NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 G 3.7048 8.2014 109.7242 45.2696 0.0000 172.6076 *9 G 4.0734 8.1020 107.2698 45.3442 0.0000 172.0025 10 N 4.9992 8.4793 117.8150 51.2021 40.7113 174.2255 11 A 4.8850 8.1640 123.5036 50.6476 20.7796 176.2567 12 A 4.8112 8.7237 123.6027 49.8839 21.6092 175.9261 13 E 4.3775 8.9803 123.5578 56.2340 30.5915 175.8971 14 V 4.3565 8.1196 126.5855 60.7425 33.6807 174.9964 15 N 4.3610 8.6487 125.9975 53.8625 39.3116 175.4819 16 L 4.1822 8.4945 125.8064 57.0810 41.7494 179.1022 17 D 4.3147 8.0663 119.0405 57.4211 40.9548 178.3106 18 E 3.9726 8.9109 119.5458 59.2626 29.4524 179.1538 19 L 3.9446 7.9711 120.2358 58.1057 42.1361 178.8869 20 A 4.0624 8.0560 120.7938 55.1566 18.0501 179.4421 21 Q 3.9174 7.6832 117.4705 59.3531 29.2234 177.8766 22 E 4.1696 8.0759 118.6944 58.6052 29.8523 178.2965 23 L 4.5398 8.5625 118.2748 55.2641 41.9174 178.9202 24 G 3.9913 7.7564 106.1755 47.7055 0.0000 173.7601 25 P 4.4150 0.0000 0.0000 63.5953 32.6324 177.0547 26 I 4.2132 7.6665 112.4901 59.1572 36.7680 175.1103 *28 G 3.7538 7.3992 111.4106 45.7355 0.0000 171.8473 29 D 4.3553 8.8446 120.4928 57.0812 40.8511 177.9370 30 N 4.8908 7.9762 113.4382 52.8773 39.0561 173.9583 31 E 4.6553 7.7360 119.0508 55.1303 31.0237 175.2167 32 Q 4.7298 9.0213 123.4645 53.9868 33.1739 174.4165 33 L 4.5062 8.5861 121.8182 54.6696 42.1486 176.3060 34 A 4.6523 8.9722 124.9248 53.3378 21.1563 176.9579 35 L 4.3827 7.7307 113.0223 54.4075 45.6073 173.6246 36 A 5.2690 7.9334 125.8131 50.8865 22.7537 174.4238 37 Y 5.2086 8.9767 118.9108 56.1901 41.5274 175.0634 38 R 4.8497 9.4982 123.4713 54.6986 33.0957 175.0958 39 V 4.3096 8.6235 125.6557 62.7654 33.8340 177.7742 40 I 3.2882 8.8365 132.8280 62.5902 35.5165 175.6364 41 R 4.3681 9.2029 129.1381 57.3903 31.8032 175.8371 42 D 5.0626 7.6912 117.6335 52.2105 43.1809 174.2355 *44 F 4.4800 8.2946 121.5511 58.8281 40.7039 174.4598 45 V 4.7771 8.1644 127.0627 61.1032 34.1714 174.1335 46 F 4.9889 9.9750 127.8610 56.5176 40.5990 175.7398 47 T 4.8648 8.4680 115.9461 59.9819 71.0492 174.2275 48 N 3.1400 8.6644 117.7948 53.6485 37.1363 175.9277 49 K 4.7715 8.3994 118.9209 56.9428 35.6117 175.7655 50 R 3.9477 7.4978 114.0674 55.0934 32.6798 173.7003 51 L 4.4052 8.0486 120.0246 53.6252 43.6130 175.9919 52 I 4.4733 8.0589 123.7154 59.4845 39.7118 174.5147 53 L 4.3916 8.7210 128.2834 53.0742 43.5836 175.9158 54 I 4.5904 8.0782 126.0462 59.9378 38.7469 174.2657 55 D 5.2723 8.7346 127.7262 52.2884 43.4349 175.7237 56 K 5.1197 9.2919 122.8442 54.8110 34.4655 175.5814 57 Q 4.5806 9.4463 122.2441 54.6820 33.0387 175.7294 58 G 3.8833 8.8031 105.7848 45.0488 0.0000 174.8992 59 V 3.5686 8.2382 118.6629 65.8088 31.4409 177.0320 60 T 4.2148 7.9005 106.3882 61.0639 69.3044 174.6149 61 G 3.8890 7.4897 109.5631 46.9717 0.0000 174.8281 62 K 4.1499 8.1055 118.9275 56.4198 33.1063 176.8796 63 K 4.2845 7.7093 121.2514 55.5756 32.3784 175.3007 64 V 5.0843 8.2902 127.2197 60.8640 34.2577 174.5565 65 S 4.9113 9.2014 122.0970 56.7518 66.1082 172.6475 66 Y 4.7216 8.7445 119.9770 56.8611 39.8121 174.5583 67 H 4.8147 9.0903 126.3769 54.6847 31.5265 173.7641 68 S 4.8202 8.6492 122.7405 57.5590 64.1560 174.2512 69 V 4.0752 8.6537 126.0180 60.0155 32.7506 173.1000 70 P 4.5758 0.0000 0.0000 62.3202 32.2115 177.6779 71 Y 4.2123 8.2058 119.8042 60.9607 37.9442 178.8229 72 K 4.1884 8.1744 117.1371 58.7687 33.0103 177.4271 73 A 4.2087 8.0500 122.4299 53.2437 19.0078 176.8931 74 I 4.6895 7.6222 117.3391 60.7811 36.2992 175.6828 75 T 4.4724 8.7083 117.7447 64.3422 69.7489 174.3351 76 H 4.9528 8.3678 115.5490 55.2771 31.4232 172.5455 77 F 5.8558 8.2119 112.8559 56.3393 40.8202 172.9150 78 E 4.8828 9.7587 119.9495 54.8084 33.4090 173.7984 79 V 5.0145 8.6087 125.3273 61.0537 34.3503 173.9678 80 E 4.8336 8.9492 128.4925 54.3523 32.0890 175.3308 81 T 4.4915 8.6325 116.8826 61.1029 70.0258 174.3203 82 A 4.1391 8.5049 126.2517 52.2005 19.0940 178.3905 83 G 3.7472 8.6448 110.9189 47.7816 0.0000 173.5368 84 T 4.7845 7.3898 107.4073 59.1866 72.0649 173.5796 85 F 4.3148 8.8436 123.4931 61.4359 39.4371 176.0816 86 D 4.3698 7.4169 118.4297 54.6900 40.2856 175.6026 *88 D 4.4571 7.9636 117.7062 53.7551 42.7495 175.1624 89 A 4.4501 8.3574 122.0003 52.1623 20.1525 175.8371 90 E 4.9549 9.2298 120.8126 54.2140 32.9069 174.3492 91 L 5.1559 8.9887 129.0915 53.3749 44.4599 174.8082 92 K 4.8447 9.1921 126.2316 54.5172 34.7938 175.0645 93 L 5.1005 8.5934 125.0425 52.7498 44.8322 175.4331 94 W 4.8299 9.4496 124.6549 55.6268 30.9082 175.3189 95 I 4.9797 8.3265 125.4382 59.1388 39.1505 175.1045 96 S 4.1302 8.8164 121.7171 60.4736 62.3815 174.7360 97 G 3.9459 9.2221 116.0672 45.0579 0.0000 172.3723 98 Q 4.5268 7.8881 121.1898 53.9420 30.1090 175.0819 99 K 4.2031 8.8742 127.3159 59.1976 32.6328 176.6747 100 D 4.8252 7.8104 117.3636 52.3563 42.0405 174.3846 101 P 4.1465 0.0000 0.0000 62.1397 32.5311 175.5715 102 L 4.0631 8.4320 124.3348 55.0629 43.0326 175.5332 103 V 4.7040 8.2929 126.5160 61.0849 33.4614 174.7773 104 K 4.6379 9.0824 127.0592 54.3931 35.8978 175.4173 105 E 4.3340 8.7294 124.4624 56.3519 30.1406 177.8164 106 L 4.2286 8.6308 126.5400 53.2775 40.1207 176.7856 107 K 4.3531 7.7540 121.7653 55.0150 34.1821 176.5109 108 K 3.9409 8.4509 121.9262 58.3712 32.3851 177.9988 109 G 4.0589 9.0109 111.6663 45.4426 0.0000 173.7939 110 T 3.7383 7.2651 109.3614 60.6398 69.7828 175.5315 111 D 4.5688 8.6390 123.5253 53.1074 40.2635 177.1234 112 V 3.5744 7.9484 125.3306 65.6876 31.7590 177.4885 113 V 3.7125 7.7694 117.6236 65.8343 31.4419 178.1082 114 G 3.5612 8.0880 106.4268 47.0958 0.0000 175.2974 115 I 3.3389 8.2057 122.6921 64.4996 37.2193 178.5403 116 Q 4.0261 7.8584 118.0114 58.7093 28.4611 178.7874 117 K 3.9164 8.2839 121.0313 59.6716 32.2520 179.0247 118 T 3.5289 8.1635 116.4443 66.6474 68.2701 176.6698 119 I 3.7282 7.7737 121.4324 64.2009 36.6350 178.4248 120 A 4.0272 7.9890 121.5770 55.2726 18.0344 179.2964 121 N 4.0572 8.2675 114.0867 55.9955 38.6101 176.7831 122 F 4.7521 7.5243 116.6650 57.6500 39.8833 177.1720 123 S 4.7943 8.1192 111.9600 58.0804 63.8632 174.0564 124 L 4.3898 7.5113 126.4646 55.0088 41.6753 176.0240 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 0 G 8.20 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.10 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 10 N 8.48 5.00 0.00 2.70 2.72 0.00 0.00 6.85 7.35 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 11 A 8.16 4.88 1.13 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 0.00 0.00 12 A 8.72 4.81 1.28 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 0.00 0.00 0.00 13 E 8.98 4.38 0.00 2.07 1.86 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 2.12 1.95 0.00 14 V 8.12 4.36 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 0.77 0.00 0.00 0.96 0.00 0.00 15 N 8.65 4.36 0.00 2.75 2.69 0.00 0.00 7.23 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 16 L 8.49 4.18 0.00 1.72 1.69 0.95 1.15 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 17 D 8.07 4.31 0.00 2.85 2.71 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 18 E 8.91 3.97 0.00 1.97 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 2.33 2.40 0.00 19 L 7.97 3.94 0.00 1.90 1.65 0.89 1.17 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 20 A 8.06 4.06 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.68 3.92 0.00 2.27 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.96 0.00 0.00 0.00 0.00 0.00 2.37 2.27 0.00 22 E 8.08 4.17 0.00 2.12 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 2.35 2.52 0.00 23 L 8.56 4.54 0.00 1.70 1.71 0.84 0.82 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 24 G 7.76 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 0.00 0.00 0.00 25 P 0.00 4.41 0.00 2.03 2.13 0.00 3.79 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 2.03 2.15 0.00 26 I 7.67 4.21 1.90 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.70 0.89 0.00 0.00 *28 G 7.40 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 29 D 8.84 4.36 0.00 2.67 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 30 N 7.98 4.89 0.00 2.69 2.81 0.00 0.00 6.77 7.66 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 31 E 7.74 4.66 0.00 1.92 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 2.22 2.36 0.00 32 Q 9.02 4.73 0.00 1.97 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.75 0.00 0.00 0.00 0.00 0.00 2.26 2.30 0.00 33 L 8.59 4.51 0.00 1.53 1.60 0.93 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 34 A 8.97 4.65 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 35 L 7.73 4.38 0.00 1.68 1.47 0.68 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 36 A 7.93 5.27 1.18 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 0.00 0.00 0.00 0.00 0.00 0.00 37 Y 8.98 5.21 0.00 2.98 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 38 R 9.50 4.85 0.00 1.88 1.81 0.00 3.06 0.00 0.00 3.41 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.60 0.00 39 V 8.62 4.31 2.11 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 0.92 0.00 0.00 0.94 0.00 0.00 40 I 8.84 3.29 1.88 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 1.42 0.54 0.92 0.00 0.00 41 R 9.20 4.37 0.00 1.80 1.98 0.00 3.21 0.00 0.00 3.23 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.64 0.00 42 D 7.69 5.06 0.00 2.86 2.71 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 *44 F 8.29 4.48 0.00 3.16 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 45 V 8.16 4.78 1.97 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 0.95 0.00 0.00 0.83 0.00 0.00 46 F 9.97 4.99 0.00 3.25 3.26 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 47 T 8.47 4.86 4.31 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 1.18 0.00 0.00 48 N 8.66 3.14 0.00 2.31 2.63 0.00 0.00 6.78 7.79 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 49 K 8.40 4.77 0.00 1.72 1.81 0.00 1.72 0.00 0.00 1.69 0.00 0.00 2.84 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.27 1.45 7.81 50 R 7.50 3.95 0.00 1.57 1.78 0.00 2.81 0.00 0.00 3.23 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.42 0.00 51 L 8.05 4.41 0.00 1.00 0.75 0.73 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 52 I 8.06 4.47 1.61 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.63 0.64 0.00 0.00 53 L 8.72 4.39 0.00 1.37 1.40 0.78 -0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 54 I 8.08 4.59 1.67 0.00 0.00 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.32 0.89 0.78 0.00 0.00 55 D 8.73 5.27 0.00 2.60 2.55 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 56 K 9.29 5.12 0.00 1.60 1.84 0.00 1.79 0.00 0.00 1.86 0.00 0.00 2.99 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.40 7.81 57 Q 9.45 4.58 0.00 1.91 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 5.31 0.00 0.00 0.00 0.00 0.00 2.26 2.28 0.00 58 G 8.80 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 59 V 8.24 3.57 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 0.93 0.00 0.00 60 T 7.90 4.21 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 61 G 7.49 3.89 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 0.00 0.00 0.00 0.00 0.00 0.00 62 K 8.11 4.15 0.00 1.75 1.86 0.00 1.76 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.39 1.35 7.81 63 K 7.71 4.28 0.00 1.88 1.91 0.00 1.45 0.00 0.00 1.57 0.00 0.00 2.85 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.41 1.43 7.81 64 V 8.29 5.08 2.11 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 1.14 0.00 0.00 0.99 0.00 0.00 65 S 9.20 4.91 0.00 3.92 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 66 Y 8.74 4.72 0.00 2.66 2.85 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 67 H 9.09 4.81 0.00 3.15 3.06 0.00 5.59 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 S 8.65 4.82 0.00 3.74 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 69 V 8.65 4.08 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 0.69 0.00 0.00 0.57 0.00 0.00 70 P 0.00 4.58 0.00 2.20 1.92 0.00 3.59 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.04 0.00 71 Y 8.21 4.21 0.00 3.07 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 72 K 8.17 4.19 0.00 1.93 2.03 0.00 1.61 0.00 0.00 1.77 0.00 0.00 3.01 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.48 7.81 73 A 8.05 4.21 1.40 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 0.00 0.00 0.00 74 I 7.62 4.69 2.17 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.65 1.17 0.00 0.00 75 T 8.71 4.47 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 1.34 0.00 0.00 76 H 8.37 4.95 0.00 3.04 3.27 0.00 5.49 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 F 8.21 5.86 0.00 3.30 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 78 E 9.76 4.88 0.00 2.34 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 0.00 2.32 2.36 0.00 79 V 8.61 5.01 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 0.92 0.00 0.00 1.07 0.00 0.00 80 E 8.95 4.83 0.00 2.09 1.76 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 2.20 2.23 0.00 81 T 8.63 4.49 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 82 A 8.50 4.14 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 83 G 8.64 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 84 T 7.39 4.78 4.29 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 1.23 0.00 0.00 85 F 8.84 4.31 0.00 2.96 3.16 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 0.00 86 D 7.42 4.37 0.00 2.53 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 *88 D 7.96 4.46 0.00 2.54 2.69 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 89 A 8.36 4.45 1.24 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 90 E 9.23 4.95 0.00 1.96 1.75 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 2.14 2.16 0.00 91 L 8.99 5.16 0.00 1.73 1.59 1.08 0.54 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 92 K 9.19 4.84 0.00 1.50 0.83 0.00 1.74 0.00 0.00 1.42 0.00 0.00 2.77 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.19 1.34 7.81 93 L 8.59 5.10 0.00 1.53 1.61 1.03 0.96 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 94 W 9.45 4.83 0.00 3.37 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 95 I 8.33 4.98 1.92 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.79 0.94 0.00 0.00 96 S 8.82 4.13 0.00 3.86 3.87 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 97 G 9.22 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 98 Q 7.89 4.53 0.00 2.03 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.91 0.00 0.00 0.00 0.00 0.00 2.45 2.28 0.00 99 K 8.87 4.20 0.00 1.81 1.87 0.00 1.86 0.00 0.00 1.75 0.00 0.00 3.07 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.52 1.54 7.81 100 D 7.81 4.83 0.00 2.69 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 0.00 101 P 0.00 4.15 0.00 1.17 0.49 0.00 3.63 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.32 0.00 102 L 8.43 4.06 0.00 1.75 1.52 0.93 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 103 V 8.29 4.70 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 0.83 0.00 0.00 0.79 0.00 0.00 104 K 9.08 4.64 0.00 1.47 1.44 0.00 1.71 0.00 0.00 1.70 0.00 0.00 3.24 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.36 1.60 7.81 105 E 8.73 4.33 0.00 1.78 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 2.25 2.28 0.00 106 L 8.63 4.23 0.00 1.51 1.50 0.89 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 107 K 7.75 4.35 0.00 1.58 1.83 0.00 1.89 0.00 0.00 1.83 0.00 0.00 2.74 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.44 1.40 7.81 108 K 8.45 3.94 0.00 1.87 1.70 0.00 1.39 0.00 0.00 1.62 0.00 0.00 2.13 0.00 0.00 2.30 0.00 0.00 0.00 0.00 1.41 1.46 7.81 109 G 9.01 4.06 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 0.00 0.00 0.00 110 T 7.27 3.74 3.61 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 0.51 0.00 0.00 111 D 8.64 4.57 0.00 2.82 2.69 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 0.00 112 V 7.95 3.57 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 0.96 0.00 0.00 0.85 0.00 0.00 113 V 7.77 3.71 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 1.06 0.00 0.00 0.93 0.00 0.00 114 G 8.09 3.56 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 0.00 0.00 0.00 115 I 8.21 3.34 2.04 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 1.36 0.76 0.95 0.00 0.00 116 Q 7.86 4.03 0.00 2.27 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.81 0.00 0.00 0.00 0.00 0.00 2.45 2.58 0.00 117 K 8.28 3.92 0.00 1.89 1.85 0.00 1.59 0.00 0.00 1.58 0.00 0.00 2.89 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.32 1.41 7.81 118 T 8.16 3.53 4.17 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 0.00 0.00 0.00 1.47 0.00 0.00 119 I 7.77 3.73 1.75 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 1.69 1.02 0.15 0.00 0.00 120 A 7.99 4.03 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 0.00 121 N 8.27 4.06 0.00 2.07 2.03 0.00 0.00 7.02 7.89 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 0.00 122 F 7.52 4.75 0.00 1.61 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 0.00 0.00 0.00 0.00 123 S 8.12 4.79 0.00 4.34 4.12 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 0.00 124 L 7.51 4.39 0.00 1.83 1.65 1.03 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.