NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 T 4.2780 8.1593 117.3738 63.5586 69.6210 173.1066 2 S 4.5575 8.1397 120.0818 55.2140 65.9850 173.2450 3 K 3.8264 9.5008 122.2927 59.7815 32.6048 179.5516 4 K 3.8569 8.0848 117.9284 59.6778 31.8189 178.9248 5 K 3.9460 7.5184 117.4477 59.2132 32.0699 177.8921 6 R 4.3456 7.4805 115.1811 56.5781 30.5006 177.9234 7 Q 4.1368 8.1015 120.2442 57.4234 28.4440 176.0850 8 R 3.9986 7.6118 118.6773 58.9972 30.1239 176.4888 9 G 4.0809 9.0775 111.3057 45.3177 0.0000 173.8065 10 S 4.2414 8.1996 113.5449 58.1166 63.5432 174.1434 11 R 4.1079 7.8791 124.5438 57.4977 29.2327 176.5267 12 T 4.2855 7.6114 104.8733 61.3957 69.6137 174.2338 13 H 4.7309 8.4424 117.5316 56.0508 26.9169 175.6748 14 G 3.9055 8.4869 104.2919 45.9811 0.0000 174.9056 15 G 3.8869 8.3529 107.3850 45.0894 0.0000 175.9062 16 G 3.9623 7.7313 107.8234 45.2356 0.0000 175.2231 17 S 4.1815 8.6053 118.7525 58.4753 62.5673 174.4636 18 H 4.4308 8.8294 121.4570 57.1977 28.3862 175.8080 19 K 4.1018 7.7837 119.2989 56.9005 31.6413 177.3857 20 N 4.3966 7.5533 117.1010 55.5223 39.4285 177.0358 21 R 4.4309 7.4526 119.2619 56.6223 28.9205 177.0842 22 R 4.5305 7.3374 121.6498 56.2035 30.8687 180.3797 23 G 4.0846 8.5232 122.0056 45.6318 0.0000 173.4470 24 A 4.2599 8.6319 120.2866 54.4169 18.3340 180.0912 25 G 3.5522 8.0447 104.3730 47.8537 0.0000 175.0130 26 H 4.5029 8.0972 118.4770 57.8183 29.9350 176.3147 27 R 4.5443 7.6070 117.0760 55.0755 30.9470 175.4947 28 G 3.8742 8.6326 106.7346 47.1540 0.0000 173.8320 29 G 4.1751 7.9149 105.8997 43.3642 0.0000 174.7757 30 R 4.0394 8.7383 121.6055 56.8231 31.7725 176.0171 31 G 3.7467 8.2058 113.9145 47.5251 0.0000 173.5376 32 D 4.6975 8.7136 124.6972 53.7423 40.5599 175.4244 33 A 4.0118 7.5287 122.7689 54.1509 18.7448 178.8123 34 G 3.8045 9.0070 109.5573 45.7770 0.0000 175.1891 35 R 3.9256 7.7267 115.9172 57.4842 29.1878 177.1928 36 D 5.1152 7.8789 115.7168 52.6874 41.3906 175.2526 37 K 4.4222 8.9613 118.6692 57.2181 32.3844 178.0984 38 H 4.5152 9.8111 125.8229 58.3220 28.2993 176.0371 39 E 4.7162 7.4506 121.4456 55.7101 30.4246 178.0402 40 F 5.0369 8.3676 115.5816 59.3266 38.2439 175.4573 41 H 3.4600 5.6877 114.9839 57.4523 29.1684 174.7892 42 N 4.2260 8.8446 120.8936 54.7642 35.7591 173.7735 43 H 4.9227 7.7135 112.0598 53.6122 33.2923 174.0831 44 E 4.1717 8.6850 122.2291 55.5819 29.9926 175.4236 45 P 4.4757 0.0000 0.0000 62.2058 32.1912 176.3483 46 L 4.0367 8.2579 120.2426 55.5215 42.1352 175.8211 47 G 4.1945 8.1363 105.7109 43.7073 0.0000 173.3464 48 K 4.5761 8.1859 119.1463 54.6707 34.0868 176.6140 49 S 4.3570 8.1372 115.8808 57.6504 65.0361 175.1170 50 G 4.0372 9.0040 118.6984 45.1729 0.0000 171.2519 51 F 5.0301 8.3040 113.0000 55.3844 41.1773 173.3221 52 K 4.3798 8.4222 118.9038 54.4930 35.1869 176.2373 53 R 4.6059 8.1408 120.8723 53.7250 31.8117 174.7068 54 P 4.2072 0.0000 0.0000 63.5210 31.8537 176.6767 55 Q 3.9242 9.1457 122.0424 59.1814 28.6693 179.0937 56 K 4.3013 8.0187 112.3514 57.5115 32.6386 177.1163 57 V 4.2447 8.0494 118.2928 62.8295 32.0874 174.9235 58 Q 4.4967 7.7588 117.8047 55.2364 29.8024 174.8088 59 E 4.6367 8.5918 122.0351 54.7908 31.2992 174.9011 60 E 4.5281 8.4615 123.3455 54.2857 32.0894 174.2878 61 A 4.0593 8.3459 128.9173 50.8480 20.2554 176.0072 62 A 4.4871 8.4681 124.5530 50.9179 20.2587 176.5785 63 T 5.5340 8.1943 112.0385 59.6607 72.1782 173.3340 64 I 4.4791 7.8195 120.1944 60.1431 41.6540 172.9154 65 D 5.1756 8.6014 128.0477 53.3842 42.3412 177.8053 66 V 3.6108 8.6821 116.0431 64.8221 31.5620 178.7606 67 R 3.8583 7.8126 118.0867 59.6777 29.5164 178.1474 68 E 3.8786 8.0025 117.7560 59.6634 30.0282 178.2653 69 I 3.6868 7.7857 119.3662 64.3754 36.9436 177.2904 70 D 4.3878 8.3869 119.4627 57.9260 41.2078 178.5959 71 E 4.2434 8.0791 116.8810 57.9776 29.5992 177.1832 72 N 4.9861 8.2696 115.9793 52.3959 40.1439 176.4737 73 V 3.2682 7.9476 114.1788 64.6402 31.1387 178.2014 74 T 3.8049 7.3930 108.5491 64.9801 68.6982 176.3307 75 L 3.9596 7.8657 120.6678 56.6261 42.5229 178.2026 76 L 4.4062 7.9881 120.5056 53.9172 40.0240 178.2051 77 A 4.0020 7.5783 121.1346 54.7494 18.9262 178.2068 78 A 4.5195 7.7671 117.7904 52.1136 19.0489 177.1511 79 D 4.3462 8.1330 120.4897 56.0539 44.1753 176.2959 80 D 4.1308 7.4400 122.1754 53.4621 39.2098 177.0416 81 V 4.6990 8.0944 126.0835 61.3185 31.7367 175.3153 82 A 3.8711 8.5070 121.5707 53.5519 19.0916 178.5584 83 E 3.3069 7.9900 115.2961 57.0338 31.9853 175.9622 *89 F 4.5453 7.3541 118.6491 57.0872 41.2549 173.7774 90 R 5.1851 8.7284 119.0861 54.9318 32.4097 174.8076 91 V 4.4877 8.8551 125.5285 60.0373 35.3981 174.5383 92 D 4.9042 8.7248 123.4352 52.8929 40.9024 176.5864 93 V 3.5497 8.4451 126.4133 65.9908 31.7720 178.4313 94 R 3.4491 7.5005 116.2399 59.2918 29.9339 177.0219 95 D 4.6622 8.4078 115.0200 54.5006 41.4765 177.0844 96 V 3.9290 8.4486 120.0381 64.1976 32.4653 176.1303 97 V 3.6143 7.5722 119.7642 62.4910 30.9273 175.2566 98 E 4.1413 8.5988 127.1118 56.6714 30.0430 176.5002 99 E 4.2470 8.5649 115.1975 57.6740 26.8815 175.5629 100 A 4.3595 7.3237 119.6897 52.5453 18.8724 179.2209 101 D 4.4034 7.3101 117.1532 56.9440 41.4286 176.9033 102 D 4.7293 7.8079 117.7752 53.7131 39.7675 176.4793 103 A 4.1783 7.3352 122.7506 52.2108 18.9921 178.1017 104 D 4.5117 8.5656 120.3697 54.8763 41.8445 176.1002 105 Y 4.9152 6.6673 120.4739 57.2432 40.0071 171.4500 106 V 4.7139 8.7459 121.6184 61.3319 33.8211 174.4189 107 K 4.8112 8.9734 128.7794 54.5730 35.4612 174.6384 108 V 4.5266 8.4252 127.6025 61.8099 33.1021 174.7300 109 L 4.7321 9.3770 128.3248 52.4599 44.6680 176.6939 110 G 4.2867 8.2556 107.6420 45.6520 0.0000 173.9963 111 A 4.5317 7.8636 121.8317 51.6434 20.6363 177.7301 112 G 3.9856 8.8376 109.2815 44.5643 0.0000 172.2078 113 Q 4.4281 8.1327 117.5698 54.4081 30.6511 175.7450 114 V 4.4061 7.9173 117.3949 61.9282 32.5886 175.0680 115 R 4.6663 9.2124 130.4700 55.6110 30.5641 176.1562 116 H 4.9161 7.8509 112.1294 54.9010 33.2937 174.1505 117 E 4.6597 8.8356 119.0216 54.8875 29.8841 175.1566 118 L 5.0802 8.4416 125.0030 53.3871 45.2007 176.0834 119 T 4.7745 9.0233 119.4707 62.0374 70.7184 172.5519 120 L 5.1969 8.5177 126.5856 53.2267 44.3016 175.9448 121 I 5.6870 8.9040 123.6360 59.0439 39.8657 174.5659 122 A 4.9818 8.7196 127.4548 50.6690 22.9187 175.9619 123 D 4.7196 8.6739 117.8423 56.9799 42.1151 176.4277 124 D 4.9546 7.3533 115.9282 53.4128 44.5938 174.2573 125 F 5.1809 8.6339 121.0927 54.9690 43.3355 175.3209 126 S 4.6198 8.3452 119.1270 57.2906 65.5945 175.1638 127 E 4.0271 8.7365 122.5691 59.7077 29.5043 179.3025 128 G 3.6806 8.1607 104.5852 47.3672 0.0000 175.4016 129 A 4.0994 7.8057 123.1643 55.3864 18.3477 179.5752 130 R 3.7964 8.0554 116.1641 59.2048 30.1066 178.8302 131 E 3.8983 8.1802 117.7920 59.7865 29.4067 179.9553 132 K 3.9305 7.7275 116.5596 59.5368 32.5668 179.3432 133 V 3.7592 7.7096 118.0641 66.0920 31.5040 177.9578 134 E 4.8797 8.0075 120.1682 58.9090 29.1670 179.1172 135 G 3.9364 8.3346 101.9624 45.6250 0.0000 173.4748 136 A 4.6390 7.6446 123.4245 51.4151 19.6686 176.7237 137 G 3.5801 8.3181 104.8105 48.1968 0.0000 173.5212 138 G 4.4595 7.6852 104.7664 44.2349 0.0000 171.9653 139 S 5.0767 8.8073 113.1134 56.3140 66.9917 173.5236 140 V 4.3357 8.0856 119.6778 61.2351 33.7352 174.3060 141 E 4.4715 9.3191 129.0485 54.8282 31.1818 175.1572 142 L 5.0605 8.4564 127.5177 54.3486 43.1572 176.4218 143 T 4.0471 9.1375 123.9215 63.9780 69.5836 175.2046 144 D 4.9787 8.7656 121.4489 57.2024 41.2003 178.8877 145 L 3.8922 8.2582 120.6474 58.1703 41.8074 178.9919 146 G 4.1723 7.5471 106.3478 47.5254 0.0000 173.1071 147 E 4.7800 8.2361 121.2496 56.5035 29.3471 178.0580 148 E 4.2385 7.4305 119.4118 57.6965 30.9202 178.0077 149 R 3.7957 6.8828 116.3260 57.9772 30.7889 176.2325 150 Q 4.1895 8.7764 120.4713 56.4072 29.5597 172.9150 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 1.20 0.00 0.00 2 S 8.14 4.56 0.00 4.06 3.97 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 3 K 9.50 3.83 0.00 1.83 1.86 0.00 1.73 0.00 0.00 1.81 0.00 0.00 2.95 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.50 1.54 7.81 4 K 8.08 3.86 0.00 1.83 1.86 0.00 1.74 0.00 0.00 1.75 0.00 0.00 2.92 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.55 1.52 7.81 5 K 7.52 3.95 0.00 1.73 2.01 0.00 1.67 0.00 0.00 1.70 0.00 0.00 3.13 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.53 7.81 6 R 7.48 4.35 0.00 1.83 1.92 0.00 3.20 0.00 0.00 3.21 7.51 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 8.10 4.14 0.00 1.95 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.64 6.91 0.00 0.00 0.00 0.00 0.00 2.56 2.44 0.00 8 R 7.61 4.00 0.00 1.79 1.93 0.00 3.35 0.00 0.00 3.27 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.60 0.00 9 G 9.08 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 10 S 8.20 4.24 0.00 3.95 3.97 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 11 R 7.88 4.11 0.00 1.97 2.07 0.00 3.21 0.00 0.00 3.27 7.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.60 0.00 12 T 7.61 4.29 4.33 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 1.31 0.00 0.00 13 H 8.44 4.73 0.00 3.28 3.39 0.00 5.70 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 8.49 3.91 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 0.00 0.00 0.00 15 G 8.35 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 16 G 7.73 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 8.61 4.18 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 8.83 4.43 0.00 3.31 3.39 0.00 5.57 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 K 7.78 4.10 0.00 1.73 1.80 0.00 1.68 0.00 0.00 1.68 0.00 0.00 2.98 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.31 1.34 7.81 20 N 7.55 4.40 0.00 2.82 2.55 0.00 0.00 6.93 7.12 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 21 R 7.45 4.43 0.00 1.78 1.91 0.00 3.18 0.00 0.00 3.24 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.66 0.00 22 R 7.34 4.53 0.00 1.75 0.87 0.00 3.22 0.00 0.00 3.20 7.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.52 0.00 23 G 8.52 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 24 A 8.63 4.26 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 8.04 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 0.00 0.00 0.00 26 H 8.10 4.50 0.00 3.18 3.51 0.00 5.91 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 27 R 7.61 4.54 0.00 1.88 1.89 0.00 3.37 0.00 0.00 3.22 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.65 0.00 28 G 8.63 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 0.00 0.00 0.00 29 G 7.91 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 30 R 8.74 4.04 0.00 1.91 1.82 0.00 3.39 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 1.70 1.69 0.00 31 G 8.21 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 32 D 8.71 4.70 0.00 2.74 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 33 A 7.53 4.01 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 34 G 9.01 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 35 R 7.73 3.93 0.00 1.63 1.99 0.00 2.74 0.00 0.00 3.17 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.62 0.00 36 D 7.88 5.12 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 37 K 8.96 4.42 0.00 1.80 1.53 0.00 1.72 0.00 0.00 1.73 0.00 0.00 2.98 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.36 1.51 7.81 38 H 9.81 4.52 0.00 3.31 3.45 0.00 5.47 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 E 7.45 4.72 0.00 2.07 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 2.18 2.01 0.00 40 F 8.37 5.04 0.00 3.06 3.14 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 41 H 5.69 3.46 0.00 2.87 3.07 0.00 5.81 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 N 8.84 4.23 0.00 2.80 2.82 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 7.71 4.92 0.00 3.34 3.18 0.00 5.90 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 E 8.68 4.17 0.00 1.98 1.90 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 2.32 2.25 0.00 45 P 0.00 4.48 0.00 2.19 2.07 0.00 3.80 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 2.00 2.00 0.00 46 L 8.26 4.04 0.00 1.66 1.66 0.91 0.95 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 47 G 8.14 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 48 K 8.19 4.58 0.00 1.76 1.75 0.00 1.73 0.00 0.00 1.65 0.00 0.00 3.00 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.37 1.41 7.81 49 S 8.14 4.36 0.00 3.77 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 50 G 9.00 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 51 F 8.30 5.03 0.00 3.13 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 52 K 8.42 4.38 0.00 1.71 1.66 0.00 1.72 0.00 0.00 1.67 0.00 0.00 2.75 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.23 1.36 7.81 53 R 8.14 4.61 0.00 1.79 1.89 0.00 3.34 0.00 0.00 3.29 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.56 0.00 54 P 0.00 4.21 0.00 2.23 2.25 0.00 3.80 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.06 0.00 55 Q 9.15 3.92 0.00 2.13 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.79 7.10 0.00 0.00 0.00 0.00 0.00 2.45 2.39 0.00 56 K 8.02 4.30 0.00 1.87 1.92 0.00 1.54 0.00 0.00 1.64 0.00 0.00 2.99 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.41 1.43 7.81 57 V 8.05 4.24 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 0.85 0.00 0.00 0.95 0.00 0.00 58 Q 7.76 4.50 0.00 2.23 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.83 6.41 0.00 0.00 0.00 0.00 0.00 2.32 2.52 0.00 59 E 8.59 4.64 0.00 2.02 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 2.74 2.33 0.00 60 E 8.46 4.53 0.00 1.94 1.69 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 2.14 2.18 0.00 61 A 8.35 4.06 0.74 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 0.00 0.00 62 A 8.47 4.49 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 63 T 8.19 5.53 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 64 I 7.82 4.48 1.84 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 1.33 1.24 0.87 0.00 0.00 65 D 8.60 5.18 0.00 2.64 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 66 V 8.68 3.61 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 0.90 0.00 0.00 1.00 0.00 0.00 67 R 7.81 3.86 0.00 1.97 1.99 0.00 3.09 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 68 E 8.00 3.88 0.00 2.00 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 2.30 2.33 0.00 69 I 7.79 3.69 2.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.38 0.89 0.00 0.00 70 D 8.39 4.39 0.00 2.73 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 71 E 8.08 4.24 0.00 2.13 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 2.58 0.00 72 N 8.27 4.99 0.00 2.57 2.68 0.00 0.00 6.82 7.62 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 73 V 7.95 3.27 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 0.00 0.00 0.56 0.00 0.00 0.34 0.00 0.00 74 T 7.39 3.80 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 1.19 0.00 0.00 75 L 7.87 3.96 0.00 1.69 1.77 1.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 76 L 7.99 4.41 0.00 1.71 1.75 0.85 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 77 A 7.58 4.00 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 78 A 7.77 4.52 1.27 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 0.00 0.00 0.00 79 D 8.13 4.35 0.00 2.70 2.58 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 80 D 7.44 4.13 0.00 3.14 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 81 V 8.09 4.70 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 0.68 0.00 0.00 1.09 0.00 0.00 82 A 8.51 3.87 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 E 7.99 3.31 0.00 2.11 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 2.20 2.29 0.00 *89 F 7.35 4.55 0.00 3.03 3.30 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 90 R 8.73 5.19 0.00 1.85 1.82 0.00 3.23 0.00 0.00 3.31 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.58 0.00 91 V 8.86 4.49 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 0.70 0.00 0.00 0.94 0.00 0.00 92 D 8.72 4.90 0.00 2.78 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 93 V 8.45 3.55 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 0.85 0.00 0.00 0.97 0.00 0.00 94 R 7.50 3.45 0.00 2.10 2.03 0.00 3.22 0.00 0.00 3.24 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.65 0.00 95 D 8.41 4.66 0.00 2.69 2.70 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 96 V 8.45 3.93 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 0.72 0.00 0.00 0.92 0.00 0.00 97 V 7.57 3.61 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 0.81 0.00 0.00 0.95 0.00 0.00 98 E 8.60 4.14 0.00 2.05 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 2.38 2.31 0.00 99 E 8.56 4.25 0.00 2.06 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 2.19 2.26 0.00 100 A 7.32 4.36 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 0.00 101 D 7.31 4.40 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 0.00 102 D 7.81 4.73 0.00 2.76 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 0.00 103 A 7.34 4.18 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 0.00 104 D 8.57 4.51 0.00 2.67 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 0.00 105 Y 6.67 4.92 0.00 3.14 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 0.00 106 V 8.75 4.71 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 0.85 0.00 0.00 0.91 0.00 0.00 107 K 8.97 4.81 0.00 2.03 1.64 0.00 1.91 0.00 0.00 1.65 0.00 0.00 2.81 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.30 1.41 7.81 108 V 8.43 4.53 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 1.02 0.00 0.00 0.72 0.00 0.00 109 L 9.38 4.73 0.00 1.76 1.55 0.92 -0.05 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 8.26 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 0.00 0.00 0.00 0.00 111 A 7.86 4.53 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 0.00 112 G 8.84 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 0.00 113 Q 8.13 4.43 0.00 2.06 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.99 6.89 0.00 0.00 0.00 0.00 0.00 2.30 2.33 0.00 114 V 7.92 4.41 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 1.01 0.00 0.00 0.97 0.00 0.00 115 R 9.21 4.67 0.00 1.77 1.87 0.00 3.27 0.00 0.00 3.22 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.59 0.00 116 H 7.85 4.92 0.00 3.21 3.39 0.00 5.69 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 E 8.84 4.66 0.00 2.09 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 0.00 2.24 2.18 0.00 118 L 8.44 5.08 0.00 1.67 1.67 1.02 0.75 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 0.00 119 T 9.02 4.77 4.28 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 1.24 0.00 0.00 120 L 8.52 5.20 0.00 1.89 1.85 1.08 0.59 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 0.00 121 I 8.90 5.69 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 1.44 0.98 0.00 0.00 122 A 8.72 4.98 0.66 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 0.00 123 D 8.67 4.72 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 0.00 124 D 7.35 4.95 0.00 2.60 2.41 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 0.00 125 F 8.63 5.18 0.00 2.97 2.93 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 0.00 126 S 8.35 4.62 0.00 4.04 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 8.74 4.03 0.00 2.08 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 2.53 2.40 0.00 128 G 8.16 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 0.00 0.00 0.00 129 A 7.81 4.10 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.06 3.80 0.00 2.08 1.93 0.00 3.19 0.00 0.00 3.14 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.55 0.00 131 E 8.18 3.90 0.00 2.19 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 2.35 2.62 0.00 132 K 7.73 3.93 0.00 1.79 1.91 0.00 1.73 0.00 0.00 1.74 0.00 0.00 3.06 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.50 1.68 7.81 133 V 7.71 3.76 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 1.09 0.00 0.00 1.07 0.00 0.00 134 E 8.01 4.88 0.00 2.01 1.96 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 2.28 2.32 0.00 135 G 8.33 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 0.00 136 A 7.64 4.64 1.47 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 0.00 0.00 137 G 8.32 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 0.00 138 G 7.69 4.46 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 0.00 0.00 0.00 139 S 8.81 5.08 0.00 3.82 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 0.00 140 V 8.09 4.34 1.67 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 -1.02 0.00 0.00 0.58 0.00 0.00 141 E 9.32 4.47 0.00 1.95 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 8.46 5.06 0.00 1.68 1.62 1.28 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 143 T 9.14 4.05 4.42 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 1.27 0.00 0.00 144 D 8.77 4.98 0.00 2.72 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 8.26 3.89 0.00 1.69 1.85 1.02 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 146 G 7.55 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 0.00 0.00 0.00 0.00 147 E 8.24 4.78 0.00 2.20 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 2.32 2.60 0.00 148 E 7.43 4.24 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 2.20 2.43 0.00 149 R 6.88 3.80 0.00 1.64 1.90 0.00 3.30 0.00 0.00 3.15 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.75 0.00 150 Q 8.78 4.19 0.00 2.06 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.90 6.65 0.00 0.00 0.00 0.00 0.00 2.17 2.25 0.00 * Residues marked with a * may have inaccurate shift predictions.