NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 T 4.2401 8.1744 110.9425 61.2241 70.2958 173.0344 8 D 4.3040 8.4977 125.2569 51.4324 41.3037 174.4734 9 P 4.4194 0.0000 0.0000 65.3797 32.4551 177.0488 10 R 4.1662 8.5892 116.8762 57.0931 30.4812 176.7357 11 A 4.2403 7.4983 120.4271 51.0201 19.0125 177.1624 12 K 3.9466 8.5313 120.8693 56.3260 32.6264 176.5954 13 W 4.2512 8.8992 135.0000 57.3072 31.2224 175.1436 14 V 4.1031 7.6264 125.1674 60.0470 32.3362 173.2919 15 P 4.0020 0.0000 0.0000 62.2547 32.1902 175.3693 16 Q 4.6538 8.5540 116.8322 54.7371 31.9306 174.1253 17 D 5.4956 8.5257 115.7526 54.1472 41.4854 175.3671 18 N 4.9960 9.4037 113.1314 52.0929 38.9060 174.1624 19 D 4.3369 8.0409 119.7926 53.4881 42.5650 175.2738 20 I 2.9886 7.9581 120.7448 62.3872 37.9342 176.6148 21 Q 4.2564 8.3732 119.1797 56.0015 29.3100 175.2458 22 A 4.7628 7.4649 121.7225 50.5641 20.5634 177.8359 23 C 4.6968 8.9158 118.4359 59.1167 41.2736 174.2978 24 D 5.0113 8.1236 118.8126 52.9344 39.5782 175.2918 25 Y 4.7823 8.1496 122.3055 57.4405 39.2743 176.7000 26 W 4.5938 8.5062 125.0388 59.9114 28.0075 177.6519 27 R 3.3750 5.8400 115.3664 57.7997 29.9261 176.3288 28 H 5.1811 8.2692 115.8709 55.9302 28.9247 174.4813 29 C 3.0633 8.3118 116.9997 57.1290 42.3747 174.1982 30 S 4.8413 7.7276 114.6624 56.8317 62.3258 173.7193 31 I 3.3876 7.3639 117.6803 59.9626 39.5034 174.0847 32 D 4.7663 8.7567 126.2747 53.3922 44.3948 172.2462 33 G 4.2302 7.9156 115.8714 44.4184 0.0000 175.7612 34 N 5.4088 9.6215 122.6029 50.8825 42.3086 173.3860 35 I 4.2772 8.2219 122.8298 60.9128 37.5853 176.5611 36 C 4.1610 8.6476 124.2006 60.0067 34.6185 175.8727 37 D 4.1744 8.0907 118.2649 56.7785 40.8975 177.6399 38 C 4.7633 8.1356 114.8971 57.3853 40.3760 173.7737 39 S 4.6190 8.3248 113.9834 58.2504 63.4141 175.0031 40 G 4.0427 8.7211 108.6829 45.9836 0.0000 174.3865 41 G 4.1969 7.5203 110.6778 44.8261 0.0000 171.3380 42 S 5.0756 8.1845 115.3452 56.4658 66.2530 173.2958 43 L 4.0404 8.6914 120.8020 58.0667 41.6663 178.4914 44 T 4.7145 7.8072 104.0766 60.9596 69.7439 172.9145 45 N 5.0725 7.8959 119.0813 51.7140 41.8391 173.2919 46 C 4.7716 8.3840 117.8784 55.6414 37.4938 172.2138 47 P 4.7388 0.0000 0.0000 60.9320 31.7002 174.4600 48 P 4.1833 0.0000 0.0000 64.1513 31.6745 177.0585 49 G 4.0270 8.8726 110.4222 45.3878 0.0000 173.6070 50 T 4.3381 6.7133 109.2575 60.6697 70.8420 174.2332 51 K 4.5820 8.7927 121.5183 54.4240 34.8531 175.4525 52 L 4.5033 8.4223 126.8678 54.3889 43.1054 175.9421 53 A 4.6092 8.6642 128.8661 52.3435 19.2376 176.8146 54 T 4.3958 8.6774 109.0098 62.8875 71.0427 175.3733 55 A 4.7681 8.0425 123.4962 51.3521 20.7730 177.6581 56 S 3.9501 7.1923 116.6324 58.5921 66.1557 177.9360 *58 V 4.5033 8.6851 113.6299 61.6757 32.7384 173.4133 59 A 4.7592 8.1972 120.2148 51.3073 22.5288 175.4298 60 S 5.0678 8.7746 115.8418 57.5815 63.3134 173.8706 61 C 5.2869 9.4443 125.8641 55.3297 41.3372 172.6746 62 Y 4.6285 8.9815 124.8074 57.3759 40.1001 173.3544 63 N 3.5848 8.3507 126.8021 50.8070 39.3456 173.9007 64 P 4.0505 0.0000 0.0000 65.3669 31.9377 178.1453 65 T 3.8788 7.8708 116.3422 66.1517 68.2927 175.1021 66 D 4.6226 7.5786 116.3736 52.1695 39.8821 176.3141 67 G 3.8042 7.6225 106.7131 46.3739 0.0000 173.5502 68 Q 4.5710 8.1035 118.5100 54.0866 31.8531 174.5563 69 S 5.2986 8.1755 116.7516 57.2197 65.4275 172.8734 70 Y 5.1582 9.1975 121.9695 55.9829 41.6717 174.5166 71 L 4.8517 9.2453 125.2659 54.6795 43.7477 175.2906 72 I 4.6146 8.9014 127.7412 59.5750 39.4735 174.6872 73 A 4.2560 8.1487 129.3929 50.4832 19.4375 176.8353 74 Y 4.7150 8.0327 120.8135 57.8651 36.1056 175.3920 75 R 4.4197 8.0251 121.5064 55.7949 32.4011 175.3861 76 D 5.3512 8.6012 121.7198 53.3896 44.0178 174.6138 77 C 5.2229 8.8268 118.8055 55.7816 38.8157 172.6183 78 C 5.8462 8.9209 120.7760 54.4068 44.2603 174.8390 79 G 4.0739 9.2142 105.3659 46.0850 0.0000 172.9086 80 Y 4.7325 7.4313 114.5113 55.6386 41.9831 174.6067 81 N 4.6022 8.4901 120.4440 52.8324 39.8229 175.1492 82 V 3.9498 8.6147 121.6076 61.2196 31.7356 176.4851 83 S 4.1270 8.2948 118.4916 59.9390 62.8058 175.8823 84 G 3.9753 7.7717 106.7014 45.0739 0.0000 173.0427 85 R 4.5419 7.5833 118.0170 55.5345 33.3159 175.2407 86 C 4.3176 8.6787 116.9593 57.5684 37.6058 171.1295 87 P 5.1187 0.0000 0.0000 63.2092 32.6287 178.2635 88 C 4.9968 9.2110 118.5637 55.8766 45.4407 173.3621 89 L 4.8772 8.3665 123.7019 54.2823 43.7345 174.4962 90 N 5.0882 9.0777 124.1196 50.9196 42.9794 174.6773 91 T 4.8555 7.5279 109.3803 60.9649 68.9433 174.0591 92 E 3.8635 8.2799 122.6883 58.6085 29.5030 177.8248 93 G 3.7467 8.8057 111.8068 45.4635 0.0000 172.1600 94 E 4.3085 7.8320 121.4186 56.0662 30.2234 176.2897 95 L 4.7521 8.3898 125.9690 52.0800 45.2520 174.1328 96 P 4.5697 0.0000 0.0000 62.3269 32.0691 178.0991 97 V 3.6249 8.5103 120.5137 64.8338 31.1450 176.6859 98 Y 4.5047 7.7643 116.1345 57.6707 38.8714 175.6226 99 R 4.7180 7.8090 119.2471 53.8865 30.8782 174.1442 100 P 4.4776 0.0000 0.0000 65.8379 31.7512 179.0081 101 E 3.6969 8.1934 115.6501 58.3686 29.4880 177.5021 102 F 5.1120 8.3312 116.1399 56.8739 39.9209 173.7866 103 A 5.1711 8.4663 124.2689 50.4053 19.6532 177.6010 104 N 5.0918 9.2240 119.8063 52.8200 37.5590 175.4719 105 D 4.7486 7.8484 118.2240 55.0813 41.6553 177.0690 106 I 3.4641 7.2265 120.0681 60.7613 37.4659 175.9600 107 I 3.7926 7.6248 125.6473 60.5778 36.4037 176.8800 108 W 4.7466 8.5209 130.4798 55.8178 27.5660 176.7936 109 C 4.8459 7.2646 114.7472 56.2325 37.2767 174.4801 110 F 4.5564 7.5223 119.8430 59.3993 38.9028 176.2637 111 G 4.4468 9.4085 112.3395 46.4186 0.0000 173.7374 112 A 4.5804 7.7124 122.5425 51.1120 19.1476 176.8104 113 E 3.9524 8.6033 121.6264 57.6411 30.2654 176.7850 114 D 4.5881 9.1116 121.8657 54.8258 38.3087 173.3808 115 D 4.4048 7.8909 114.7441 54.8766 39.0219 173.9275 116 A 4.0981 7.7313 121.4585 53.0208 18.5449 178.3371 117 M 4.6685 8.4948 120.4796 54.7076 34.2461 175.7902 118 T 4.3116 7.6266 110.2595 61.3923 70.7360 172.9416 119 Y 4.4860 8.5739 125.2402 57.6398 40.1285 173.7222 120 H 4.7551 7.9437 124.9554 57.0645 32.2640 171.1478 121 C 4.9567 6.7402 109.7115 55.0390 39.2919 171.8186 122 T 5.3500 9.0919 115.9129 61.7827 71.2434 173.8901 123 I 4.5985 8.4861 118.5191 59.0760 40.5646 175.0258 124 S 4.9660 8.2749 117.4853 56.5955 61.8090 172.3995 125 P 4.5262 0.0000 0.0000 62.2929 33.6401 176.9952 126 I 4.6034 8.1260 122.4938 61.0920 37.7797 176.0643 127 V 4.2902 9.7090 118.9804 60.3285 33.2036 175.6865 128 G 4.1942 7.5632 108.4111 45.8591 0.0000 171.5264 129 K 4.5297 8.3159 119.1909 55.6904 32.7750 177.9432 130 A 4.8472 8.5408 127.5740 52.0465 19.9810 177.1952 131 S 4.3864 8.6439 110.9735 59.4171 63.2064 174.0247 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 7 T 8.17 4.24 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 1.22 0.00 0.00 8 D 8.50 4.30 0.00 2.83 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.42 0.00 2.25 2.21 0.00 3.83 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 2.01 2.01 0.00 10 R 8.59 4.17 0.00 1.96 2.04 0.00 3.17 0.00 0.00 3.24 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.59 0.00 11 A 7.50 4.24 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 12 K 8.53 3.95 0.00 1.76 1.79 0.00 1.80 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.51 1.51 7.81 13 W 8.90 4.25 0.00 3.28 3.25 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 14 V 7.63 4.10 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 0.83 0.00 0.00 0.95 0.00 0.00 15 P 0.00 4.00 0.00 2.24 1.83 0.00 3.67 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.19 0.00 16 Q 8.55 4.65 0.00 2.29 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.91 7.00 0.00 0.00 0.00 0.00 0.00 2.38 2.44 0.00 17 D 8.53 5.50 0.00 2.60 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 18 N 9.40 5.00 0.00 2.79 2.88 0.00 0.00 6.52 7.74 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 19 D 8.04 4.34 0.00 2.67 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 20 I 7.96 2.99 1.32 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.54 0.07 0.00 0.00 21 Q 8.37 4.26 0.00 2.17 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.71 0.00 0.00 0.00 0.00 0.00 2.32 2.24 0.00 22 A 7.46 4.76 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 23 C 8.92 4.70 0.00 3.13 3.35 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 24 D 8.12 5.01 0.00 2.60 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 25 Y 8.15 4.78 0.00 3.36 2.91 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 26 W 8.51 4.59 0.00 3.69 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 27 R 5.84 3.37 0.00 1.36 1.52 0.00 2.97 0.00 0.00 2.82 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 28 H 8.27 5.18 0.00 3.56 3.36 0.00 5.63 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 C 8.31 3.06 0.00 2.50 3.57 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 30 S 7.73 4.84 0.00 3.81 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 31 I 7.36 3.39 1.81 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 1.06 1.39 0.86 0.00 0.00 32 D 8.76 4.77 0.00 2.79 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 33 G 7.92 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 34 N 9.62 5.41 0.00 2.70 2.83 0.00 0.00 7.39 7.44 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 35 I 8.22 4.28 1.86 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 1.13 0.74 0.95 0.00 0.00 36 C 8.65 4.16 0.00 2.94 3.11 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 37 D 8.09 4.17 0.00 2.71 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 38 C 8.14 4.76 0.00 3.10 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 39 S 8.32 4.62 0.00 3.99 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 40 G 8.72 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 0.00 0.00 0.00 41 G 7.52 4.20 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 0.00 42 S 8.18 5.08 0.00 3.90 3.81 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.69 4.04 0.00 1.66 1.67 0.90 0.58 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 44 T 7.81 4.71 4.21 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 1.17 0.00 0.00 45 N 7.90 5.07 0.00 2.73 2.67 0.00 0.00 7.00 8.33 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 46 C 8.38 4.77 0.00 2.90 2.91 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 47 P 0.00 4.74 0.00 1.93 2.06 0.00 3.74 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.08 0.00 48 P 0.00 4.18 0.00 2.00 1.95 0.00 3.62 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 2.00 2.05 0.00 49 G 8.87 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 50 T 6.71 4.34 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 0.28 0.00 0.00 51 K 8.79 4.58 0.00 1.62 1.73 0.00 1.68 0.00 0.00 1.57 0.00 0.00 2.80 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.37 1.66 7.81 52 L 8.42 4.50 0.00 1.75 1.53 0.92 1.01 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 53 A 8.66 4.61 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 54 T 8.68 4.40 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 1.29 0.00 0.00 55 A 8.04 4.77 1.49 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 0.00 0.00 56 S 7.19 3.95 0.00 3.97 3.31 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 *58 V 8.69 4.50 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 0.92 0.00 0.00 0.98 0.00 0.00 59 A 8.20 4.76 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 60 S 8.77 5.07 0.00 3.95 3.83 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 61 C 9.44 5.29 0.00 3.27 3.55 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 62 Y 8.98 4.63 0.00 3.16 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 63 N 8.35 3.58 0.00 1.44 2.25 0.00 0.00 6.56 7.49 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 64 P 0.00 4.05 0.00 2.13 2.16 0.00 3.12 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.89 0.00 65 T 7.87 3.88 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 1.13 0.00 0.00 66 D 7.58 4.62 0.00 2.68 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 67 G 7.62 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 68 Q 8.10 4.57 0.00 1.84 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.34 6.73 0.00 0.00 0.00 0.00 0.00 2.38 2.37 0.00 69 S 8.18 5.30 0.00 3.75 3.83 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 70 Y 9.20 5.16 0.00 3.27 2.99 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 71 L 9.25 4.85 0.00 1.79 1.60 1.09 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 72 I 8.90 4.61 1.43 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 1.11 0.17 0.00 0.00 73 A 8.15 4.26 1.12 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 0.00 0.00 74 Y 8.03 4.71 0.00 2.95 3.01 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 75 R 8.03 4.42 0.00 1.79 1.88 0.00 3.08 0.00 0.00 3.31 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.77 0.00 76 D 8.60 5.35 0.00 2.88 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 77 C 8.83 5.22 0.00 2.73 2.87 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 0.00 0.00 0.00 78 C 8.92 5.85 0.00 2.79 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 79 G 9.21 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 80 Y 7.43 4.73 0.00 2.63 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 81 N 8.49 4.60 0.00 2.64 2.73 0.00 0.00 7.02 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 82 V 8.61 3.95 2.24 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 0.98 0.00 0.00 1.09 0.00 0.00 83 S 8.29 4.13 0.00 3.98 3.67 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 0.00 0.00 0.00 0.00 84 G 7.77 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 85 R 7.58 4.54 0.00 1.80 1.83 0.00 3.33 0.00 0.00 3.47 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.71 0.00 86 C 8.68 4.32 0.00 3.10 3.08 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 87 P 0.00 5.12 0.00 2.08 2.06 0.00 3.77 0.00 0.00 3.61 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 88 C 9.21 5.00 0.00 2.83 2.98 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 89 L 8.37 4.88 0.00 1.52 1.48 0.89 0.86 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 90 N 9.08 5.09 0.00 2.38 2.06 0.00 0.00 6.17 7.31 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 91 T 7.53 4.86 4.16 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 0.00 0.00 1.17 0.00 0.00 92 E 8.28 3.86 0.00 1.90 1.93 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 1.95 2.21 0.00 93 G 8.81 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 0.00 0.00 0.00 94 E 7.83 4.31 0.00 1.96 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 2.59 2.58 0.00 95 L 8.39 4.75 0.00 1.67 1.44 0.95 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 96 P 0.00 4.57 0.00 1.40 2.00 0.00 3.28 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.06 0.00 97 V 8.51 3.62 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 0.95 0.00 0.00 98 Y 7.76 4.50 0.00 3.11 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 99 R 7.81 4.72 0.00 1.79 1.91 0.00 3.40 0.00 0.00 3.35 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 1.57 0.00 100 P 0.00 4.48 0.00 2.51 2.49 0.00 3.81 0.00 0.00 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.07 0.00 101 E 8.19 3.70 0.00 1.50 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 1.47 1.47 0.00 102 F 8.33 5.11 0.00 3.10 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 0.00 103 A 8.47 5.17 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 N 9.22 5.09 0.00 2.79 2.90 0.00 0.00 7.01 8.14 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 0.00 105 D 7.85 4.75 0.00 2.61 2.67 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 0.00 0.00 0.00 0.00 106 I 7.23 3.46 0.85 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.28 -0.41 0.00 0.00 107 I 7.62 3.79 1.62 0.00 0.00 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 1.23 0.63 0.93 0.00 0.00 108 W 8.52 4.75 0.00 3.64 3.31 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 0.00 109 C 7.26 4.85 0.00 2.75 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 0.00 110 F 7.52 4.56 0.00 3.30 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 0.00 111 G 9.41 4.45 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 0.00 0.00 0.00 112 A 7.71 4.58 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 0.00 113 E 8.60 3.95 0.00 2.02 1.84 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 2.39 2.35 0.00 114 D 9.11 4.59 0.00 2.89 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 0.00 115 D 7.89 4.40 0.00 2.86 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 0.00 116 A 7.73 4.10 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 0.00 117 M 8.49 4.67 0.00 1.88 2.02 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.58 0.00 118 T 7.63 4.31 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 1.22 0.00 0.00 119 Y 8.57 4.49 0.00 3.13 2.90 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 0.00 120 H 7.94 4.76 0.00 3.24 3.22 0.00 5.87 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 C 6.74 4.96 0.00 3.12 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 0.00 122 T 9.09 5.35 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 1.55 0.00 0.00 123 I 8.49 4.60 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 1.45 0.91 0.90 0.00 0.00 124 S 8.27 4.97 0.00 3.75 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 0.00 125 P 0.00 4.53 0.00 2.05 2.11 0.00 3.79 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.93 0.00 126 I 8.13 4.60 1.85 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.43 1.06 0.00 0.00 127 V 9.71 4.29 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 0.61 0.00 0.00 1.00 0.00 0.00 128 G 7.56 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 0.00 0.00 0.00 0.00 129 K 8.32 4.53 0.00 1.62 1.64 0.00 1.64 0.00 0.00 1.57 0.00 0.00 2.79 0.00 0.00 2.75 0.00 0.00 0.00 0.00 0.92 1.27 7.81 130 A 8.54 4.85 1.26 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 0.00 0.00 0.00 131 S 8.64 4.39 0.00 3.86 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 * Residues marked with a * may have inaccurate shift predictions.