 174.5885 52 I 4.7841 9.3210 123.8710 59.5469 39.4303 174.8344 53 K 5.2534 8.9609 125.9996 55.2400 35.2675 175.8306 54 S 4.4717 7.8753 117.3383 56.4116 65.0139 173.7952 55 S 4.3067 8.2843 114.8157 58.1129 63.4239 174.1707 56 T 4.2959 8.2518 113.5826 61.9664 69.4440 173.4143 57 F 5.1354 9.2594 118.7509 55.1423 41.6352 173.6278 58 S 5.3822 8.5141 114.1130 56.0284 66.3573 172.4617 59 S 4.2996 8.3958 111.6893 58.4319 65.6463 177.6138 60 G 3.7953 8.9964 111.3809 44.3748 0.0000 176.6071 *64 K 3.9179 8.7859 123.4130 55.9681 32.8846 173.8714 65 L 4.6657 8.2016 126.0885 53.2346 44.5497 175.5088 66 K 4.5497 7.8595 120.9138 54.6630 35.2047 175.2031 67 W 5.4984 9.1494 127.0070 55.4462 34.1928 173.3623 68 C 4.3593 8.3324 112.8744 57.6285 32.6650 172.9921 69 L 5.2832 8.5779 120.4844 53.5400 44.0347 175.7726 70 R 5.4673 9.0156 120.3514 54.5211 34.1447 174.9377 71 V 5.0414 9.2669 121.8848 60.2747 35.4024 174.2646 72 N 5.3717 9.6753 122.0361 50.0522 39.0894 173.5810 73 P 4.4938 0.0000 0.0000 64.8521 31.9330 177.2716 74 K 4.5747 7.8138 118.4649 55.5803 33.0277 174.7878 75 G 4.9176 7.9683 107.6684 45.7558 0.0000 175.2452 76 L 3.7923 8.5505 122.9519 57.6316 42.7282 175.9908 77 D 4.6458 8.2503 116.0983 52.3108 42.5356 175.7769 78 E 3.9024 8.8766 119.4548 59.5939 29.5147 178.6807 79 E 4.0153 7.9857 116.7127 58.7024 29.9506 177.4798 80 S 4.9947 8.3538 112.8950 57.8187 63.5193 176.3037 81 K 4.1183 7.9251 123.0973 60.3944 32.5341 177.1727 82 D 4.7736 8.3209 118.0873 54.1178 40.9662 174.6723 83 Y 5.3500 7.6731 116.6478 56.0756 42.7785 173.7740 84 L 4.8715 9.4610 123.3524 54.3426 44.1643 175.2827 85 S 5.3437 9.0738 121.9075 56.7686 65.8803 172.8891 86 L 4.9660 8.1488 125.3212 53.4851 45.0171 174.7332 87 Y 5.2067 9.0923 122.7570 56.1699 43.0821 173.7967 88 L 4.8951 9.3288 123.9649 53.4711 44.5608 174.6543 89 L 5.1526 9.0516 129.3502 53.3553 44.4542 174.8724 90 L 3.8312 8.7587 129.0002 54.3591 42.2479 177.2614 91 V 3.6525 8.4011 128.6650 65.6556 32.2766 176.3418 92 S 4.6262 7.1434 111.3425 57.9204 65.4811 174.5872 93 C 4.9614 8.2592 115.2781 56.1159 32.8206 172.6463 94 P 4.2659 0.0000 0.0000 65.4775 29.9366 177.2284 95 K 4.4606 7.5389 116.9335 55.1557 34.2102 177.1071 96 S 4.1618 8.6041 113.2203 61.2571 63.1655 172.9047 97 E 4.9427 7.0030 117.1511 55.9922 32.7587 175.1080 98 V 4.7331 9.1146 119.1685 61.2406 35.4321 173.7285 99 R 5.3496 9.0030 127.7458 54.8925 31.9046 174.6459 100 A 5.3013 9.3723 127.3273 50.7083 23.1878 175.2115 101 K 4.9585 9.2348 121.2072 55.7125 34.4959 175.8572 102 F 5.2909 8.2751 116.2249 55.5395 41.8153 173.0900 103 K 5.0568 8.8959 121.1770 54.9662 35.5443 174.7702 104 F 5.7884 9.6894 126.4767 56.3090 41.8641 174.8425 105 S 5.2987 9.4859 116.0147 57.9109 67.0800 172.7584 106 I 5.0374 8.9781 120.8269 59.5616 40.2812 175.1224 107 L 4.9726 8.6485 126.9584 53.2903 42.5534 176.5088 108 N 4.7215 9.3691 122.7585 51.9054 38.7830 176.0120 109 A 3.9345 9.1160 123.0545 55.3842 18.2723 178.8228 110 K 4.2937 8.0409 114.6024 57.4905 32.5223 176.1975 111 G 4.0735 7.6587 102.0933 46.2269 0.0000 173.5085 112 E 4.7299 8.5139 117.3185 53.7841 33.0147 175.3074 113 E 4.5265 8.5370 123.5925 56.5546 30.6571 175.3731 114 T 4.5511 9.1787 120.2920 60.3801 71.9940 172.6924 115 K 3.8219 8.5929 119.6986 57.0976 29.7203 175.5947 116 A 4.8256 7.9403 118.6544 52.3503 19.7085 178.0824 117 M 4.8103 9.7214 121.3441 53.4189 35.7794 174.4028 118 E 5.2011 8.8147 121.1190 54.4429 33.0536 176.3479 119 S 4.3704 8.3806 117.7897 56.9554 62.2984 173.7675 120 Q 4.0307 8.7605 126.3681 58.9466 28.5534 178.2884 121 R 4.5343 7.6414 111.2272 54.5884 31.9253 175.2569 122 A 4.6252 8.2707 121.4825 51.6188 19.5416 176.9006 123 Y 3.9933 9.1186 120.7585 56.8590 40.2708 175.3177 124 R 4.7940 8.5227 122.5779 56.0677 30.6711 175.2594 125 F 5.0619 10.2247 127.2464 56.1270 41.2674 175.7103 126 V 4.7275 8.2073 115.4472 58.9796 35.6501 174.6219 127 Q 3.8531 8.7124 122.3178 59.3795 28.3972 177.6053 128 G 3.9362 9.2466 112.0716 44.5188 0.0000 172.1331 129 K 4.6541 8.2666 120.8812 54.2413 35.5577 174.3750 130 D 5.8500 8.1114 123.1480 50.5475 43.0029 174.6193 131 W 5.2574 8.5347 116.9613 55.2323 33.6634 175.8446 132 G 3.4999 7.8961 108.0487 45.9857 0.0000 171.5640 133 F 4.9979 7.3026 119.5036 55.3931 40.7253 176.3971 134 K 4.3255 8.9364 127.1833 58.0025 32.8497 177.1044 135 K 4.5093 7.5753 116.3885 54.8764 31.9949 175.4680 136 F 4.4168 8.6208 123.7446 60.8840 40.3374 175.0420 137 I 4.5156 7.5229 118.1404 58.3789 40.8520 173.3967 138 R 4.0248 8.4727 125.5366 55.6585 31.2167 177.9209 139 R 3.9879 8.7880 124.2985 59.3977 30.0021 178.6769 140 D 4.3409 8.1003 117.0491 56.7558 38.9973 178.3927 141 F 4.2314 8.0730 121.3378 60.6788 39.3894 176.5084 142 L 3.8753 7.9177 118.6373 58.4583 41.9906 178.8510 143 L 4.3854 8.4897 117.6821 56.6272 42.0834 176.9167 144 D 4.4336 7.5379 117.1660 53.4755 40.0014 176.1553 145 E 4.1776 8.7479 127.1496 58.9413 29.2337 178.7839 146 A 4.1008 7.8637 119.7898 54.4165 18.4645 178.3812 147 N 4.4860 8.1867 113.5077 53.0001 38.6548 175.6245 148 G 3.8849 7.8083 108.9639 46.3782 0.0000 175.0800 149 L 4.5908 7.7828 116.7178 54.2638 43.4553 176.3603 150 L 5.0416 7.5354 117.5438 51.3505 42.3749 174.9629 151 P 4.4696 0.0000 0.0000 64.3802 31.9178 176.6617 152 D 4.4781 9.5370 121.7235 55.1624 38.5868 173.0545 153 D 4.4954 8.1856 114.4872 55.1159 40.2895 172.1579 154 K 4.9526 8.0256 116.8106 54.0452 34.6291 174.8997 155 L 4.4189 8.8227 127.6469 53.6641 44.0214 174.9722 156 T 4.9239 8.3657 122.6349 61.9342 71.2232 173.0054 157 L 5.2307 9.1048 127.1891 53.0756 44.6735 175.3721 158 F 5.3308 9.6161 124.3202 56.6023 42.6228 173.3955 159 C 5.1273 8.8669 125.6993 57.7943 34.6515 172.1495 160 E 4.7423 9.0140 126.9266 54.6305 31.5519 175.1333 161 V 4.3177 7.6156 125.2021 60.8882 34.0159 174.3195 162 S 4.8697 8.8154 124.8294 56.7625 64.8897 173.5663 163 V 4.3679 8.0389 126.5049 62.4058 31.0796 175.9787 164 V 3.9875 9.1668 129.6543 65.4814 32.5930 176.3369 165 Q 4.5528 7.8534 120.0955 55.2397 32.4991 174.1962 166 D 4.5700 8.8125 125.3679 54.6201 41.1001 176.2280 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 26 S 8.32 4.21 0.00 4.01 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 27 G 9.17 3.59 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 0.00 0.00 0.00 28 K 8.01 4.57 0.00 1.73 1.70 0.00 1.78 0.00 0.00 1.76 0.00 0.00 2.77 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.36 1.44 7.81 29 V 8.39 3.98 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 0.99 0.00 0.00 1.00 0.00 0.00 30 V 8.35 4.30 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.96 0.00 0.00 31 K 8.16 5.02 0.00 1.67 1.74 0.00 1.23 0.00 0.00 2.41 0.00 0.00 2.99 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.33 1.28 7.81 32 F 7.74 4.98 0.00 3.04 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 33 S 8.77 4.91 0.00 3.57 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 34 Y 8.68 4.46 0.00 2.56 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 35 M 7.88 4.87 0.00 1.96 2.07 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 2.63 2.51 0.00 36 W 9.39 5.01 0.00 3.12 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 37 T 8.80 4.93 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 1.24 0.00 0.00 38 I 8.59 4.28 1.68 0.00 0.00 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.47 -0.34 1.00 0.00 0.00 39 N 8.90 4.77 0.00 2.61 2.72 0.00 0.00 7.40 8.00 0.00 0.00 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 N 8.50 4.91 0.00 2.86 2.57 0.00 0.00 7.24 8.13 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 41 F 8.96 4.16 0.00 3.02 3.12 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.45 4.04 0.00 3.97 4.04 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 43 F 7.96 4.37 0.00 3.14 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 44 C 7.71 4.05 0.00 2.69 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 45 R 8.56 4.07 0.00 1.92 2.07 0.00 3.08 0.00 0.00 3.25 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.67 0.00 46 E 8.04 4.20 0.00 1.96 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 2.38 2.42 0.00 47 E 8.83 4.48 0.00 2.19 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 2.24 2.41 0.00 48 M 7.83 4.61 0.00 1.99 2.04 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.58 0.00 49 G 9.48 4.59 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 0.00 0.00 0.00 50 E 8.30 4.40 0.00 2.35 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 2.34 2.26 0.00 51 V 8.08 4.89 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 0.79 0.00 0.00 1.12 0.00 0.00 52 I 9.32 4.78 2.12 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 1.39 0.87 1.21 0.00 0.00 53 K 8.96 5.25 0.00 1.73 1.83 0.00 1.54 0.00 0.00 1.76 0.00 0.00 3.00 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.35 1.44 7.81 54 S 7.88 4.47 0.00 2.84 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 55 S 8.28 4.31 0.00 4.05 3.96 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 0.00 56 T 8.25 4.30 4.14 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 1.11 0.00 0.00 57 F 9.26 5.14 0.00 2.94 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 58 S 8.51 5.38 0.00 3.97 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 59 S 8.40 4.30 0.00 3.65 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 60 G 9.00 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 *64 K 8.79 3.92 0.00 1.72 1.74 0.00 1.69 0.00 0.00 1.63 0.00 0.00 2.76 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.27 1.37 7.81 65 L 8.20 4.67 0.00 1.75 1.20 0.66 0.31 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 66 K 7.86 4.55 0.00 1.59 1.31 0.00 1.47 0.00 0.00 1.53 0.00 0.00 2.68 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.13 1.22 7.81 67 W 9.15 5.50 0.00 1.78 2.50 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 0.00 0.00 0.00 68 C 8.33 4.36 0.00 2.86 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 69 L 8.58 5.28 0.00 1.39 1.81 1.37 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 70 R 9.02 5.47 0.00 1.91 1.90 0.00 3.08 0.00 0.00 3.35 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.59 0.00 71 V 9.27 5.04 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 1.07 0.00 0.00 1.07 0.00 0.00 72 N 9.68 5.37 0.00 2.83 3.03 0.00 0.00 6.63 8.02 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 73 P 0.00 4.49 0.00 2.04 2.25 0.00 3.97 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.01 0.00 74 K 7.81 4.57 0.00 1.89 1.81 0.00 1.78 0.00 0.00 1.80 0.00 0.00 2.83 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.38 1.35 7.81 75 G 7.97 4.92 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 76 L 8.55 3.79 0.00 2.09 1.83 0.90 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 77 D 8.25 4.65 0.00 2.96 2.76 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 78 E 8.88 3.90 0.00 2.09 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 0.00 2.42 2.44 0.00 79 E 7.99 4.02 0.00 2.06 2.16 0.00 0.00 0.00 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 2.29 0.00 80 S 8.35 4.99 0.00 4.30 4.10 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 81 K 7.93 4.12 0.00 1.89 2.06 0.00 1.62 0.00 0.00 1.87 0.00 0.00 3.07 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.71 1.48 7.81 82 D 8.32 4.77 0.00 2.56 2.50 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 0.00 0.00 0.00 83 Y 7.67 5.35 0.00 3.01 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 84 L 9.46 4.87 0.00 1.93 1.76 1.25 1.10 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 85 S 9.07 5.34 0.00 4.21 3.99 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 0.00 0.00 0.00 86 L 8.15 4.97 0.00 1.27 0.72 0.69 -0.34 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 87 Y 9.09 5.21 0.00 2.91 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 88 L 9.33 4.90 0.00 1.56 1.22 0.68 -0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 89 L 9.05 5.15 0.00 1.81 1.68 0.91 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 90 L 8.76 3.83 0.00 1.59 1.50 -0.41 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 91 V 8.40 3.65 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 0.67 0.00 0.00 0.77 0.00 0.00 92 S 7.14 4.63 0.00 3.74 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 93 C 8.26 4.96 0.00 2.91 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 P 0.00 4.27 0.00 2.03 2.11 0.00 3.61 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.04 0.00 95 K 7.54 4.46 0.00 1.81 1.76 0.00 1.75 0.00 0.00 1.87 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.41 7.81 96 S 8.60 4.16 0.00 3.98 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 97 E 7.00 4.94 0.00 2.22 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 2.17 2.21 0.00 98 V 9.11 4.73 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 1.20 0.00 0.00 0.86 0.00 0.00 99 R 9.00 5.35 0.00 2.09 1.88 0.00 3.38 0.00 0.00 3.30 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.68 0.00 100 A 9.37 5.30 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 0.00 101 K 9.23 4.96 0.00 1.66 1.66 0.00 1.64 0.00 0.00 1.66 0.00 0.00 2.86 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.37 1.39 7.81 102 F 8.28 5.29 0.00 2.60 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 0.00 103 K 8.90 5.06 0.00 1.78 1.62 0.00 1.66 0.00 0.00 1.68 0.00 0.00 2.88 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.44 1.62 7.81 104 F 9.69 5.79 0.00 3.25 2.53 0.00 0.00 0.00 0.00 0.00 0.00 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 S 9.49 5.30 0.00 4.13 4.14 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 0.00 106 I 8.98 5.04 1.96 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 1.45 1.11 0.99 0.00 0.00 107 L 8.65 4.97 0.00 1.49 1.55 0.84 0.87 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 0.00 108 N 9.37 4.72 0.00 2.94 2.96 0.00 0.00 6.43 8.06 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 0.00 109 A 9.12 3.93 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 0.00 110 K 8.04 4.29 0.00 1.71 1.87 0.00 1.92 0.00 0.00 1.79 0.00 0.00 3.01 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.37 1.41 7.81 111 G 7.66 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 0.00 112 E 8.51 4.73 0.00 1.83 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 0.00 2.16 2.29 0.00 113 E 8.54 4.53 0.00 1.80 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 2.30 2.17 0.00 114 T 9.18 4.55 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 1.31 0.00 0.00 115 K 8.59 3.82 0.00 1.85 1.57 0.00 1.76 0.00 0.00 1.76 0.00 0.00 2.64 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.39 1.38 7.81 116 A 7.94 4.83 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 0.00 117 M 9.72 4.81 0.00 0.68 2.10 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.10 0.00 118 E 8.81 5.20 0.00 1.85 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 2.15 2.24 0.00 119 S 8.38 4.37 0.00 3.55 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 0.00 120 Q 8.76 4.03 0.00 2.05 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.91 0.00 0.00 0.00 0.00 0.00 2.36 2.39 0.00 121 R 7.64 4.53 0.00 1.68 1.84 0.00 2.78 0.00 0.00 3.08 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.10 0.00 122 A 8.27 4.63 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 0.00 123 Y 9.12 3.99 0.00 2.74 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 0.00 124 R 8.52 4.79 0.00 1.90 2.04 0.00 3.28 0.00 0.00 3.32 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.96 0.00 125 F 10.22 5.06 0.00 3.29 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 0.00 126 V 8.21 4.73 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 0.89 0.00 0.00 127 Q 8.71 3.85 0.00 1.96 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.62 0.00 0.00 0.00 0.00 0.00 2.19 2.30 0.00 128 G 9.25 3.94 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 0.00 0.00 0.00 129 K 8.27 4.65 0.00 1.63 1.60 0.00 1.29 0.00 0.00 1.32 0.00 0.00 2.13 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.58 0.87 7.81 130 D 8.11 5.85 0.00 2.82 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 0.00 131 W 8.53 5.26 0.00 2.92 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 G 7.90 3.50 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 0.00 0.00 0.00 0.00 0.00 0.00 133 F 7.30 5.00 0.00 3.23 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 K 8.94 4.33 0.00 1.91 1.92 0.00 1.93 0.00 0.00 0.61 0.00 0.00 3.04 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.53 1.65 7.81 135 K 7.58 4.51 0.00 1.34 0.74 0.00 1.61 0.00 0.00 1.36 0.00 0.00 2.23 0.00 0.00 2.38 0.00 0.00 0.00 0.00 0.60 1.14 7.81 136 F 8.62 4.42 0.00 3.10 3.32 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 0.00 137 I 7.52 4.52 1.53 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.04 1.11 0.00 0.00 138 R 8.47 4.02 0.00 1.80 1.96 0.00 3.05 0.00 0.00 3.52 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 1.09 0.00 139 R 8.79 3.99 0.00 1.82 2.01 0.00 3.40 0.00 0.00 3.26 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.72 0.00 140 D 8.10 4.34 0.00 2.82 2.80 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 0.00 141 F 8.07 4.23 0.00 3.11 3.24 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 0.00 142 L 7.92 3.88 0.00 1.82 1.93 0.86 1.01 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 0.00 143 L 8.49 4.39 0.00 1.66 1.72 0.91 0.93 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 0.00 144 D 7.54 4.43 0.00 2.63 2.39 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 0.00 145 E 8.75 4.18 0.00 2.02 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 2.48 2.40 0.00 146 A 7.86 4.10 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 0.00 147 N 8.19 4.49 0.00 2.16 2.13 0.00 0.00 6.97 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 0.00 148 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 0.00 149 L 7.78 4.59 0.00 1.52 1.64 0.94 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 150 L 7.54 5.04 0.00 1.62 1.57 1.03 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 151 P 0.00 4.47 0.00 2.19 2.18 0.00 4.02 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 2.04 1.97 0.00 152 D 9.54 4.48 0.00 2.81 2.76 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 0.00 153 D 8.19 4.50 0.00 3.00 2.73 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 0.00 154 K 8.03 4.95 0.00 1.77 1.65 0.00 1.68 0.00 0.00 1.56 0.00 0.00 2.81 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.59 1.55 7.81 155 L 8.82 4.42 0.00 1.05 1.00 0.66 -0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 156 T 8.37 4.92 4.22 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 1.27 0.00 0.00 157 L 9.10 5.23 0.00 1.71 1.68 0.78 0.74 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 0.00 158 F 9.62 5.33 0.00 3.07 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 159 C 8.87 5.13 0.00 3.27 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 0.00 160 E 9.01 4.74 0.00 1.88 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 2.19 2.25 0.00 161 V 7.62 4.32 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 0.25 0.00 0.00 0.15 0.00 0.00 162 S 8.82 4.87 0.00 3.72 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 0.00 163 V 8.04 4.37 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 0.93 0.00 0.00 1.21 0.00 0.00 164 V 9.17 3.99 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 0.79 0.00 0.00 0.98 0.00 0.00 165 Q 7.85 4.55 0.00 2.23 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.75 0.00 0.00 0.00 0.00 0.00 2.37 2.47 0.00 166 D 8.81 4.57 0.00 2.71 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 * Residues marked with a * may have inaccurate shift predictions.