NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 G 4.4792 8.3016 107.8371 46.3934 0.0000 172.0891 7 L 4.6231 8.1785 121.2206 52.7173 44.2776 173.2660 8 A 4.9712 9.2819 128.6682 49.7852 20.8954 175.2311 9 Q 4.6484 8.4726 121.4981 54.7822 31.6668 175.1788 10 F 5.1979 8.6332 119.9144 55.8311 42.5115 174.4264 11 I 4.9123 8.7705 123.5446 59.4360 41.4879 174.0842 12 K 4.8301 9.2453 128.1150 55.3092 34.1982 175.4733 13 V 4.5828 9.1696 128.5053 61.6843 32.3668 173.5846 14 N 5.0808 8.8825 126.4182 52.1042 40.2694 174.4348 15 V 4.4753 8.4715 124.0511 61.1365 34.2843 174.5984 16 T 4.7968 8.4538 117.4462 59.8588 72.3876 172.4910 17 L 5.2083 8.2423 120.8333 52.9823 44.1696 176.3660 18 E 4.5515 8.8432 122.4020 55.8113 32.7075 175.7690 19 N 4.1762 9.9428 120.8004 54.3895 36.2568 175.4482 20 G 3.9756 8.5246 104.1600 45.4642 0.0000 173.5911 21 E 4.9507 7.8099 118.8400 53.3329 33.6163 173.6799 22 P 4.7853 0.0000 0.0000 62.9134 32.6335 175.6742 23 V 4.4469 8.7367 122.0058 61.2121 34.6146 173.9407 24 F 4.7426 8.9934 126.4674 55.9810 40.3991 175.1459 25 I 4.3250 8.4763 125.2040 59.5740 40.1462 174.2291 26 Y 5.2470 8.3832 125.1129 57.0781 39.8471 174.7074 27 T 5.2514 9.0167 113.7016 60.1457 72.4864 173.5324 28 D 5.0746 8.7499 123.6426 52.0224 42.1824 176.5519 29 A 3.9827 8.8416 120.6042 55.6644 18.3128 178.1959 30 N 4.6236 8.3198 110.3190 52.8586 37.3962 175.7397 31 G 3.9175 8.2776 105.7938 46.4357 0.0000 173.8785 32 Q 4.3488 8.2499 119.2754 54.2169 29.7315 175.7792 33 V 4.1430 8.3143 122.3716 63.4144 32.0483 174.7710 34 C 4.8246 8.8069 121.0489 57.3817 32.3697 173.5566 35 Q 4.4562 8.8246 116.2136 55.8047 28.4121 176.5596 36 G 3.8389 8.3164 105.0837 46.4210 0.0000 173.8508 37 D 4.4414 7.5389 118.6894 54.1132 41.2262 176.2709 38 I 4.3790 8.1198 122.8831 59.6596 39.0680 175.5343 39 T 4.1633 8.5657 123.6326 62.8885 68.5543 174.6345 40 V 4.3553 8.3051 126.7971 60.1474 33.0714 175.7543 41 T 4.4804 8.3767 112.0196 61.4280 69.8919 173.1308 42 Q 4.4739 7.5021 121.1297 54.5278 32.2779 173.2718 43 A 4.2385 8.5662 124.4908 51.9359 19.4386 177.8179 44 G 3.8542 7.8414 108.5050 45.8602 0.0000 171.9860 45 T 5.0580 7.7678 108.5360 59.8873 72.7431 173.1087 46 I 4.3745 8.4435 123.4198 59.8479 40.5185 174.4086 47 T 4.7993 8.3491 124.4888 61.9260 70.8915 172.9822 48 Y 5.2147 9.1465 124.8735 56.3058 40.6975 174.5975 49 L 5.1063 9.0026 124.9504 52.8589 44.0526 175.5273 50 L 4.3642 8.8103 126.9445 54.8595 42.9877 175.8548 51 N 4.7439 9.3669 126.1064 51.7014 40.1732 171.4104 52 D 4.6531 8.3540 124.0253 52.9762 41.8080 175.1980 53 Q 4.7395 8.7687 126.4721 56.0128 29.1732 177.1491 54 T 4.0418 8.4647 111.0230 61.4310 69.5602 175.3960 55 L 3.6284 7.9209 119.6761 55.6043 39.2392 174.5512 56 K 4.3700 8.1436 116.7439 55.5808 32.2148 176.7207 57 G 4.1568 7.9156 105.2117 45.7931 0.0000 174.6698 58 L 4.8668 8.0158 118.3402 54.0755 42.5686 177.3264 59 K 4.6221 8.1718 120.3701 54.4335 36.6187 175.7383 60 F 5.0656 8.9854 123.8832 58.2382 39.0965 175.6624 61 V 4.4158 10.1627 114.8045 60.2947 33.8226 175.7839 62 G 4.0322 7.0672 105.7929 46.3058 0.0000 170.7020 63 V 4.6720 8.1196 119.2692 60.9471 33.8957 175.5116 64 G 4.3465 8.9932 115.2537 44.6556 0.0000 172.2255 65 F 5.0640 8.4843 119.5552 55.4888 42.0924 175.5314 66 V 3.7320 8.8010 123.0049 64.9648 32.1902 176.1555 67 T 4.6036 7.5311 109.5144 59.3719 67.9671 172.7121 68 P 3.9261 0.0000 0.0000 65.0749 32.0907 177.8819 69 F 5.0016 7.4086 116.9636 57.4376 39.0183 176.0938 70 D 4.4250 7.7010 121.1393 53.8909 39.5794 177.6449 71 G 3.9243 8.1597 107.3925 45.7838 0.0000 174.6544 72 I 3.7874 8.3070 120.9666 63.8872 37.2412 176.3974 73 I 4.3199 7.2848 119.4970 59.8301 38.4296 175.3671 74 D 4.6057 8.6768 125.3559 56.8701 41.5524 176.4706 75 A 4.5638 7.4901 117.1868 50.8653 22.7861 175.2632 76 V 4.8882 8.2832 118.8287 61.2519 34.3075 174.8473 77 T 4.8426 8.8161 116.9147 60.0204 72.1758 172.5830 78 I 5.2167 8.0549 121.7021 59.4505 41.4935 174.7036 79 S 4.6819 8.9798 123.2138 57.6753 64.1694 175.5015 80 S 4.2050 8.8249 115.8271 60.9587 62.9741 174.6896 81 D 4.5422 8.1769 118.2225 52.6074 40.2467 175.3820 82 G 3.6556 7.8996 109.5692 46.0800 0.0000 172.5512 *84 L 4.9495 7.2634 119.6850 55.1872 44.1594 177.2978 85 V 5.0173 8.5380 114.7374 59.7185 36.0744 174.6042 86 Q 5.0948 9.1256 121.9671 54.1948 32.8177 174.2219 87 L 4.9318 8.9222 123.2509 53.2188 44.2516 175.4937 88 V 4.5682 8.5830 123.5230 61.0961 34.2117 173.7203 89 D 5.1540 8.9541 127.9117 52.9242 42.3479 176.0930 90 L 4.1625 9.9325 128.1588 56.3079 42.2924 178.0310 91 D 4.7864 8.0617 113.8886 51.9078 40.2253 175.7704 92 K 3.7629 8.2964 116.5315 58.1444 29.3950 175.9592 93 T 4.0751 7.6223 114.3416 62.6315 69.3659 173.5948 94 P 4.4199 0.0000 0.0000 62.6236 32.4979 176.5533 95 G 3.8497 7.5575 105.9113 44.5482 0.0000 172.5602 96 T 4.7361 7.9743 115.5866 62.0587 72.2369 173.2213 97 T 4.7436 8.3001 117.5782 60.2138 70.8053 172.6543 98 K 4.5450 8.5262 126.4539 54.4741 34.5143 174.9579 99 F 4.6607 7.3715 118.2784 55.2035 41.4381 173.4427 100 Q 4.2441 8.4467 117.9408 53.6902 32.5247 175.3003 101 F 4.4832 8.6917 122.6854 57.5943 40.6167 174.3271 102 V 4.9821 8.8253 121.9017 61.2518 34.1382 174.3696 103 L 5.5526 9.1301 127.2832 53.0264 46.1048 176.3398 104 S 4.9950 8.9264 117.3820 57.8852 65.1313 172.4591 105 N 5.5705 8.3937 116.9472 51.7337 40.4216 174.1927 106 T 4.3450 8.9930 108.8975 62.1462 69.6064 176.5358 107 A 4.1869 8.2680 125.5895 54.5469 19.1029 176.4652 108 N 4.9233 8.5188 111.2508 52.5921 40.3782 174.1284 109 T 4.4585 8.2773 105.6410 61.3667 69.0409 174.4801 110 L 4.3352 7.9358 122.2976 54.5875 42.4402 176.7268 111 L 4.5090 8.2821 122.3353 54.6469 42.9144 176.2180 112 V 4.3895 9.0417 122.3628 61.5304 33.3325 174.5790 113 L 5.8623 8.6648 126.9059 51.8811 44.3792 176.5537 114 S 3.5755 8.3258 117.0114 56.9191 63.9636 172.2720 115 P 4.3067 0.0000 0.0000 62.3212 31.7730 176.4113 116 D 4.5248 8.5166 119.3495 53.8392 39.1265 176.2578 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 6 G 8.30 4.48 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 0.00 7 L 8.18 4.62 0.00 1.84 1.49 0.93 0.52 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 8 A 9.28 4.97 1.17 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 0.00 0.00 0.00 9 Q 8.47 4.65 0.00 1.82 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.71 0.00 0.00 0.00 0.00 0.00 2.25 2.22 0.00 10 F 8.63 5.20 0.00 2.86 2.92 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 11 I 8.77 4.91 1.80 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 1.02 0.99 1.35 0.00 0.00 12 K 9.25 4.83 0.00 1.91 1.76 0.00 1.64 0.00 0.00 1.59 0.00 0.00 2.85 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.41 1.59 7.81 13 V 9.17 4.58 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 0.80 0.00 0.00 1.13 0.00 0.00 14 N 8.88 5.08 0.00 2.69 2.62 0.00 0.00 6.20 8.19 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 15 V 8.47 4.48 1.72 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 0.35 0.00 0.00 0.33 0.00 0.00 16 T 8.45 4.80 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 1.11 0.00 0.00 17 L 8.24 5.21 0.00 1.47 1.56 0.88 0.79 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 18 E 8.84 4.55 0.00 1.90 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 2.17 2.36 0.00 19 N 9.94 4.18 0.00 2.82 2.86 0.00 0.00 7.16 7.65 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 20 G 8.52 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 21 E 7.81 4.95 0.00 1.87 1.82 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 2.37 2.36 0.00 22 P 0.00 4.79 0.00 2.04 1.91 0.00 3.73 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.00 0.00 23 V 8.74 4.45 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 0.94 0.00 0.00 0.91 0.00 0.00 24 F 8.99 4.74 0.00 2.84 2.59 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 25 I 8.48 4.33 1.76 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.66 0.89 0.00 0.00 26 Y 8.38 5.25 0.00 3.29 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 27 T 9.02 5.25 4.30 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 1.25 0.00 0.00 28 D 8.75 5.07 0.00 2.87 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 29 A 8.84 3.98 1.35 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 0.00 0.00 30 N 8.32 4.62 0.00 2.86 2.94 0.00 0.00 6.04 7.00 0.00 0.00 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 G 8.28 3.92 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 32 Q 8.25 4.35 0.00 2.47 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.93 0.00 0.00 0.00 0.00 0.00 2.37 2.31 0.00 33 V 8.31 4.14 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 0.86 0.00 0.00 0.95 0.00 0.00 34 C 8.81 4.82 0.00 3.12 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 35 Q 8.82 4.46 0.00 2.29 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.24 0.00 0.00 0.00 0.00 0.00 2.39 2.64 0.00 36 G 8.32 3.84 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 0.00 0.00 0.00 37 D 7.54 4.44 0.00 2.69 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 38 I 8.12 4.38 1.92 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 1.51 0.87 0.99 0.00 0.00 39 T 8.57 4.16 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 40 V 8.31 4.36 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 0.77 0.00 0.00 0.95 0.00 0.00 41 T 8.38 4.48 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 42 Q 7.50 4.47 0.00 1.97 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.97 0.00 0.00 0.00 0.00 0.00 2.23 2.35 0.00 43 A 8.57 4.24 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 44 G 7.84 3.85 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 0.00 0.00 0.00 45 T 7.77 5.06 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 1.14 0.00 0.00 46 I 8.44 4.37 1.74 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 1.10 0.62 0.39 0.00 0.00 47 T 8.35 4.80 3.77 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 0.00 0.00 1.35 0.00 0.00 48 Y 9.15 5.21 0.00 2.99 2.92 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 49 L 9.00 5.11 0.00 1.71 1.69 1.03 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 50 L 8.81 4.36 0.00 0.98 1.38 0.49 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 51 N 9.37 4.74 0.00 2.77 2.61 0.00 0.00 6.40 8.47 0.00 0.00 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 D 8.35 4.65 0.00 2.55 2.47 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.77 4.74 0.00 1.95 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.63 0.00 0.00 0.00 0.00 0.00 2.21 2.35 0.00 54 T 8.46 4.04 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 1.08 0.00 0.00 55 L 7.92 3.63 0.00 1.79 1.78 0.89 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 56 K 8.14 4.37 0.00 1.72 1.76 0.00 1.80 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.52 1.46 7.81 57 G 7.92 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 0.00 0.00 0.00 0.00 58 L 8.02 4.87 0.00 1.57 1.50 0.78 0.75 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 59 K 8.17 4.62 0.00 1.66 1.66 0.00 1.87 0.00 0.00 1.82 0.00 0.00 2.83 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.39 1.59 7.81 60 F 8.99 5.07 0.00 3.08 2.89 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 61 V 10.16 4.42 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 0.79 0.00 0.00 1.04 0.00 0.00 62 G 7.07 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 63 V 8.12 4.67 2.03 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 0.17 0.00 0.00 0.76 0.00 0.00 64 G 8.99 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 0.00 0.00 0.00 0.00 65 F 8.48 5.06 0.00 2.68 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 66 V 8.80 3.73 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 0.80 0.00 0.00 0.90 0.00 0.00 67 T 7.53 4.60 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 1.22 0.00 0.00 68 P 0.00 3.93 0.00 1.35 1.88 0.00 3.50 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.42 0.00 69 F 7.41 5.00 0.00 3.07 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 70 D 7.70 4.42 0.00 2.76 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 71 G 8.16 3.92 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 72 I 8.31 3.79 1.89 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 1.46 0.87 0.94 0.00 0.00 73 I 7.28 4.32 1.53 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.86 0.84 0.00 0.00 74 D 8.68 4.61 0.00 2.67 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 75 A 7.49 4.56 1.16 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 0.00 0.00 76 V 8.28 4.89 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 0.90 0.00 0.00 0.93 0.00 0.00 77 T 8.82 4.84 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 1.20 0.00 0.00 78 I 8.05 5.22 1.91 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 1.50 1.19 0.96 0.00 0.00 79 S 8.98 4.68 0.00 4.01 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 80 S 8.82 4.20 0.00 4.03 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 81 D 8.18 4.54 0.00 2.81 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 82 G 7.90 3.66 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *84 L 7.26 4.95 0.00 1.81 1.76 1.01 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 85 V 8.54 5.02 1.94 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 0.46 0.00 0.00 0.32 0.00 0.00 86 Q 9.13 5.09 0.00 1.91 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.80 0.00 0.00 0.00 0.00 0.00 2.25 2.31 0.00 87 L 8.92 4.93 0.00 1.49 1.47 0.45 0.40 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 88 V 8.58 4.57 2.03 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 0.90 0.00 0.00 0.89 0.00 0.00 89 D 8.95 5.15 0.00 2.72 2.47 0.00 0.00 0.00 0.00 0.00 0.00 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 9.93 4.16 0.00 1.58 1.67 0.89 0.92 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 91 D 8.06 4.79 0.00 2.70 2.68 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 92 K 8.30 3.76 0.00 1.88 1.88 0.00 2.01 0.00 0.00 1.79 0.00 0.00 2.94 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.34 1.37 7.81 93 T 7.62 4.08 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 1.20 0.00 0.00 94 P 0.00 4.42 0.00 2.18 2.04 0.00 3.75 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.96 0.00 95 G 7.56 3.85 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 0.00 0.00 0.00 96 T 7.97 4.74 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 97 T 8.30 4.74 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 98 K 8.53 4.55 0.00 1.65 1.56 0.00 1.68 0.00 0.00 1.66 0.00 0.00 2.71 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.08 1.14 7.81 99 F 7.37 4.66 0.00 1.88 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 0.00 100 Q 8.45 4.24 0.00 1.78 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 7.01 0.00 0.00 0.00 0.00 0.00 2.30 2.05 0.00 101 F 8.69 4.48 0.00 2.98 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 0.00 102 V 8.83 4.98 2.26 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 1.10 0.00 0.00 0.97 0.00 0.00 103 L 9.13 5.55 0.00 1.73 1.64 1.36 0.77 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 0.00 104 S 8.93 5.00 0.00 3.93 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 0.00 105 N 8.39 5.57 0.00 2.86 2.77 0.00 0.00 6.01 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 0.00 106 T 8.99 4.34 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 1.26 0.00 0.00 107 A 8.27 4.19 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 0.00 108 N 8.52 4.92 0.00 2.77 2.79 0.00 0.00 6.94 8.38 0.00 0.00 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 T 8.28 4.46 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 0.00 110 L 7.94 4.34 0.00 1.86 1.65 0.93 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 111 L 8.28 4.51 0.00 1.57 1.64 0.96 0.92 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 0.00 112 V 9.04 4.39 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 1.24 0.00 0.00 0.98 0.00 0.00 113 L 8.66 5.86 0.00 1.51 1.46 0.91 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 114 S 8.33 3.58 0.00 3.16 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 0.00 115 P 0.00 4.31 0.00 2.02 2.01 0.00 3.53 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.11 0.00 116 D 8.52 4.52 0.00 2.70 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 * Residues marked with a * may have inaccurate shift predictions.