NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 19 I 4.5887 8.0093 121.4043 61.5152 38.7540 174.3975 20 T 4.5347 8.8316 117.1105 58.8960 71.8251 171.5130 21 L 5.2451 8.4687 125.9883 54.0244 45.1046 176.2624 22 T 4.8677 8.8038 116.4854 60.1622 72.6675 172.2629 23 Y 5.2985 8.3086 121.0114 55.9574 42.9561 173.3019 24 K 4.6033 7.9375 126.1968 54.1675 35.1406 174.9916 25 E 4.1564 8.9254 128.9538 56.4853 30.2609 177.3798 26 G 4.1489 8.5216 115.9866 45.9152 0.0000 173.3317 27 A 4.3894 8.5420 124.9192 50.8889 19.3522 175.8994 28 P 4.3327 0.0000 0.0000 62.8226 31.9432 176.3176 29 I 4.1489 7.9566 122.1364 59.9356 38.0804 175.6364 30 T 4.1381 8.2205 123.0231 62.7072 68.9407 174.5690 31 I 3.8389 8.1043 128.0443 60.9914 37.9388 176.0761 32 M 4.3399 8.6838 125.4788 54.5225 32.6691 176.9547 33 D 4.2675 8.5463 119.5834 57.4094 41.3351 176.6535 34 N 4.5033 8.0765 113.5785 52.8838 37.7534 175.6850 35 G 3.7888 8.4658 107.9943 45.8703 0.0000 172.7569 36 N 4.9282 8.3360 119.0652 51.3899 41.2658 172.8764 37 I 4.7262 7.5943 111.6524 58.5328 40.5519 174.3301 38 D 4.5220 8.1744 120.4582 53.7111 41.8890 175.5522 39 T 4.3480 8.0061 112.7307 61.4067 70.1186 174.8886 40 E 3.7750 8.8897 119.6817 56.6925 28.3301 175.2595 41 L 4.0259 7.4280 119.5789 54.7787 43.0130 176.6068 42 L 4.4572 8.3554 124.9988 54.1882 41.0356 176.1582 43 V 3.6826 9.2081 127.8005 65.0755 32.9991 175.4869 44 G 4.5814 7.1743 105.1139 46.5870 0.0000 171.7742 45 T 5.1398 7.8169 116.1338 61.5895 71.9780 173.5496 46 L 5.1407 9.0321 127.0239 53.7875 43.9769 175.6375 47 T 5.0627 9.0572 120.9895 61.9006 70.9591 172.8556 48 L 5.2970 9.0842 129.6461 53.6997 44.6041 175.4443 49 G 4.1844 9.1010 111.5831 45.8876 0.0000 173.5860 50 G 4.0759 8.2364 107.4480 45.1825 0.0000 173.6667 51 Y 4.5500 6.5412 116.9002 55.6977 39.2433 175.2629 52 K 4.1616 8.9853 122.7204 56.3403 32.9763 176.3792 53 T 4.0845 8.2319 119.5266 65.1494 68.6173 175.1282 54 G 3.9867 9.0325 114.0234 45.4291 0.0000 173.5786 55 T 3.8815 7.8144 117.5320 63.8143 68.9524 173.9952 56 T 4.8000 8.0639 115.5791 59.3662 71.6414 175.4834 57 S 4.1621 8.9592 116.6636 61.6490 62.8702 176.7499 58 T 3.8853 7.8406 109.2775 63.4846 68.7519 174.7264 59 S 4.3870 7.8918 117.6361 58.8286 63.5881 173.1532 60 V 4.4899 7.7035 122.4642 61.0525 33.4903 174.1494 61 N 5.0596 8.4544 125.7869 52.0414 42.0815 172.7423 62 F 5.0970 9.1703 126.8598 56.7352 40.6519 175.3884 63 T 5.2957 9.6084 114.0797 60.1572 72.4447 172.3518 64 D 5.0910 8.5560 120.7395 52.0745 42.5558 175.0112 65 A 4.0388 8.7601 120.5868 55.3596 17.8825 178.8089 66 A 3.9997 8.2261 118.4562 53.5990 18.4712 178.2598 67 G 4.5641 8.1666 102.3623 46.0256 0.0000 173.0095 68 D 4.4655 7.5649 120.4088 52.4295 41.0917 173.6680 69 P 4.4192 0.0000 0.0000 64.8225 31.5287 176.7357 70 M 3.1591 9.2512 122.0342 55.3340 30.7856 176.1240 71 Y 5.6648 7.6672 115.1816 55.0343 42.5249 174.6396 72 L 4.8167 8.2314 119.4666 53.5616 44.0304 175.5069 73 T 4.9436 9.2774 121.6457 62.2806 69.9687 174.3096 74 F 4.7045 8.9044 125.4763 56.1324 41.5317 175.0563 75 T 5.4127 8.7077 118.6405 61.4667 72.3290 173.9753 76 S 3.4735 8.7804 120.0040 58.0045 63.9873 173.8963 77 Q 4.5081 8.1633 117.4215 55.8362 29.0024 176.1033 78 D 4.5523 8.0519 115.9669 52.9445 39.9226 177.3529 79 G 3.9037 8.1396 108.0971 45.8904 0.0000 173.7994 80 N 4.4968 8.5801 116.0313 52.5313 39.3600 174.4692 81 N 4.1378 7.8831 114.5405 54.5035 36.2385 174.1966 82 H 4.6866 8.4309 115.3652 56.1473 30.4543 176.1823 83 Q 5.9373 9.0693 120.0244 53.5862 33.5926 173.7551 84 F 5.5368 8.4000 115.3539 55.6916 41.9618 173.4669 85 T 5.2018 8.8331 110.9594 60.7704 71.9980 173.0112 86 T 5.4189 8.6339 111.6311 60.3848 73.1264 172.2378 87 K 5.1642 9.3222 120.1571 55.1373 36.5683 175.2188 88 V 4.8969 8.4291 120.6384 61.3840 33.3142 174.8547 89 I 4.9678 9.2195 128.7493 59.8728 41.4388 175.3248 90 G 4.6698 9.8854 114.9820 44.5810 0.0000 171.9185 91 K 5.4460 8.4169 117.9208 54.7760 35.9355 176.9594 92 D 4.8066 8.7740 123.7358 52.1624 41.7209 177.0670 93 S 4.1955 8.6140 114.1593 61.1613 62.8231 175.3324 94 R 4.2450 7.9494 114.9501 55.2856 29.2508 175.4949 95 D 4.5051 7.9578 115.3513 55.7235 40.3003 173.4027 96 F 5.0841 8.9876 115.7621 55.8676 40.9124 175.1579 97 D 5.0111 8.7682 121.2471 54.8448 41.6658 175.9174 98 I 4.4332 9.4645 124.2948 59.8849 39.7784 174.6948 99 S 4.8831 8.8195 123.5517 55.8291 62.5747 171.7218 100 P 4.7970 0.0000 0.0000 61.7766 32.6878 176.1287 101 K 4.3823 8.6900 119.9008 56.4368 33.6370 176.8314 102 V 4.6295 8.3433 122.8362 61.3487 34.7788 175.2298 103 N 4.1160 10.3765 127.9056 54.5330 36.5261 176.1884 104 G 3.9224 9.2089 103.8150 45.6951 0.0000 173.7014 105 E 4.7728 7.4474 117.5151 54.6653 35.0538 175.4352 106 N 4.3536 9.9598 121.9460 53.7480 37.3494 175.2079 *107 L 3.8874 9.2428 125.4408 54.7296 41.0222 175.2636 *111 D 4.4198 7.7351 118.3745 55.0815 41.7400 174.4182 112 V 4.6130 8.2360 125.6877 60.8931 35.5901 174.4468 113 V 4.1627 8.3305 125.2963 62.6017 32.1582 175.8523 114 L 4.4263 8.3298 127.5448 53.9085 42.5876 176.6955 115 A 4.2812 8.6223 123.5033 52.0081 18.9477 177.9670 116 T 3.9466 8.2012 116.8473 64.8036 68.5852 173.2446 117 G 3.7440 8.6940 117.4968 44.8962 0.0000 173.1929 118 S 5.0353 7.3103 113.4740 56.0457 67.3572 173.0121 119 Q 4.4723 9.4334 121.0780 54.6946 32.4637 173.1880 120 D 4.9565 8.3753 125.5688 53.2876 42.6558 175.8013 121 F 4.6570 8.9723 120.9120 55.6485 42.4971 174.1616 122 F 4.8230 8.9341 123.3304 56.8229 40.7164 175.2705 123 V 4.5875 8.8346 123.8831 62.0762 32.3834 174.5896 124 R 5.1964 9.0016 128.6629 54.4997 32.2511 176.6145 125 S 4.4838 8.9329 118.3923 58.9233 64.1027 173.1903 126 I 4.1895 9.1868 119.6051 60.9535 39.0988 176.3878 127 G 4.0716 7.7245 108.5016 45.6169 0.0000 170.8642 128 S 4.7671 8.6810 115.3358 58.5308 62.6447 174.3023 129 K 4.1860 9.3217 126.2517 56.8289 32.3869 176.0700 130 G 4.0237 8.4843 108.9394 45.7947 0.0000 173.5655 131 G 4.0744 8.2577 111.2255 44.3924 0.0000 173.1655 132 K 4.4336 8.2576 118.2580 56.1114 32.7750 177.1736 133 L 4.4780 8.9202 124.2699 54.1963 42.7886 176.0294 134 A 4.7869 7.8419 122.6235 49.9234 20.6839 177.1842 135 A 4.1474 8.7553 124.5490 51.7972 19.3318 178.6876 136 G 3.9452 8.0347 106.4655 45.1323 0.0000 171.5736 137 K 4.7135 8.1179 119.5530 55.6959 33.2180 176.1940 138 Y 5.1426 8.9611 121.4379 56.6256 41.4320 174.6492 139 T 4.8043 8.6687 111.3927 60.7920 73.3598 172.4225 140 D 4.3373 7.8424 120.1479 53.1947 43.6153 174.6486 141 A 4.0185 8.5436 130.3177 51.9695 18.2403 176.2084 142 V 4.6004 7.9426 122.1134 62.3641 33.8791 175.2267 143 T 4.8969 8.9793 121.9708 61.6853 72.7196 173.1540 144 V 4.6237 8.4688 124.4401 60.0626 34.1292 174.7821 145 T 4.5086 8.5615 121.0296 61.6152 71.2493 173.0098 146 V 4.6311 8.3519 126.3466 61.3988 33.1666 175.4355 147 S 4.5466 9.0116 124.7635 56.7521 65.0614 173.1390 148 N 4.1511 8.3953 114.8162 54.6772 35.8851 174.8210 149 Q 4.2327 8.1076 120.6914 56.1636 29.0165 176.1113 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 19 I 8.01 4.59 1.89 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.09 0.96 0.00 0.00 20 T 8.83 4.53 4.27 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 1.22 0.00 0.00 21 L 8.47 5.25 0.00 1.70 1.64 1.28 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 22 T 8.80 4.87 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 1.26 0.00 0.00 23 Y 8.31 5.30 0.00 3.11 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 24 K 7.94 4.60 0.00 1.74 1.42 0.00 1.66 0.00 0.00 1.53 0.00 0.00 2.77 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.23 1.30 7.81 25 E 8.93 4.16 0.00 2.26 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 2.38 2.52 0.00 26 G 8.52 4.15 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 A 8.54 4.39 1.22 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 0.00 0.00 28 P 0.00 4.33 0.00 2.03 2.00 0.00 3.65 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.12 0.00 29 I 7.96 4.15 1.61 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.45 0.58 0.00 0.00 30 T 8.22 4.14 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 1.17 0.00 0.00 31 I 8.10 3.84 1.83 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.70 0.86 0.00 0.00 32 M 8.68 4.34 0.00 2.02 2.17 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.41 0.00 33 D 8.55 4.27 0.00 2.61 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 34 N 8.08 4.50 0.00 2.86 2.89 0.00 0.00 6.08 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 35 G 8.47 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 36 N 8.34 4.93 0.00 2.68 2.64 0.00 0.00 6.70 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 37 I 7.59 4.73 1.60 0.00 0.00 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.63 0.58 0.00 0.00 38 D 8.17 4.52 0.00 2.56 2.52 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 39 T 8.01 4.35 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 1.21 0.00 0.00 40 E 8.89 3.77 0.00 2.10 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 0.00 2.22 2.39 0.00 41 L 7.43 4.03 0.00 1.53 1.50 0.77 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 42 L 8.36 4.46 0.00 1.59 1.59 1.13 0.95 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 43 V 9.21 3.68 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 0.75 0.00 0.00 0.93 0.00 0.00 44 G 7.17 4.58 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 45 T 7.82 5.14 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 46 L 9.03 5.14 0.00 1.74 1.72 0.40 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 47 T 9.06 5.06 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 1.28 0.00 0.00 48 L 9.08 5.30 0.00 2.21 2.04 1.09 1.04 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 49 G 9.10 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 50 G 8.24 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 Y 6.54 4.55 0.00 3.08 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 52 K 8.99 4.16 0.00 1.86 1.79 0.00 1.66 0.00 0.00 1.67 0.00 0.00 2.90 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.47 1.44 7.81 53 T 8.23 4.08 4.27 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 1.24 0.00 0.00 54 G 9.03 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 55 T 7.81 3.88 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 1.04 0.00 0.00 56 T 8.06 4.80 4.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 57 S 8.96 4.16 0.00 4.07 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 0.00 58 T 7.84 3.89 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 1.21 0.00 0.00 59 S 7.89 4.39 0.00 3.98 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 60 V 7.70 4.49 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 0.32 0.00 0.00 0.81 0.00 0.00 61 N 8.45 5.06 0.00 2.74 2.48 0.00 0.00 6.83 7.87 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 62 F 9.17 5.10 0.00 2.99 2.88 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 63 T 9.61 5.30 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 1.18 0.00 0.00 64 D 8.56 5.09 0.00 2.65 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 65 A 8.76 4.04 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 66 A 8.23 4.00 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 67 G 8.17 4.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 D 7.56 4.47 0.00 2.97 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 69 P 0.00 4.42 0.00 1.98 2.20 0.00 3.78 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 2.01 2.11 0.00 70 M 9.25 3.16 0.00 1.66 1.27 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.39 0.00 71 Y 7.67 5.66 0.00 2.84 2.88 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 72 L 8.23 4.82 0.00 1.82 1.69 0.83 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 73 T 9.28 4.94 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 1.20 0.00 0.00 74 F 8.90 4.70 0.00 1.51 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 75 T 8.71 5.41 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 1.22 0.00 0.00 76 S 8.78 3.47 0.00 3.57 3.41 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 77 Q 8.16 4.51 0.00 1.95 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.96 0.00 0.00 0.00 0.00 0.00 2.18 2.36 0.00 78 D 8.05 4.55 0.00 2.74 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 79 G 8.14 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 80 N 8.58 4.50 0.00 2.64 2.61 0.00 0.00 7.01 7.57 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 81 N 7.88 4.14 0.00 2.81 2.85 0.00 0.00 7.02 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 82 H 8.43 4.69 0.00 3.24 3.49 0.00 5.56 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 Q 9.07 5.94 0.00 2.02 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.83 0.00 0.00 0.00 0.00 0.00 2.39 2.46 0.00 84 F 8.40 5.54 0.00 3.00 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 85 T 8.83 5.20 4.09 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 1.19 0.00 0.00 86 T 8.63 5.42 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 1.27 0.00 0.00 87 K 9.32 5.16 0.00 1.93 2.13 0.00 1.36 0.00 0.00 1.68 0.00 0.00 2.84 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.55 1.45 7.81 88 V 8.43 4.90 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 0.50 0.00 0.00 0.79 0.00 0.00 89 I 9.22 4.97 2.04 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.65 1.13 0.00 0.00 90 G 9.89 4.67 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 0.00 0.00 0.00 91 K 8.42 5.45 0.00 1.77 1.78 0.00 2.00 0.00 0.00 1.95 0.00 0.00 3.09 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.54 1.44 7.81 92 D 8.77 4.81 0.00 2.90 2.88 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 93 S 8.61 4.20 0.00 3.84 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 94 R 7.95 4.24 0.00 1.34 1.69 0.00 2.21 0.00 0.00 2.77 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.81 0.00 95 D 7.96 4.51 0.00 2.87 2.88 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 96 F 8.99 5.08 0.00 3.37 2.91 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 97 D 8.77 5.01 0.00 2.58 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 98 I 9.46 4.43 1.98 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.35 1.09 0.00 0.00 99 S 8.82 4.88 0.00 3.92 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 0.00 100 P 0.00 4.80 0.00 1.97 1.73 0.00 4.09 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.30 0.00 101 K 8.69 4.38 0.00 1.82 1.72 0.00 1.71 0.00 0.00 1.54 0.00 0.00 2.74 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.48 7.81 102 V 8.34 4.63 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 0.99 0.00 0.00 0.96 0.00 0.00 103 N 10.38 4.12 0.00 2.95 2.82 0.00 0.00 6.57 7.88 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 0.00 104 G 9.21 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 0.00 105 E 7.45 4.77 0.00 1.88 1.70 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 2.25 2.27 0.00 106 N 9.96 4.35 0.00 2.69 2.57 0.00 0.00 6.95 7.85 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 *107 L 9.24 3.89 0.00 1.74 1.81 0.92 0.88 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 *111 D 7.74 4.42 0.00 2.67 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 0.00 112 V 8.24 4.61 2.14 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 1.01 0.00 0.00 1.00 0.00 0.00 113 V 8.33 4.16 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 0.86 0.00 0.00 0.94 0.00 0.00 114 L 8.33 4.43 0.00 1.33 1.44 0.30 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 115 A 8.62 4.28 1.36 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 0.00 0.00 0.00 0.00 0.00 116 T 8.20 3.95 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 0.00 117 G 8.69 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 0.00 0.00 0.00 118 S 7.31 5.04 0.00 3.98 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 0.00 119 Q 9.43 4.47 0.00 2.12 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.92 0.00 0.00 0.00 0.00 0.00 1.50 1.39 0.00 120 D 8.38 4.96 0.00 2.29 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 0.00 0.00 0.00 121 F 8.97 4.66 0.00 2.84 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 0.00 122 F 8.93 4.82 0.00 3.24 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 0.00 123 V 8.83 4.59 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 1.23 0.00 0.00 1.15 0.00 0.00 124 R 9.00 5.20 0.00 1.82 1.85 0.00 3.58 0.00 0.00 3.24 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.78 0.00 125 S 8.93 4.48 0.00 3.72 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 0.00 126 I 9.19 4.19 1.93 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.69 0.75 0.00 0.00 127 G 7.72 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 S 8.68 4.77 0.00 3.83 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 0.00 129 K 9.32 4.19 0.00 1.87 1.85 0.00 1.96 0.00 0.00 1.80 0.00 0.00 3.03 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.46 1.41 7.81 130 G 8.48 4.02 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 0.00 0.00 0.00 0.00 0.00 0.00 131 G 8.26 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 K 8.26 4.43 0.00 1.66 1.74 0.00 1.74 0.00 0.00 1.71 0.00 0.00 2.79 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.64 1.48 7.81 133 L 8.92 4.48 0.00 1.43 1.61 0.75 1.09 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 0.00 134 A 7.84 4.79 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 0.00 135 A 8.76 4.15 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 0.00 136 G 8.03 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 K 8.12 4.71 0.00 1.79 1.87 0.00 1.80 0.00 0.00 1.81 0.00 0.00 3.00 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.46 7.81 138 Y 8.96 5.14 0.00 3.08 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 T 8.67 4.80 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 140 D 7.84 4.34 0.00 1.59 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 0.00 141 A 8.54 4.02 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 V 7.94 4.60 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 1.00 0.00 0.00 0.82 0.00 0.00 143 T 8.98 4.90 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 1.18 0.00 0.00 144 V 8.47 4.62 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 0.71 0.00 0.00 0.10 0.00 0.00 145 T 8.56 4.51 4.15 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 0.00 0.00 0.00 1.16 0.00 0.00 146 V 8.35 4.63 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 0.80 0.00 0.00 0.88 0.00 0.00 147 S 9.01 4.55 0.00 3.71 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 0.00 148 N 8.40 4.15 0.00 2.84 2.88 0.00 0.00 6.84 7.69 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 0.00 149 Q 8.11 4.23 0.00 2.04 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.65 0.00 0.00 0.00 0.00 0.00 2.56 2.31 0.00 * Residues marked with a * may have inaccurate shift predictions.