NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 Q 4.3412 8.2027 118.9648 55.7864 30.7865 173.6878 2 V 4.0548 8.2148 121.8611 62.7173 31.8859 173.6748 3 Q 4.7699 10.0906 128.0219 54.0628 33.5022 174.3486 4 L 5.0274 8.4983 120.7571 53.2791 44.9937 176.2419 5 V 4.2359 8.7727 125.9768 61.1905 32.9557 174.1405 6 E 5.1458 8.8119 129.7169 55.4807 30.9245 175.0725 7 S 4.5477 9.5010 120.1131 57.6572 67.0396 173.0886 8 G 3.6898 8.6915 104.8251 45.4563 0.0000 173.0904 9 G 3.6525 7.5925 108.7163 46.4134 0.0000 172.0667 10 G 3.8923 8.3098 105.4636 44.3508 0.0000 171.5578 11 L 5.2828 8.1126 124.3375 53.5720 44.3101 176.9966 12 V 4.6831 8.4226 123.8919 60.1679 35.2436 173.9415 13 Q 4.7720 8.5563 120.4720 54.5997 30.2090 173.6690 14 P 4.6111 0.0000 0.0000 64.4088 31.8067 177.1941 15 G 3.9197 9.4501 111.2195 45.3525 0.0000 173.9316 16 G 3.9152 7.8727 109.1121 45.0274 0.0000 172.5423 17 S 5.0345 8.1518 114.1566 56.6448 65.9603 174.0021 18 L 4.6163 7.9213 121.3795 53.1545 45.2795 175.2660 19 R 4.6725 8.3219 121.3091 54.5622 32.9030 174.2599 20 L 5.0600 8.5712 126.0766 53.3540 44.4644 175.6281 21 S 5.4087 9.2682 117.1016 57.2323 67.8842 172.6537 22 C 5.2253 9.0962 121.4326 55.4119 46.9665 172.5176 23 A 4.7338 9.0759 129.6042 50.6420 19.9040 175.4877 24 A 5.1762 8.1245 125.2160 50.8897 21.0832 176.0735 25 S 4.1696 8.9614 114.2780 57.9072 66.9361 175.1999 26 G 4.2834 10.7688 107.5742 46.4899 0.0000 172.7442 27 F 4.7745 6.9113 112.1009 55.6022 40.4969 174.4164 28 T 4.1053 8.6227 117.9933 63.1484 67.5811 175.3353 29 F 4.1041 8.8235 129.8878 61.2071 39.5448 177.5243 30 S 4.3330 8.1654 113.7205 60.4502 62.9311 175.4771 31 S 4.2960 8.0334 116.3702 59.6669 62.8371 173.5815 32 Y 4.5266 7.9025 118.6442 55.5244 40.7141 175.7909 33 A 4.6089 8.4550 126.0457 51.3830 19.6757 175.9429 *35 S 4.7907 8.1561 111.9230 58.4311 65.0195 172.7426 36 W 5.6479 9.2318 119.8902 55.2007 32.1959 174.9962 37 F 5.6505 10.1871 122.5502 55.8581 42.8820 174.1734 38 R 5.2083 9.3957 116.0037 54.8087 33.4113 173.6757 39 Q 4.9045 9.2747 121.4944 54.4559 32.0402 174.0811 40 A 5.1179 8.4804 127.2863 49.1464 22.5198 173.9638 41 P 4.2905 0.0000 0.0000 64.2343 31.7161 177.5840 42 G 3.9653 9.0033 110.2105 45.4955 0.0000 172.9153 43 K 4.7076 7.8040 117.8355 54.0275 35.3962 175.7662 44 E 4.2129 8.4315 119.8180 55.6715 30.1792 177.2018 45 R 4.2623 8.4313 122.5111 56.7623 30.8624 175.5177 46 E 5.0286 9.3633 122.2131 54.2291 33.3403 174.7710 47 I 2.7624 8.4114 121.7379 61.4005 38.4619 174.7369 48 V 4.3406 8.7097 127.7227 64.2558 33.5269 175.1047 49 S 5.1036 7.9335 112.3476 57.5440 65.8980 172.1953 50 A 5.2206 8.8454 124.6194 50.7760 23.1344 175.5026 51 V 4.9724 8.1050 117.7541 59.9449 35.1313 174.9988 52 S 4.3605 9.1722 119.0380 58.0486 63.9997 175.3332 53 G 4.0651 9.1631 109.7932 48.4898 0.0000 175.2730 54 S 4.1583 7.9247 112.8569 58.9572 63.4774 175.1691 55 G 3.9953 8.1495 109.3587 45.1486 0.0000 174.4238 56 G 3.8107 7.7263 107.5568 47.0853 0.0000 174.1050 57 S 4.8777 8.0983 116.4538 56.9911 66.9435 173.3300 58 T 5.1869 8.6450 113.2278 60.0972 72.2949 172.3706 59 Y 4.7730 8.6519 122.7347 56.0795 42.5030 173.5005 60 Y 4.9349 7.3284 121.9694 55.5086 41.5739 175.2823 61 A 4.0738 8.6852 125.8168 52.0482 19.1917 178.4304 62 D 4.3173 8.9395 120.5117 57.3820 41.1519 179.2572 63 S 4.1402 7.9912 112.1666 60.2064 63.4048 174.9439 64 V 3.8481 7.5279 112.7241 60.3159 32.5478 175.6039 65 R 3.8144 7.2644 120.0803 57.6868 30.2727 176.4640 66 G 4.0777 8.5499 110.9964 45.4876 0.0000 174.5208 67 R 4.3208 7.5516 116.9805 56.9800 30.9919 176.4920 68 F 5.3697 7.9226 114.8214 56.0002 41.7290 175.5692 69 T 4.8267 8.8331 118.2782 61.9876 72.0482 173.0237 70 I 5.0500 9.1175 127.4933 60.6078 39.5245 174.6224 71 S 5.0283 8.9255 120.8574 57.7474 66.6914 173.0690 72 R 5.3845 8.6498 115.7782 54.8271 33.0013 173.9246 73 D 4.9895 9.3961 120.6599 52.8320 43.1614 175.8248 74 N 5.1570 9.1195 122.7723 53.9098 39.0881 175.9201 75 S 4.5910 8.2655 114.7601 60.2521 64.1755 175.8149 76 K 3.9656 8.6936 117.9928 57.1289 32.7055 176.5258 77 N 3.1400 7.9375 115.9256 54.4717 35.7817 173.3863 78 T 4.7363 7.3123 113.2032 61.4465 73.2340 174.6244 79 L 5.2257 8.6638 127.0858 53.6376 45.0760 174.7126 80 Y 5.5881 9.4958 122.4382 56.2649 42.5483 174.5141 81 L 4.7226 8.8311 123.3853 53.5927 45.0125 175.8396 82 Q 4.3236 8.8194 128.9081 54.7630 31.5553 173.9115 *84 N 4.6590 8.3906 117.3191 53.4999 39.8483 174.1309 85 S 3.7297 8.5646 112.4310 59.6593 60.6531 173.3690 86 L 4.4251 7.8806 119.3750 54.9375 42.5151 177.3060 87 R 4.9287 9.1470 120.3631 53.8119 33.8114 176.5648 88 A 4.2884 9.0066 122.0778 54.8045 18.2487 179.5261 89 E 4.2608 8.0856 110.5516 57.9605 29.8457 177.1496 90 D 4.7266 8.1776 119.2969 55.6852 41.3915 176.7446 91 T 4.3329 7.8385 117.0313 64.1703 68.8781 173.4667 92 A 4.4236 8.6471 126.7031 51.5556 23.7799 174.9516 93 V 4.3375 7.9946 119.8592 62.6675 32.8724 174.4056 94 Y 5.1860 9.1535 126.0727 56.6807 40.3411 174.3345 95 Y 5.5830 9.7474 121.2085 56.4847 42.0687 172.3999 96 C 4.8819 9.2678 117.2466 54.3315 44.2559 172.2229 97 A 4.9004 8.3527 121.4158 50.2845 22.3794 175.4577 98 R 4.2323 8.5815 122.1396 54.9087 31.4404 175.5861 99 E 4.6294 8.7642 127.2088 55.4798 30.3196 175.1994 100 P 4.7304 0.0000 0.0000 61.7883 33.1090 175.8367 101 R 3.8156 8.7299 119.8307 56.3845 30.3945 175.7915 102 I 3.9803 8.1567 125.6819 61.1131 37.7342 174.5660 103 P 4.8685 0.0000 0.0000 62.0990 31.7316 175.8457 104 R 3.7420 7.6882 117.8301 56.6280 30.8130 175.5046 105 P 4.6368 0.0000 0.0000 61.1936 32.6369 175.2667 106 P 4.4942 0.0000 0.0000 64.9065 31.2387 178.4798 107 S 4.2775 8.1144 111.6166 59.9857 63.1875 174.5860 108 F 4.3383 8.2236 119.2845 57.2604 38.8607 175.6200 109 D 4.5413 7.5095 121.3154 54.7685 41.3289 175.3923 110 Y 4.7287 8.2064 118.6483 56.0459 40.8362 174.8902 111 W 5.3315 8.7985 121.8902 54.6814 32.6493 175.5902 112 G 4.0714 9.2419 110.8078 46.0478 0.0000 174.1062 113 Q 4.2703 8.8220 118.7428 57.0364 29.1158 177.8773 114 G 3.6962 8.8117 104.3458 45.3505 0.0000 172.8097 115 T 4.6382 8.4931 115.3964 59.8561 71.2812 172.5983 116 L 4.6709 8.6030 130.6350 54.8993 43.9009 175.2425 117 V 4.8243 9.1635 126.1583 61.4372 34.4663 174.0468 118 T 4.8750 8.8531 124.6512 61.7809 71.2122 173.2648 119 V 4.9796 8.6534 127.4086 61.0250 32.7103 174.2011 120 S 4.5579 8.1626 121.2382 57.0843 66.1788 174.3710 121 S 4.3323 8.5256 118.7393 58.8977 62.7204 174.4057 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 Q 8.20 4.34 0.00 2.16 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 7.05 0.00 0.00 0.00 0.00 0.00 2.32 2.37 0.00 2 V 8.21 4.05 1.10 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 -0.26 0.00 0.00 0.40 0.00 0.00 3 Q 10.09 4.77 0.00 1.98 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.56 6.52 0.00 0.00 0.00 0.00 0.00 2.26 2.45 0.00 4 L 8.50 5.03 0.00 1.52 1.58 0.94 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 5 V 8.77 4.24 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 1.03 0.00 0.00 0.94 0.00 0.00 6 E 8.81 5.15 0.00 2.14 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 2.42 2.62 0.00 7 S 9.50 4.55 0.00 3.89 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 8 G 8.69 3.69 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 0.00 0.00 0.00 9 G 7.59 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 10 G 8.31 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 11 L 8.11 5.28 0.00 1.64 1.54 0.96 0.81 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 12 V 8.42 4.68 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 0.64 0.00 0.00 0.90 0.00 0.00 13 Q 8.56 4.77 0.00 2.12 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 7.08 0.00 0.00 0.00 0.00 0.00 2.40 2.17 0.00 14 P 0.00 4.61 0.00 2.07 2.05 0.00 3.69 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 2.04 2.10 0.00 15 G 9.45 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 16 G 7.87 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 17 S 8.15 5.03 0.00 3.77 3.67 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 18 L 7.92 4.62 0.00 1.35 1.29 0.79 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 19 R 8.32 4.67 0.00 1.88 1.69 0.00 3.14 0.00 0.00 3.28 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.58 0.00 20 L 8.57 5.06 0.00 0.78 1.29 0.38 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 21 S 9.27 5.41 0.00 3.78 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 22 C 9.10 5.23 0.00 2.94 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 23 A 9.08 4.73 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 A 8.12 5.18 1.01 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 25 S 8.96 4.17 0.00 3.78 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 26 G 10.77 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 0.00 0.00 0.00 0.00 27 F 6.91 4.77 0.00 3.05 2.78 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 0.00 0.00 0.00 28 T 8.62 4.11 4.44 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 1.28 0.00 0.00 29 F 8.82 4.10 0.00 2.64 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 30 S 8.17 4.33 0.00 4.04 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 S 8.03 4.30 0.00 4.05 3.64 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 32 Y 7.90 4.53 0.00 3.06 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 33 A 8.46 4.61 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 *35 S 8.16 4.79 0.00 4.17 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 W 9.23 5.65 0.00 3.48 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 37 F 10.19 5.65 0.00 3.41 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 38 R 9.40 5.21 0.00 1.12 1.22 0.00 2.55 0.00 0.00 3.00 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.47 0.00 39 Q 9.27 4.90 0.00 2.18 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.74 0.00 0.00 0.00 0.00 0.00 2.41 2.44 0.00 40 A 8.48 5.12 1.25 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 41 P 0.00 4.29 0.00 2.07 2.03 0.00 3.77 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 2.05 2.12 0.00 42 G 9.00 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 0.00 0.00 0.00 43 K 7.80 4.71 0.00 1.81 1.71 0.00 1.74 0.00 0.00 1.72 0.00 0.00 2.84 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.57 1.52 7.81 44 E 8.43 4.21 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 2.30 2.29 0.00 45 R 8.43 4.26 0.00 1.64 1.77 0.00 2.49 0.00 0.00 2.48 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.65 0.00 46 E 9.36 5.03 0.00 2.05 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 2.40 2.28 0.00 47 I 8.41 2.76 1.29 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.28 0.93 0.00 0.00 48 V 8.71 4.34 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 1.39 0.00 0.00 1.17 0.00 0.00 49 S 7.93 5.10 0.00 4.07 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 50 A 8.85 5.22 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 51 V 8.11 4.97 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 0.87 0.00 0.00 0.97 0.00 0.00 52 S 9.17 4.36 0.00 3.89 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 53 G 9.16 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 54 S 7.92 4.16 0.00 3.99 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 55 G 8.15 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 G 7.73 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 57 S 8.10 4.88 0.00 3.71 3.73 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 58 T 8.65 5.19 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 1.26 0.00 0.00 59 Y 8.65 4.77 0.00 3.05 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 60 Y 7.33 4.93 0.00 2.65 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 A 8.69 4.07 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 62 D 8.94 4.32 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 63 S 7.99 4.14 0.00 3.90 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 64 V 7.53 3.85 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 0.15 0.00 0.00 0.96 0.00 0.00 65 R 7.26 3.81 0.00 1.68 1.77 0.00 3.15 0.00 0.00 3.19 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.74 0.00 66 G 8.55 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 67 R 7.55 4.32 0.00 1.94 2.37 0.00 3.33 0.00 0.00 3.20 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.54 0.00 68 F 7.92 5.37 0.00 2.75 2.97 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 69 T 8.83 4.83 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 1.33 0.00 0.00 70 I 9.12 5.05 2.07 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.43 0.93 0.00 0.00 71 S 8.93 5.03 0.00 4.09 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 72 R 8.65 5.38 0.00 2.22 2.09 0.00 2.97 0.00 0.00 3.29 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.75 0.00 73 D 9.40 4.99 0.00 3.00 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 74 N 9.12 5.16 0.00 2.85 2.94 0.00 0.00 7.09 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 75 S 8.27 4.59 0.00 4.01 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 76 K 8.69 3.97 0.00 1.73 1.83 0.00 1.98 0.00 0.00 1.77 0.00 0.00 3.06 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.49 1.44 7.81 77 N 7.94 3.14 0.00 2.46 1.99 0.00 0.00 6.91 7.05 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 78 T 7.31 4.74 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 0.57 0.00 0.00 79 L 8.66 5.23 0.00 1.89 1.47 1.10 0.02 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 80 Y 9.50 5.59 0.00 2.97 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 L 8.83 4.72 0.00 0.27 0.30 0.98 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 82 Q 8.82 4.32 0.00 2.14 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 6.22 0.00 0.00 0.00 0.00 0.00 2.24 2.29 0.00 *84 N 8.39 4.66 0.00 2.79 2.78 0.00 0.00 6.99 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 85 S 8.56 3.73 0.00 3.99 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 86 L 7.88 4.43 0.00 1.85 1.62 0.81 0.99 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 87 R 9.15 4.93 0.00 1.83 1.80 0.00 3.15 0.00 0.00 3.30 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.73 0.00 88 A 9.01 4.29 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 89 E 8.09 4.26 0.00 2.11 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 0.00 2.30 2.35 0.00 90 D 8.18 4.73 0.00 2.96 3.07 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 91 T 7.84 4.33 4.36 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 1.30 0.00 0.00 92 A 8.65 4.42 1.13 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 93 V 7.99 4.34 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 0.47 0.00 0.00 0.92 0.00 0.00 94 Y 9.15 5.19 0.00 2.97 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 95 Y 9.75 5.58 0.00 3.32 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 C 9.27 4.88 0.00 2.20 1.56 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 97 A 8.35 4.90 0.26 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 98 R 8.58 4.23 0.00 1.55 1.47 0.00 2.21 0.00 0.00 2.25 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.24 0.00 99 E 8.76 4.63 0.00 2.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.21 0.00 100 P 0.00 4.73 0.00 2.06 2.34 0.00 3.75 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.16 0.00 101 R 8.73 3.82 0.00 1.95 1.80 0.00 3.05 0.00 0.00 3.03 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.63 0.00 102 I 8.16 3.98 1.79 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.57 0.85 0.00 0.00 103 P 0.00 4.87 0.00 2.09 2.04 0.00 3.65 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.89 0.00 104 R 7.69 3.74 0.00 1.67 1.33 0.00 2.87 0.00 0.00 2.49 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 1.16 0.00 105 P 0.00 4.64 0.00 2.28 2.21 0.00 3.60 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.07 0.00 106 P 0.00 4.49 0.00 2.24 2.19 0.00 3.63 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 2.16 2.12 0.00 107 S 8.11 4.28 0.00 3.87 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 F 8.22 4.34 0.00 3.04 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 D 7.51 4.54 0.00 2.21 1.57 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 0.00 110 Y 8.21 4.73 0.00 2.63 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 0.00 111 W 8.80 5.33 0.00 3.10 3.07 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 0.00 112 G 9.24 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 0.00 113 Q 8.82 4.27 0.00 2.13 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.48 0.00 0.00 0.00 0.00 0.00 2.44 2.43 0.00 114 G 8.81 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 0.00 0.00 0.00 115 T 8.49 4.64 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 1.32 0.00 0.00 116 L 8.60 4.67 0.00 1.83 1.53 0.96 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 117 V 9.16 4.82 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 0.83 0.00 0.00 0.69 0.00 0.00 118 T 8.85 4.87 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 1.23 0.00 0.00 119 V 8.65 4.98 2.21 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 1.34 0.00 0.00 0.97 0.00 0.00 120 S 8.16 4.56 0.00 3.91 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 S 8.53 4.33 0.00 3.91 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 * Residues marked with a * may have inaccurate shift predictions.