NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 8 Q 4.2428 8.3401 121.7114 55.9033 30.0636 174.1525 9 A 4.6278 8.2468 127.5234 47.3162 21.9647 173.0299 10 P 4.3773 0.0000 0.0000 62.4238 32.6311 174.4290 11 I 3.9172 7.9613 112.7014 60.2917 38.2761 175.0376 12 A 4.1499 8.2847 123.1647 51.5638 18.7799 177.2200 13 A 4.1898 8.4495 126.2074 51.8300 19.1291 177.0316 14 Y 4.3701 8.5556 123.8980 57.5501 39.5280 175.8535 15 K 4.2623 6.9571 122.9603 53.3176 33.6692 174.2379 16 P 4.2084 0.0000 0.0000 63.0605 31.7397 176.9435 17 R 4.5214 8.3952 119.2413 56.1716 31.7953 175.9846 18 S 4.6205 7.5342 110.5232 56.7408 65.7368 173.0104 19 N 5.1537 8.5930 119.8204 52.8276 39.0249 174.3340 20 E 4.7948 9.1239 120.5773 55.4220 33.6157 174.0164 21 I 4.8696 8.3642 121.4076 59.6193 39.9181 174.9183 22 L 4.6971 9.0748 128.1084 53.0186 43.2710 175.5985 23 W 5.3245 9.0268 124.6137 55.7369 30.8304 176.3951 24 D 4.8963 8.8442 124.0932 51.9214 41.5107 177.2459 25 G 3.6523 8.9027 106.2765 47.6373 0.0000 173.6291 26 Y 4.4094 9.3320 117.4679 57.4601 38.4257 176.2351 27 G 4.0343 8.4771 108.0181 45.9698 0.0000 173.3452 28 V 4.3354 8.2218 120.2340 60.8977 32.9036 172.9530 29 P 4.0156 0.0000 0.0000 62.1927 32.6797 175.4524 30 H 4.4569 8.5172 121.0982 54.1311 30.2387 172.9124 31 I 4.5482 7.7836 124.4036 60.3553 38.1686 174.9007 32 Y 4.6151 9.2526 126.2649 56.1183 40.0078 175.3838 33 G 4.6409 8.6512 110.5762 44.4619 0.0000 173.2453 34 V 3.9781 9.2684 115.3824 62.8676 32.2747 176.0926 35 D 4.6870 7.6049 118.5490 50.8660 43.2397 175.7732 36 A 4.1476 8.5676 120.5290 55.1051 18.3396 177.6652 37 P 4.2854 0.0000 0.0000 66.1132 31.3159 178.8880 38 S 4.2207 9.0794 113.8432 61.5746 62.6760 176.6551 39 A 4.0578 8.1028 122.9671 55.3835 18.1017 179.7454 40 F 4.1868 8.9659 116.6180 60.7483 38.9134 177.2856 41 Y 4.4209 8.9798 119.9029 60.8733 38.6784 178.4693 42 G 3.7233 8.8131 107.0140 48.0019 0.0000 175.0326 43 Y 4.5809 8.6224 122.2890 60.4756 38.7489 178.3701 44 G 2.5692 8.4459 106.9774 46.9642 0.0000 175.4355 45 W 4.0058 8.1651 130.8602 60.0652 30.7827 177.6751 46 A 4.5381 8.7129 121.0322 55.7161 17.8691 179.5860 47 Q 3.9348 8.3278 116.4121 59.0419 28.7435 179.0263 48 A 3.7021 7.8179 121.8629 55.0252 18.1134 179.7217 49 R 2.6966 6.9441 116.0771 58.9412 30.0925 178.4125 50 S 4.3628 7.8117 113.9512 60.4847 63.4142 174.7588 51 H 4.8960 8.7183 118.2545 54.2894 30.5940 175.6687 52 G 3.6571 8.2546 109.0201 48.1495 0.0000 175.4851 53 D 4.3101 7.9653 120.6827 57.4182 40.8821 178.7741 54 N 4.3218 7.9843 116.0960 55.9830 38.5357 177.6379 55 I 3.4969 7.6621 121.4845 64.2362 37.1408 178.3252 56 L 3.8838 7.7763 119.8244 57.7248 41.4114 179.6204 57 R 3.8085 7.8629 118.5435 59.3479 29.9074 178.4992 58 L 4.1250 8.1023 118.9263 58.2740 41.4368 179.2038 59 Y 4.4579 8.5587 116.0062 60.9673 38.0979 178.6356 60 G 4.2466 8.7438 106.9824 48.0892 0.0000 175.6569 61 E 4.2093 8.8347 121.2011 59.1239 29.3659 179.2335 62 A 4.3720 8.2969 119.3008 54.4292 18.4999 178.9683 63 R 4.1989 7.7128 114.7103 56.4098 30.4129 177.4615 64 G 3.8614 8.3370 107.2256 45.7822 0.0000 173.9437 65 K 4.1912 7.5882 116.8148 55.6618 32.7450 178.5685 66 G 3.7621 8.1752 108.6468 47.9926 0.0000 176.0680 67 A 4.2971 8.2126 123.5155 54.7712 18.1643 179.3710 68 E 3.7484 7.7149 116.3212 59.5740 29.8566 178.2699 69 Y 4.1743 7.1839 115.5278 59.9555 37.9250 177.1929 70 W 4.8081 8.0349 115.7348 56.9661 30.9234 176.4597 71 G 3.9288 8.6312 107.1593 44.0344 0.0000 171.7720 72 P 4.2658 0.0000 0.0000 66.1312 31.0914 178.0247 73 D 4.4834 8.3332 114.5437 56.2687 41.1388 177.0011 74 Y 4.6293 8.3566 116.2938 57.4585 38.8782 176.9806 75 E 4.0450 8.4432 122.5008 59.3414 29.7962 178.5809 76 Q 4.0337 8.0904 117.6731 59.4287 28.7949 178.8928 77 T 4.0693 7.9352 116.1952 66.7786 68.4573 176.7603 78 T 3.8873 7.8596 117.3052 66.7673 68.5271 176.8054 79 V 3.5905 8.1402 120.3695 65.6719 31.3906 177.8895 80 W 4.2429 8.4025 128.1470 60.5746 30.6074 178.0830 81 L 3.5804 8.4415 119.3911 57.3395 41.0656 179.5077 82 L 3.8523 8.1188 119.3544 58.1546 41.3957 179.7082 83 T 3.7772 7.7061 114.2670 66.3526 68.4659 174.9015 84 N 4.2731 7.4287 116.3692 52.1705 38.4939 175.1013 85 G 3.8471 7.8741 106.4452 46.3830 0.0000 176.5485 86 V 3.2769 7.4227 119.8191 65.1863 31.2900 175.7254 87 P 4.1645 0.0000 0.0000 65.7879 31.2042 178.4724 88 E 3.9083 7.9293 116.6490 59.4138 29.4439 179.2861 89 R 3.7770 8.0932 118.5183 58.9036 29.9091 178.4363 90 A 3.8495 7.8900 120.9746 55.1659 18.3760 179.5840 91 Q 4.0270 7.7777 116.4596 59.0700 28.5358 178.8651 92 Q 4.0536 7.8521 119.6290 59.1535 29.4149 178.0295 93 W 4.5000 9.0229 120.4250 59.8813 29.0921 177.8885 94 Y 4.1835 8.7636 119.8658 60.7763 38.0696 178.0676 95 A 4.0344 8.1768 120.3217 54.4691 18.5651 178.5859 96 Q 4.2674 7.5127 114.0952 55.4920 29.3973 176.3189 97 Q 4.1889 7.0162 119.4658 55.2896 29.5659 176.9215 98 S 4.3371 8.3286 115.3590 57.5416 65.2362 173.4868 99 P 4.1801 0.0000 0.0000 66.1235 31.2135 178.6669 100 D 4.3497 8.0656 116.9484 57.4927 40.7295 178.5879 101 F 3.9085 8.2340 120.8262 60.7797 39.3433 177.3332 102 R 3.7524 8.3416 118.8245 59.0691 29.7215 178.2927 103 A 4.0089 7.9664 120.7191 55.1757 18.3749 179.3956 104 N 3.8694 7.4565 114.4446 56.1711 38.3524 177.6840 105 L 3.9704 7.5126 120.4659 57.8624 41.6650 179.3475 106 D 4.4898 8.7041 119.0685 57.3085 40.6922 178.6424 107 A 4.2380 8.4811 121.7143 55.1469 18.5391 179.3549 108 F 4.4383 8.6805 118.9508 61.6003 39.5396 177.2039 109 A 4.0961 8.4473 120.1183 55.2669 18.2503 179.4476 110 A 4.1995 8.7559 119.8813 55.1861 18.4145 180.0896 111 G 2.8901 8.3081 104.6673 47.7840 0.0000 176.0287 112 I 3.5135 7.3549 122.0603 63.9941 36.9991 178.3541 113 N 4.2979 8.2736 117.0596 56.1750 38.3161 177.1908 114 A 4.1064 8.5263 122.5480 55.4087 18.4562 178.8877 115 Y 2.4014 7.6705 117.5735 60.4533 38.5068 178.3843 116 A 3.6903 7.4712 119.6877 54.9963 18.4499 179.0958 117 Q 3.9704 7.9526 117.8999 59.3014 29.2509 177.9075 118 Q 4.2400 7.9436 117.8494 57.0064 30.5083 175.8942 119 N 4.8637 7.7161 117.0182 50.8331 38.9217 173.6430 120 P 4.2365 0.0000 0.0000 65.3019 31.9965 178.1551 121 D 4.3036 7.8613 116.3771 55.2478 41.4131 175.9114 122 D 4.6504 7.8154 116.9197 54.8810 41.5117 176.1674 123 I 4.1726 6.9314 121.1843 59.4923 38.1830 175.7127 124 S 4.1223 9.1131 120.7353 58.0818 63.1834 172.9343 125 P 4.2082 0.0000 0.0000 65.8530 31.0921 178.0736 126 E 4.3019 8.2076 112.0940 57.6198 29.8519 177.5695 127 V 4.4949 7.7189 118.4760 63.1401 32.5311 177.1005 128 R 3.9277 7.8630 117.6045 59.8153 29.6985 178.4106 129 Q 3.9363 7.8632 115.7620 58.6109 28.3689 178.3515 130 V 3.5595 7.2477 119.8241 64.5178 32.0497 176.4799 131 L 4.0948 7.2438 118.1754 54.2471 42.0569 174.8992 132 P 4.8132 0.0000 0.0000 61.8267 32.8720 175.8888 133 V 4.4010 8.6763 114.2098 60.5346 33.1143 175.3191 134 S 4.8419 9.3716 115.8327 55.4894 66.2590 175.3031 135 G 3.8051 8.6461 106.5257 48.0731 0.0000 175.6391 136 A 3.8508 6.8487 122.4558 54.9551 18.2935 179.4339 137 D 4.2237 7.8239 117.4562 57.3012 40.6834 179.1635 138 V 3.2431 7.4256 118.2715 65.9032 31.5512 178.1540 139 V 3.7351 7.8866 117.7837 65.8588 31.3344 177.6945 140 A 3.9757 8.4882 120.9622 55.5656 18.1297 179.1251 141 H 4.1446 8.2741 116.3894 59.3970 29.7391 177.3566 142 A 4.0526 7.7242 121.4611 55.4232 18.2823 178.7963 143 H 4.5685 8.5076 116.3188 59.3188 30.2378 177.2915 144 R 4.1862 8.3265 120.7741 59.3271 30.0689 178.0264 145 L 4.0037 8.0436 117.2468 57.1594 41.8344 177.7662 *147 N 4.5468 8.0158 115.6490 53.1462 40.3798 175.6221 148 F 5.9896 8.1872 113.9046 56.4574 39.6842 175.6307 149 L 4.6789 8.0921 119.1929 56.9227 44.7403 177.6586 150 Y 4.1401 8.0905 114.5505 61.1303 37.9996 177.5943 151 V 3.5647 7.8554 117.8328 64.8855 32.2075 175.9574 152 A 4.6614 8.4080 129.7923 50.3614 19.4808 175.5424 153 S 4.8918 8.2945 117.6183 57.3768 66.1740 173.3794 154 P 2.9700 0.0000 0.0000 65.1905 30.7594 179.0284 155 G 3.4584 7.5829 105.0752 47.8018 0.0000 175.8141 156 R 3.9926 7.4802 119.1392 58.8455 30.0683 179.1781 157 T 4.1694 7.3554 114.8127 66.6457 67.5334 176.9387 158 L 4.2086 8.2807 120.5531 55.5093 41.2699 178.8575 159 G 3.7886 7.7190 106.4560 45.9665 0.0000 173.6575 160 E 4.1105 7.4696 123.2316 56.3506 29.4591 176.6163 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 8 Q 8.34 4.24 0.00 2.01 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.70 0.00 0.00 0.00 0.00 0.00 2.24 2.43 0.00 9 A 8.25 4.63 1.23 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 10 P 0.00 4.38 0.00 2.20 2.09 0.00 3.78 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 2.00 1.97 0.00 11 I 7.96 3.92 1.89 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 1.36 0.62 0.92 0.00 0.00 12 A 8.28 4.15 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 13 A 8.45 4.19 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 14 Y 8.56 4.37 0.00 2.92 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 15 K 6.96 4.26 0.00 1.49 1.55 0.00 1.76 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.26 1.47 7.81 16 P 0.00 4.21 0.00 2.26 2.20 0.00 3.61 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 2.29 2.57 0.00 17 R 8.40 4.52 0.00 1.73 1.91 0.00 3.17 0.00 0.00 3.24 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.45 0.00 18 S 7.53 4.62 0.00 3.92 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 19 N 8.59 5.15 0.00 2.63 2.83 0.00 0.00 6.76 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 20 E 9.12 4.79 0.00 2.04 2.01 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 2.25 2.34 0.00 21 I 8.36 4.87 1.91 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 1.26 0.63 0.04 0.00 0.00 22 L 9.07 4.70 0.00 1.67 1.65 0.74 0.64 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 23 W 9.03 5.32 0.00 3.18 3.23 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 24 D 8.84 4.90 0.00 2.98 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 25 G 8.90 3.65 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 0.00 0.00 0.00 26 Y 9.33 4.41 0.00 3.15 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 27 G 8.48 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 28 V 8.22 4.34 2.56 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 0.91 0.00 0.00 1.06 0.00 0.00 29 P 0.00 4.02 0.00 1.43 0.49 0.00 3.75 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.87 0.00 30 H 8.52 4.46 0.00 3.34 3.34 0.00 5.60 0.00 0.00 0.00 0.00 6.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 I 7.78 4.55 1.67 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 1.20 0.20 0.95 0.00 0.00 32 Y 9.25 4.62 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 33 G 8.65 4.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 V 9.27 3.98 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 0.77 0.00 0.00 1.00 0.00 0.00 35 D 7.60 4.69 0.00 2.93 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 36 A 8.57 4.15 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.29 0.00 2.21 2.17 0.00 3.82 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.30 0.00 38 S 9.08 4.22 0.00 4.08 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 39 A 8.10 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 40 F 8.97 4.19 0.00 3.40 3.50 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.98 4.42 0.00 3.19 3.29 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 42 G 8.81 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 0.00 0.00 0.00 43 Y 8.62 4.58 0.00 3.08 3.34 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 0.00 44 G 8.45 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 0.00 0.00 0.00 45 W 8.17 4.01 0.00 3.27 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 46 A 8.71 4.54 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.33 3.93 0.00 2.03 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 2.32 2.22 0.00 48 A 7.82 3.70 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 R 6.94 2.70 0.00 0.86 1.90 0.00 3.22 0.00 0.00 2.53 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.48 0.00 50 S 7.81 4.36 0.00 3.91 3.82 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 51 H 8.72 4.90 0.00 3.01 3.15 0.00 5.64 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 G 8.25 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 53 D 7.97 4.31 0.00 2.63 2.66 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 54 N 7.98 4.32 0.00 2.69 2.81 0.00 0.00 7.02 7.27 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 55 I 7.66 3.50 1.60 0.00 0.00 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 1.39 0.71 0.20 0.00 0.00 56 L 7.78 3.88 0.00 1.97 1.74 0.81 0.69 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 57 R 7.86 3.81 0.00 1.60 1.77 0.00 2.84 0.00 0.00 2.69 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 58 L 8.10 4.12 0.00 2.07 1.78 1.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 59 Y 8.56 4.46 0.00 3.05 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 60 G 8.74 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 0.00 0.00 0.00 0.00 61 E 8.83 4.21 0.00 2.42 2.23 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 2.78 2.85 0.00 62 A 8.30 4.37 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 63 R 7.71 4.20 0.00 1.99 1.94 0.00 3.34 0.00 0.00 3.28 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.93 0.00 64 G 8.34 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 65 K 7.59 4.19 0.00 1.01 0.74 0.00 1.48 0.00 0.00 1.55 0.00 0.00 2.80 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.13 1.15 7.81 66 G 8.18 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 0.00 0.00 0.00 67 A 8.21 4.30 1.34 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 0.00 0.00 0.00 68 E 7.71 3.75 0.00 1.75 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.29 0.00 69 Y 7.18 4.17 0.00 1.43 1.43 0.00 0.00 0.00 0.00 0.00 0.00 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 W 8.03 4.81 0.00 2.57 2.81 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 71 G 8.63 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 0.00 0.00 0.00 72 P 0.00 4.27 0.00 2.22 2.19 0.00 3.71 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.27 0.00 73 D 8.33 4.48 0.00 2.66 2.51 0.00 0.00 0.00 0.00 0.00 0.00 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 8.36 4.63 0.00 3.37 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 75 E 8.44 4.04 0.00 2.10 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 2.34 2.38 0.00 76 Q 8.09 4.03 0.00 2.12 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.68 0.00 0.00 0.00 0.00 0.00 2.45 2.46 0.00 77 T 7.94 4.07 4.51 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 78 T 7.86 3.89 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 1.28 0.00 0.00 79 V 8.14 3.59 2.29 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 1.05 0.00 0.00 0.99 0.00 0.00 80 W 8.40 4.24 0.00 3.47 3.29 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 81 L 8.44 3.58 0.00 1.64 1.54 1.03 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 82 L 8.12 3.85 0.00 1.66 1.63 0.87 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 83 T 7.71 3.78 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 1.14 0.00 0.00 84 N 7.43 4.27 0.00 1.68 1.55 0.00 0.00 7.01 9.00 0.00 0.00 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 G 7.87 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 86 V 7.42 3.28 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 0.87 0.00 0.00 0.03 0.00 0.00 87 P 0.00 4.16 0.00 2.10 2.12 0.00 3.49 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.29 0.00 88 E 7.93 3.91 0.00 1.91 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 2.36 2.30 0.00 89 R 8.09 3.78 0.00 1.73 1.47 0.00 2.99 0.00 0.00 3.10 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.33 0.00 90 A 7.89 3.85 1.38 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 0.00 0.00 0.00 91 Q 7.78 4.03 0.00 2.25 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.76 0.00 0.00 0.00 0.00 0.00 2.52 2.50 0.00 92 Q 7.85 4.05 0.00 2.10 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.97 0.00 0.00 0.00 0.00 0.00 2.65 2.48 0.00 93 W 9.02 4.50 0.00 3.59 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 94 Y 8.76 4.18 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 95 A 8.18 4.03 1.45 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 96 Q 7.51 4.27 0.00 2.15 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.86 0.00 0.00 0.00 0.00 0.00 2.37 2.53 0.00 97 Q 7.02 4.19 0.00 1.96 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.92 0.00 0.00 0.00 0.00 0.00 2.69 2.49 0.00 98 S 8.33 4.34 0.00 4.04 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 99 P 0.00 4.18 0.00 2.16 2.13 0.00 3.59 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.16 0.00 100 D 8.07 4.35 0.00 2.71 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 0.00 101 F 8.23 3.91 0.00 3.14 3.03 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 0.00 102 R 8.34 3.75 0.00 1.70 1.97 0.00 3.03 0.00 0.00 3.00 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.31 0.00 103 A 7.97 4.01 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 0.00 104 N 7.46 3.87 0.00 1.48 1.42 0.00 0.00 7.05 7.22 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 0.00 105 L 7.51 3.97 0.00 1.88 1.84 1.13 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 106 D 8.70 4.49 0.00 2.86 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 0.00 107 A 8.48 4.24 1.66 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 0.00 108 F 8.68 4.44 0.00 3.55 3.44 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 0.00 109 A 8.45 4.10 1.58 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 0.00 110 A 8.76 4.20 1.68 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 0.00 111 G 8.31 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 0.00 0.00 0.00 112 I 7.35 3.51 1.91 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 1.22 0.72 0.77 0.00 0.00 113 N 8.27 4.30 0.00 2.93 2.90 0.00 0.00 6.93 7.21 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 0.00 114 A 8.53 4.11 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 0.00 0.00 0.00 0.00 0.00 115 Y 7.67 2.40 0.00 1.85 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 0.00 116 A 7.47 3.69 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 0.00 117 Q 7.95 3.97 0.00 2.06 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.93 0.00 0.00 0.00 0.00 0.00 2.42 2.46 0.00 118 Q 7.94 4.24 0.00 2.14 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 7.09 0.00 0.00 0.00 0.00 0.00 2.52 2.51 0.00 119 N 7.72 4.86 0.00 1.67 2.48 0.00 0.00 6.57 8.67 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 0.00 120 P 0.00 4.24 0.00 2.15 2.23 0.00 3.66 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.89 0.00 121 D 7.86 4.30 0.00 2.59 2.66 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 0.00 122 D 7.82 4.65 0.00 2.80 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 0.00 123 I 6.93 4.17 1.82 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.72 0.88 0.00 0.00 124 S 9.11 4.12 0.00 4.04 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 0.00 125 P 0.00 4.21 0.00 2.22 2.09 0.00 3.64 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.08 0.00 126 E 8.21 4.30 0.00 2.33 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 0.00 2.30 2.34 0.00 127 V 7.72 4.49 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 1.06 0.00 0.00 0.98 0.00 0.00 128 R 7.86 3.93 0.00 1.86 1.91 0.00 3.15 0.00 0.00 3.18 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.91 0.00 129 Q 7.86 3.94 0.00 1.82 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 7.11 0.00 0.00 0.00 0.00 0.00 1.91 1.19 0.00 130 V 7.25 3.56 2.22 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 1.08 0.00 0.00 1.02 0.00 0.00 131 L 7.24 4.09 0.00 1.86 1.57 0.95 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 132 P 0.00 4.81 0.00 2.20 2.05 0.00 3.76 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.99 0.00 133 V 8.68 4.40 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 0.91 0.00 0.00 1.08 0.00 0.00 134 S 9.37 4.84 0.00 3.77 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 0.00 135 G 8.65 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 0.00 0.00 0.00 136 A 6.85 3.85 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 D 7.82 4.22 0.00 2.76 2.42 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 0.00 138 V 7.43 3.24 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 1.10 0.00 0.00 1.29 0.00 0.00 139 V 7.89 3.74 2.39 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 1.37 0.00 0.00 1.29 0.00 0.00 140 A 8.49 3.98 1.34 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 0.00 0.00 0.00 141 H 8.27 4.14 0.00 3.25 3.33 0.00 5.79 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 0.00 142 A 7.72 4.05 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 0.00 143 H 8.51 4.57 0.00 3.12 3.55 0.00 5.96 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 0.00 144 R 8.33 4.19 0.00 1.96 2.13 0.00 3.29 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.78 0.00 145 L 8.04 4.00 0.00 1.85 1.87 1.02 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 *147 N 8.02 4.55 0.00 2.79 2.30 0.00 0.00 6.89 8.13 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 0.00 148 F 8.19 5.99 0.00 3.22 3.45 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 0.00 149 L 8.09 4.68 0.00 1.93 1.51 0.97 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 150 Y 8.09 4.14 0.00 3.14 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 0.00 151 V 7.86 3.56 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 0.75 0.00 0.00 0.96 0.00 0.00 152 A 8.41 4.66 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 0.00 153 S 8.29 4.89 0.00 3.92 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 0.00 154 P 0.00 2.97 0.00 1.59 0.49 0.00 3.37 0.00 0.00 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.47 0.00 155 G 7.58 3.46 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 0.00 156 R 7.48 3.99 0.00 1.77 2.02 0.00 3.18 0.00 0.00 3.23 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.64 0.00 157 T 7.36 4.17 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 1.46 0.00 0.00 158 L 8.28 4.21 0.00 1.83 1.66 1.02 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 159 G 7.72 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 0.00 160 E 7.47 4.11 0.00 1.90 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 2.30 2.19 0.00 * Residues marked with a * may have inaccurate shift predictions.