NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 T 4.2759 8.1593 117.3740 63.5499 69.6860 173.5865 2 S 4.3963 8.3922 121.3673 55.7638 65.0511 172.6814 3 K 3.9900 9.4566 122.6267 59.8215 33.2114 179.6549 4 K 3.8316 8.3112 117.7643 59.8229 31.7187 178.6722 5 K 4.0161 7.5574 118.0629 59.6099 32.0299 177.8053 6 R 4.3066 7.6850 115.2860 56.7638 30.4298 177.9665 7 Q 4.1220 8.4990 119.9163 57.2469 28.4545 176.1434 8 R 3.9523 7.5569 118.9383 58.5142 30.1773 176.4338 9 G 4.0989 9.0489 111.8133 45.4749 0.0000 174.2729 10 S 4.1377 7.8406 113.1855 58.9843 63.2570 174.2510 11 R 4.1991 7.9253 124.9819 56.8014 29.3520 176.2439 12 T 4.3068 7.6167 104.5899 61.2419 69.5331 174.3901 13 H 4.3068 8.3296 117.8530 56.2265 26.8116 175.4728 14 G 3.8980 8.3126 103.8583 46.2923 0.0000 174.8390 15 G 3.8593 8.5842 107.3495 45.1263 0.0000 176.1406 16 G 3.9646 7.7751 107.3972 45.2154 0.0000 174.8579 17 S 4.2435 8.5373 118.4118 58.3932 62.7133 174.6199 18 H 4.4333 8.7426 120.6471 57.4331 28.5547 175.9577 19 K 4.1237 8.2488 119.6241 56.8529 31.7272 177.4961 20 N 4.4176 7.7043 117.3461 55.8065 39.0956 177.5358 21 R 4.3521 7.4697 119.9541 55.9666 29.2300 177.2385 22 R 4.4256 7.7016 121.7982 56.2075 30.9159 180.1235 23 G 4.0109 8.6990 122.5655 45.5992 0.0000 173.4838 24 A 4.3282 8.5705 120.1524 53.5696 18.3914 179.9149 25 G 3.5773 8.0044 104.8054 47.8830 0.0000 175.1655 26 H 4.4565 7.9809 119.0511 57.9124 29.9645 176.3876 27 R 4.4941 7.7200 117.1924 54.9037 30.7763 175.7577 28 G 3.8529 8.5916 106.9122 47.2147 0.0000 173.7746 29 G 4.1271 7.8399 105.3929 43.5294 0.0000 174.4910 30 R 4.1277 8.6915 120.6059 56.3870 31.7003 176.2645 31 G 3.7700 8.5090 113.2545 47.1227 0.0000 174.2025 32 D 4.5843 8.6815 123.0294 54.4868 40.5627 175.4904 33 A 3.9938 7.3653 122.4881 54.1531 18.6852 178.6873 34 G 3.7859 9.0193 109.1884 45.8717 0.0000 175.3478 35 R 3.8468 7.7388 116.4736 57.5005 29.2307 177.2889 36 D 5.0345 7.8863 115.6948 52.5938 42.3275 176.0155 37 K 4.2465 8.6174 117.6356 57.1062 32.6892 176.7835 38 H 4.6084 9.5778 124.9869 58.0246 29.4593 176.3230 39 E 4.6883 7.6061 120.6655 55.6807 30.0689 177.9671 40 F 4.9240 8.1486 115.4999 59.2160 38.4544 175.0499 41 H 3.7452 5.6826 114.6773 57.4692 28.7321 174.5083 42 N 4.2559 8.8875 120.0903 54.7751 35.9630 173.6674 43 H 4.8724 7.8017 112.8612 53.4980 31.7113 173.9917 44 E 4.0620 8.9141 123.9111 55.7675 29.8773 175.2684 45 P 4.4611 0.0000 0.0000 62.7279 31.8768 175.9686 46 L 4.1598 8.0774 118.9452 54.8214 42.2786 176.1077 47 G 4.2514 8.0017 106.4476 43.4131 0.0000 172.9457 48 K 4.6077 7.9738 119.3629 54.9127 34.2925 176.4516 49 S 4.4039 8.4173 114.4114 58.1321 65.3748 175.6798 50 G 4.0806 8.8678 117.7553 45.3642 0.0000 170.8793 51 F 5.0368 8.6063 112.9455 55.5469 41.0696 173.2168 52 K 4.2649 8.2988 117.9544 54.7187 35.7107 176.2661 53 R 4.5818 7.9434 120.2317 53.6862 31.9002 174.8227 54 P 4.3071 0.0000 0.0000 63.1534 32.0861 176.9177 55 Q 3.9252 9.0745 121.2828 59.3138 28.6720 179.0074 56 K 4.2499 7.9976 112.5466 57.2763 32.4917 177.0417 57 V 4.3108 8.0117 117.4538 62.8743 31.9118 174.8231 58 Q 4.6028 7.7632 116.9359 54.3208 30.2579 174.7454 59 E 4.4782 8.5902 121.0346 54.4267 31.7870 174.8372 60 E 4.4181 8.4959 124.6938 54.3701 31.4915 174.2151 61 A 4.1648 8.2016 129.5426 50.6659 19.9023 176.2332 62 A 4.2512 8.8715 126.5824 51.8956 19.3624 176.6526 63 T 5.4946 8.1293 112.2755 60.0921 71.9307 173.7756 64 I 4.3434 7.7449 119.5320 60.4417 41.5322 173.1577 65 D 5.2072 8.5790 128.5652 53.3639 42.3808 177.6884 66 V 3.6292 8.5872 116.5609 64.8758 31.4789 178.7875 67 R 3.9003 7.7696 118.2292 59.6089 29.5329 178.1217 68 E 3.8753 7.9513 117.6777 59.4239 30.0143 178.3057 69 I 3.7557 7.7689 119.2655 64.5412 37.0654 177.3278 70 D 4.3187 8.5294 118.7454 57.7727 40.9205 178.5048 71 E 4.1938 8.3690 116.9309 58.1861 28.5506 177.0570 72 N 5.0563 8.0610 116.9610 52.9220 40.3469 177.4605 73 V 3.2600 7.6358 113.1824 64.7207 31.8085 179.0235 74 T 3.8616 7.5980 108.0149 64.7409 68.4938 175.5152 75 L 4.0832 7.1803 121.0004 56.6096 42.1535 177.3252 76 L 4.4603 7.5082 120.6088 53.5786 41.3161 178.1378 77 A 4.0197 8.0320 122.2572 55.2624 18.7416 178.0620 78 A 4.4909 7.7703 117.5137 52.2167 18.9852 177.1357 79 D 4.5814 8.2799 120.4491 56.2966 45.3398 175.8671 80 D 4.2256 7.5955 122.0122 49.2480 41.5163 175.3931 81 V 4.5389 8.3081 120.9230 61.2298 34.2233 174.7386 82 A 4.2656 8.1300 132.8291 51.7129 20.5107 176.5739 83 E 3.7984 8.9715 109.5459 59.3834 30.1335 173.8692 *89 F 4.6328 7.7563 114.2794 57.9428 41.0913 174.0817 90 R 5.1712 8.6591 120.1142 54.7133 32.3760 174.8956 91 V 4.4564 8.6842 126.0198 59.9271 34.9795 174.6983 92 D 4.7110 8.7877 124.4697 52.8000 40.4659 176.1983 93 V 3.7221 8.2927 127.9314 66.0759 31.6482 178.5632 94 R 3.9267 7.9707 117.6449 59.0303 29.9078 177.1466 95 D 4.6149 8.3483 115.6358 54.8218 41.4539 177.1280 96 V 4.0136 7.8462 119.0084 64.4134 32.4177 176.5120 97 V 3.6395 7.5639 118.1179 62.9747 31.6180 175.3817 98 E 4.2372 8.5691 125.9716 56.8692 30.1647 176.6006 99 E 4.2063 8.7456 117.1121 57.5208 26.8027 175.4502 100 A 4.4877 7.5112 119.5815 52.6920 18.7660 178.3108 101 D 4.7198 7.7986 116.7362 57.0213 42.2167 178.3412 102 D 4.5188 8.0362 114.6460 53.3566 39.1547 175.1811 103 A 4.7132 7.5805 123.0342 50.6374 20.7054 178.4581 104 D 4.4274 8.8772 122.9069 56.0925 41.7517 175.8541 105 Y 4.8467 6.4139 117.7456 56.7070 41.5428 172.4654 106 V 4.5992 8.7678 122.3309 61.9956 33.3498 174.5336 107 K 4.7373 9.5136 129.7282 54.5608 35.3019 174.6301 108 V 4.5288 8.4761 128.0017 61.9424 32.8315 174.8420 109 L 4.5400 9.2176 128.2822 52.7500 44.2476 176.8149 110 G 4.1757 8.2006 109.1026 45.1860 0.0000 173.2194 111 A 4.6160 8.3020 121.0033 51.8201 21.6992 178.4603 112 G 3.8291 8.9579 109.5874 44.4427 0.0000 172.0378 113 Q 4.5144 8.1653 117.2737 54.1359 31.1504 175.2932 114 V 4.3451 7.9820 117.4698 61.8592 33.0785 174.7685 115 R 4.4479 8.8727 125.4805 56.1229 30.2363 175.6186 116 H 5.0089 7.6642 113.7200 53.6847 32.6185 172.7007 117 E 4.8473 8.7387 118.8784 55.0749 30.0129 175.5775 118 L 5.1456 8.5711 124.3561 53.0645 45.7328 175.9867 119 T 4.9219 8.8760 119.0777 62.1247 70.9099 172.8076 120 L 5.2396 8.6946 127.4770 53.0707 44.4305 175.8405 121 I 5.5537 8.6596 124.2613 59.0718 39.4363 174.6461 122 A 4.8363 8.6718 127.4443 50.2931 21.9712 176.3481 123 D 4.4028 8.6934 118.8399 57.3638 42.2036 175.9591 124 D 4.6973 7.5496 115.9737 53.2490 45.0119 174.3451 125 F 5.5614 8.9972 120.8839 54.7833 43.4067 174.2961 126 S 4.6378 8.6289 115.4483 57.2406 65.4589 174.4494 127 E 4.0020 9.2078 119.7457 59.7926 29.1618 179.6354 128 G 3.9426 8.2127 104.4617 48.1428 0.0000 174.9437 129 A 4.0822 7.9535 122.9500 54.9991 18.3405 179.7907 130 R 3.7756 8.0897 116.3749 59.3481 30.1308 178.7150 131 E 3.9364 8.2837 118.1813 59.7999 29.5041 179.6434 132 K 3.9264 8.0471 117.8085 59.8036 32.2119 179.4002 133 V 3.6393 8.0204 118.1809 66.1413 31.2648 178.1059 134 E 4.7177 8.0605 120.0013 58.8232 29.3035 179.1397 135 G 3.9602 8.5337 104.4866 47.1562 0.0000 173.9321 136 A 4.7340 7.9669 122.1994 51.5397 20.9130 176.9024 137 G 4.0310 8.4487 106.6278 48.7363 0.0000 173.0639 138 G 4.9590 7.7457 104.2760 43.0914 0.0000 172.1032 139 S 5.0689 9.0949 113.1888 56.5043 67.0993 173.3732 140 V 4.4972 8.1025 119.7372 61.2198 33.6938 174.1941 141 E 4.5912 9.4913 128.5197 54.6876 31.5386 174.8717 142 L 5.0625 8.4275 126.8159 54.2254 43.3786 176.3387 143 T 4.1395 8.4888 122.7867 63.5934 69.6330 175.2019 144 D 4.4431 8.7471 121.7019 57.4956 41.0991 179.0639 145 L 3.9429 7.9949 120.0619 57.8405 42.4601 178.0976 146 G 3.8006 7.8510 106.8141 47.0800 0.0000 174.5690 147 E 4.4849 7.9758 120.0840 56.9895 29.2583 176.9523 148 E 4.7888 8.3582 114.8051 56.4608 30.0744 178.5043 149 R 4.5311 7.5769 116.6294 52.0924 30.7847 176.2285 150 Q 4.3125 7.9527 121.4267 56.8248 29.3432 173.1153 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 1 T 8.16 4.28 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 2 S 8.39 4.40 0.00 4.05 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 3 K 9.46 3.99 0.00 1.80 1.85 0.00 1.74 0.00 0.00 1.82 0.00 0.00 2.87 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.50 1.47 7.81 4 K 8.31 3.83 0.00 1.84 1.88 0.00 1.76 0.00 0.00 1.76 0.00 0.00 2.92 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.56 1.53 7.81 5 K 7.56 4.02 0.00 1.67 2.06 0.00 1.68 0.00 0.00 1.70 0.00 0.00 3.15 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.46 1.55 7.81 6 R 7.68 4.31 0.00 1.97 1.93 0.00 3.20 0.00 0.00 3.21 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.65 0.00 7 Q 8.50 4.12 0.00 1.92 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.76 6.94 0.00 0.00 0.00 0.00 0.00 2.59 2.49 0.00 8 R 7.56 3.95 0.00 1.79 1.91 0.00 3.35 0.00 0.00 3.26 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.59 0.00 9 G 9.05 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 0.00 0.00 0.00 10 S 7.84 4.14 0.00 3.98 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 11 R 7.93 4.20 0.00 1.99 2.12 0.00 3.21 0.00 0.00 3.27 7.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.61 0.00 12 T 7.62 4.31 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 1.32 0.00 0.00 13 H 8.33 4.31 0.00 3.17 3.39 0.00 5.73 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 G 8.31 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 15 G 8.58 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 0.00 0.00 0.00 16 G 7.78 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 0.00 0.00 0.00 17 S 8.54 4.24 0.00 3.87 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 18 H 8.74 4.43 0.00 3.31 3.39 0.00 5.57 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 K 8.25 4.12 0.00 1.66 1.80 0.00 1.68 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.30 1.34 7.81 20 N 7.70 4.42 0.00 2.82 2.64 0.00 0.00 6.93 7.61 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 21 R 7.47 4.35 0.00 1.77 1.89 0.00 3.16 0.00 0.00 3.23 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.63 0.00 22 R 7.70 4.43 0.00 1.73 1.03 0.00 3.15 0.00 0.00 3.20 7.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.52 0.00 23 G 8.70 4.01 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 0.00 0.00 0.00 24 A 8.57 4.33 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 25 G 8.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 H 7.98 4.46 0.00 3.05 3.51 0.00 5.92 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 R 7.72 4.49 0.00 2.04 1.92 0.00 3.38 0.00 0.00 3.23 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.67 0.00 28 G 8.59 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 29 G 7.84 4.13 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 0.00 30 R 8.69 4.13 0.00 1.91 1.81 0.00 3.38 0.00 0.00 3.35 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.69 0.00 31 G 8.51 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 0.00 0.00 0.00 0.00 32 D 8.68 4.58 0.00 2.74 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 33 A 7.37 3.99 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 34 G 9.02 3.79 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 0.00 0.00 0.00 35 R 7.74 3.85 0.00 1.70 2.03 0.00 2.74 0.00 0.00 3.18 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.61 0.00 36 D 7.89 5.03 0.00 2.74 2.75 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 37 K 8.62 4.25 0.00 1.80 1.73 0.00 1.76 0.00 0.00 1.78 0.00 0.00 2.99 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.39 1.53 7.81 38 H 9.58 4.61 0.00 3.31 3.45 0.00 5.46 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 E 7.61 4.69 0.00 1.91 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 2.23 2.00 0.00 40 F 8.15 4.92 0.00 3.20 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 41 H 5.68 3.75 0.00 2.95 3.05 0.00 5.81 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 N 8.89 4.26 0.00 2.82 2.86 0.00 0.00 6.85 8.16 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 43 H 7.80 4.87 0.00 3.32 3.21 0.00 5.87 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 E 8.91 4.06 0.00 1.98 1.92 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 2.34 2.33 0.00 45 P 0.00 4.46 0.00 2.18 2.09 0.00 3.79 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 2.01 2.02 0.00 46 L 8.08 4.16 0.00 1.66 1.64 0.91 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 47 G 8.00 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 0.00 0.00 0.00 0.00 48 K 7.97 4.61 0.00 1.76 1.75 0.00 1.78 0.00 0.00 1.65 0.00 0.00 3.00 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.37 1.40 7.81 49 S 8.42 4.40 0.00 3.79 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 50 G 8.87 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 51 F 8.61 5.04 0.00 3.14 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 52 K 8.30 4.26 0.00 1.66 1.58 0.00 1.71 0.00 0.00 1.66 0.00 0.00 2.76 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.23 1.39 7.81 53 R 7.94 4.58 0.00 1.71 1.84 0.00 3.27 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 1.66 1.29 0.00 54 P 0.00 4.31 0.00 2.22 2.21 0.00 3.77 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.03 0.00 55 Q 9.07 3.93 0.00 2.12 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.79 7.15 0.00 0.00 0.00 0.00 0.00 2.44 2.37 0.00 56 K 8.00 4.25 0.00 1.86 1.90 0.00 1.52 0.00 0.00 1.63 0.00 0.00 2.98 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.40 1.42 7.81 57 V 8.01 4.31 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 0.84 0.00 0.00 0.94 0.00 0.00 58 Q 7.76 4.60 0.00 2.27 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.53 6.37 0.00 0.00 0.00 0.00 0.00 2.27 2.46 0.00 59 E 8.59 4.48 0.00 1.92 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 2.51 2.27 0.00 60 E 8.50 4.42 0.00 1.95 1.71 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 2.17 2.20 0.00 61 A 8.20 4.16 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 A 8.87 4.25 1.20 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 63 T 8.13 5.49 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 1.22 0.00 0.00 64 I 7.74 4.34 1.85 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 1.33 1.17 0.88 0.00 0.00 65 D 8.58 5.21 0.00 2.74 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 66 V 8.59 3.63 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 0.86 0.00 0.00 1.00 0.00 0.00 67 R 7.77 3.90 0.00 1.84 2.08 0.00 3.09 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 68 E 7.95 3.88 0.00 2.01 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 0.00 2.31 2.34 0.00 69 I 7.77 3.76 2.02 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 1.52 0.47 0.90 0.00 0.00 70 D 8.53 4.32 0.00 2.85 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 71 E 8.37 4.19 0.00 1.93 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 2.34 2.63 0.00 72 N 8.06 5.06 0.00 2.66 2.69 0.00 0.00 6.85 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 73 V 7.64 3.26 0.69 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 0.51 0.00 0.00 0.32 0.00 0.00 74 T 7.60 3.86 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 1.18 0.00 0.00 75 L 7.18 4.08 0.00 1.80 1.76 0.99 0.95 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 76 L 7.51 4.46 0.00 1.88 1.64 0.89 0.61 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 77 A 8.03 4.02 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 78 A 7.77 4.49 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 79 D 8.28 4.58 0.00 2.71 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 80 D 7.60 4.23 0.00 3.01 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 81 V 8.31 4.54 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 0.35 0.00 0.00 0.95 0.00 0.00 82 A 8.13 4.27 1.14 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 0.00 0.00 83 E 8.97 3.80 0.00 1.99 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 2.24 1.95 0.00 *89 F 7.76 4.63 0.00 2.98 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 90 R 8.66 5.17 0.00 1.83 1.82 0.00 3.22 0.00 0.00 3.30 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.58 0.00 91 V 8.68 4.46 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 0.72 0.00 0.00 0.95 0.00 0.00 92 D 8.79 4.71 0.00 2.73 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 V 8.29 3.72 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 0.94 0.00 0.00 0.95 0.00 0.00 94 R 7.97 3.93 0.00 2.10 2.00 0.00 3.22 0.00 0.00 3.24 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.61 0.00 95 D 8.35 4.61 0.00 2.74 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 96 V 7.85 4.01 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 0.73 0.00 0.00 0.93 0.00 0.00 97 V 7.56 3.64 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 0.83 0.00 0.00 0.98 0.00 0.00 98 E 8.57 4.24 0.00 2.05 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 2.37 2.31 0.00 99 E 8.75 4.21 0.00 2.17 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 0.00 2.26 2.27 0.00 100 A 7.51 4.49 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 0.00 101 D 7.80 4.72 0.00 2.73 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 0.00 102 D 8.04 4.52 0.00 2.76 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 0.00 103 A 7.58 4.71 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 0.00 104 D 8.88 4.43 0.00 2.50 2.46 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 6.41 4.85 0.00 3.33 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 0.00 106 V 8.77 4.60 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 0.86 0.00 0.00 0.94 0.00 0.00 107 K 9.51 4.74 0.00 2.02 1.67 0.00 1.90 0.00 0.00 1.66 0.00 0.00 2.80 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.31 1.42 7.81 108 V 8.48 4.53 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 0.95 0.00 0.00 0.71 0.00 0.00 109 L 9.22 4.54 0.00 1.72 1.60 0.92 0.86 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 0.00 110 G 8.20 4.18 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 0.00 111 A 8.30 4.62 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 0.00 112 G 8.96 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 0.00 0.00 0.00 113 Q 8.17 4.51 0.00 2.02 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.04 6.77 0.00 0.00 0.00 0.00 0.00 2.27 2.31 0.00 114 V 7.98 4.35 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 0.98 0.00 0.00 0.95 0.00 0.00 115 R 8.87 4.45 0.00 1.63 1.80 0.00 3.11 0.00 0.00 3.18 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.52 0.00 116 H 7.66 5.01 0.00 3.20 3.31 0.00 5.64 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 E 8.74 4.85 0.00 2.02 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 0.00 2.32 2.29 0.00 118 L 8.57 5.15 0.00 1.65 1.64 1.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 119 T 8.88 4.92 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 1.24 0.00 0.00 120 L 8.69 5.24 0.00 1.88 1.87 1.06 0.71 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 0.00 121 I 8.66 5.55 1.94 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 1.18 0.97 0.97 0.00 0.00 122 A 8.67 4.84 0.45 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 0.00 123 D 8.69 4.40 0.00 2.83 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 0.00 124 D 7.55 4.70 0.00 2.42 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 0.00 0.00 0.00 0.00 125 F 9.00 5.56 0.00 2.81 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 0.00 126 S 8.63 4.64 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 0.00 127 E 9.21 4.00 0.00 2.05 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 0.00 2.42 2.42 0.00 128 G 8.21 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 A 7.95 4.08 1.53 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 0.00 0.00 130 R 8.09 3.78 0.00 2.03 1.93 0.00 3.14 0.00 0.00 3.08 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.59 0.00 131 E 8.28 3.94 0.00 2.01 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 0.00 2.34 2.39 0.00 132 K 8.05 3.93 0.00 1.89 1.88 0.00 1.70 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.47 1.67 7.81 133 V 8.02 3.64 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 1.11 0.00 0.00 1.04 0.00 0.00 134 E 8.06 4.72 0.00 2.13 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 2.40 2.33 0.00 135 G 8.53 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 0.00 0.00 0.00 136 A 7.97 4.73 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 0.00 137 G 8.45 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 0.00 138 G 7.75 4.96 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 0.00 0.00 0.00 139 S 9.09 5.07 0.00 3.78 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 0.00 140 V 8.10 4.50 1.62 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 -1.11 0.00 0.00 0.46 0.00 0.00 141 E 9.49 4.59 0.00 1.96 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 2.22 0.00 142 L 8.43 5.06 0.00 1.67 1.60 1.30 1.07 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 0.00 143 T 8.49 4.14 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 1.26 0.00 0.00 144 D 8.75 4.44 0.00 2.71 2.72 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 0.00 145 L 7.99 3.94 0.00 1.61 1.84 1.02 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 146 G 7.85 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 0.00 147 E 7.98 4.48 0.00 2.09 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 2.35 2.48 0.00 148 E 8.36 4.79 0.00 1.79 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 2.21 2.52 0.00 149 R 7.58 4.53 0.00 1.74 1.82 0.00 3.31 0.00 0.00 3.15 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.71 0.00 150 Q 7.95 4.31 0.00 2.01 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.65 0.00 0.00 0.00 0.00 0.00 2.09 2.12 0.00 * Residues marked with a * may have inaccurate shift predictions.