NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 V 4.0833 8.0393 113.9805 61.5469 33.0885 173.8733 3 Q 4.4512 7.4689 118.0240 55.3319 32.3391 172.1727 4 L 5.1586 8.6433 120.2164 53.0315 45.1623 177.0424 5 V 4.3564 8.5620 123.7051 61.1871 33.9879 174.2410 6 E 5.1746 8.8896 129.4257 55.6839 31.5775 176.5847 7 S 4.4366 9.6099 125.2532 58.1899 64.8663 171.5257 8 G 4.2554 8.6195 107.1536 45.6867 0.0000 172.8927 9 G 3.8761 8.4670 105.0329 44.3180 0.0000 174.5202 10 G 3.8282 7.1041 105.5771 44.0792 0.0000 171.4964 11 S 5.3911 8.1240 115.1493 56.5680 64.9790 173.9998 12 V 4.5698 9.2057 123.0268 59.8668 35.4016 174.0872 13 Q 4.7915 8.5580 122.2813 54.8243 30.5400 174.7157 14 A 4.1867 8.4639 128.3427 54.1104 18.7884 178.3968 15 G 3.9607 9.2095 110.8360 45.3195 0.0000 174.1632 16 G 3.8584 8.1430 107.6891 46.1015 0.0000 173.1028 17 S 4.8815 8.0284 115.4456 56.4938 65.1126 172.7121 18 L 4.3041 7.4310 119.5768 54.4573 46.3919 172.4020 19 R 4.5695 7.9066 127.3772 54.5952 31.9695 174.6996 20 L 4.4039 8.1767 127.2852 54.0255 43.3508 175.9795 21 S 5.3627 8.7189 116.2219 56.8243 66.4459 171.8064 22 C 5.5519 9.7765 125.2662 55.2921 47.7195 172.5946 23 T 5.4603 9.0857 121.6535 60.6762 71.5739 172.6617 24 A 5.0480 8.5503 128.3899 50.8742 19.8141 176.4029 25 S 4.5027 8.5115 116.5140 56.4508 67.0145 173.9000 26 G 3.9590 9.0043 104.5716 47.1746 0.0000 172.4016 27 G 3.9985 7.7911 116.4391 44.9474 0.0000 171.4568 28 S 4.5570 8.3182 108.9949 57.1395 62.8167 173.6684 *31 S 4.3140 7.5819 114.4950 58.9274 64.0189 173.5006 32 Y 3.9905 8.6861 127.1744 60.8234 38.7174 177.8775 33 S 4.4467 8.3342 111.7753 60.6017 62.6995 174.9398 34 T 4.1132 7.9036 117.5018 65.0305 68.6896 174.4039 35 F 4.9916 8.3943 120.1773 56.1435 41.4947 175.3556 36 S 4.8232 8.7631 115.5632 56.8795 65.9836 173.6363 37 L 5.4672 9.1302 124.0889 53.3649 45.4285 175.6786 38 G 4.2920 8.7937 107.2865 44.9583 0.0000 171.7651 39 W 5.4575 9.7724 124.3879 55.1427 31.2273 175.6723 40 F 5.4047 9.7275 123.0663 55.8748 42.8668 173.9841 41 R 5.0896 9.0232 115.5558 55.5716 33.6742 174.0848 42 Q 4.7667 8.6159 118.9411 55.5307 31.4785 173.6047 43 A 4.8383 8.5862 129.3512 49.6435 21.0412 173.9726 44 P 4.3688 0.0000 0.0000 65.1496 31.0871 175.9960 45 G 4.3600 8.8071 119.1347 46.0460 0.0000 173.8119 46 Q 4.1475 7.3459 116.6806 54.9844 29.4225 176.5559 47 E 4.2713 8.2811 119.3105 55.5412 31.0335 175.9053 48 R 4.5013 8.3725 120.4301 55.8837 30.4300 175.3450 49 E 4.8832 8.6344 123.1546 54.6270 32.6782 174.8936 50 A 3.7534 8.3357 121.9902 51.5207 19.7134 176.6979 51 V 4.2485 8.5580 119.9899 64.0535 33.8213 175.3222 52 A 5.0952 7.6909 119.0625 51.2048 22.6036 174.4909 53 A 5.1808 8.9067 120.5155 50.7566 23.7115 175.4380 54 I 5.2721 10.0238 119.9726 58.7488 41.3095 174.7932 55 A 4.2925 8.8460 131.4005 51.2949 19.8641 177.2121 56 S 4.5274 8.4998 117.7277 58.4004 63.6003 174.3930 57 M 3.0674 9.3523 108.6581 57.6630 28.3044 175.8386 58 G 3.8607 8.6170 110.4078 49.0144 0.0000 172.2853 59 G 4.1285 7.2938 105.6648 42.2421 0.0000 175.9067 60 L 4.7336 8.2816 125.5258 53.4146 44.6273 175.3899 61 T 4.9861 7.9113 108.9583 60.3313 71.5812 173.1003 62 Y 4.7551 8.5798 121.1095 56.4594 41.9814 174.0276 63 Y 5.3976 8.6164 119.4864 55.8043 41.7445 175.2665 64 A 4.1844 9.1905 124.6827 52.2226 19.7386 178.7166 65 D 4.3031 8.8950 119.3584 57.6453 41.0220 179.4037 66 S 4.1558 8.0664 111.3357 60.4907 62.9329 174.9636 67 V 3.9262 7.2967 112.2201 60.2184 32.9270 175.3448 68 K 3.9957 7.7560 122.3225 57.5513 32.6125 174.9295 69 G 4.1270 8.7514 113.1483 45.7700 0.0000 174.6767 70 R 4.2879 7.6972 117.3863 58.2076 31.0526 176.3044 71 F 4.7955 8.0346 115.9110 57.7776 40.1587 175.3731 72 T 4.6399 8.8423 118.5565 62.1377 72.0559 172.7017 73 I 5.1212 9.1670 128.0274 60.1239 39.5603 174.7490 74 S 5.0164 9.4095 122.8061 57.3679 66.9951 172.5838 75 R 5.2033 8.4751 115.2409 54.8695 32.9063 174.5582 76 D 4.7219 9.3077 120.3276 52.3564 42.1928 175.7409 77 N 4.6189 8.9734 123.9783 56.0150 39.1533 177.7994 78 A 3.9701 8.1564 120.2598 54.8188 18.5294 178.1951 79 K 4.1006 8.5604 112.5322 55.7698 33.3759 176.1883 80 N 3.1400 7.1973 115.8121 53.6343 36.2937 173.6178 81 T 5.1643 7.4934 113.4687 62.1246 74.0476 175.0312 82 V 5.0768 9.2698 124.9046 61.6250 34.7697 174.4811 83 T 5.2569 9.6006 122.7289 61.7754 72.6689 172.4683 84 L 4.8397 8.6789 128.5107 53.3196 44.4237 175.0281 85 Q 4.3543 9.0762 129.8466 55.0091 30.1933 174.3745 86 M 3.6794 7.9859 128.1840 54.2997 32.5230 176.6056 87 N 4.2479 8.5962 122.0717 54.7355 38.9118 176.5032 88 N 4.7395 7.6574 119.2155 51.8212 37.0269 173.6006 89 L 4.5235 8.1803 122.0963 54.9969 43.4294 177.2403 90 K 4.9800 9.2133 121.5091 53.7440 36.0231 175.6597 91 P 4.5034 0.0000 0.0000 65.6405 31.4350 178.6469 92 E 4.1648 8.1093 116.2703 58.7207 29.5967 177.6084 93 D 4.6659 8.5709 118.2433 56.4365 41.2734 176.4796 94 T 4.2438 7.5120 115.3140 64.7027 69.0239 173.5788 95 A 4.3544 8.6345 128.1075 51.9123 23.9826 174.3403 96 I 4.6126 7.7125 119.6451 60.5369 38.9682 174.0152 97 Y 5.0790 9.1532 128.0119 57.1076 39.6001 174.4072 98 Y 5.1840 9.2309 122.0720 55.9382 41.0700 173.8172 99 C 4.3884 8.9101 121.6607 54.9635 44.2703 172.1654 100 A 4.8670 7.8149 124.5699 50.6657 22.5486 174.8035 101 A 5.8032 9.0948 120.1281 51.2214 23.4715 175.7781 102 V 4.5062 8.3871 117.5640 60.4730 34.9717 173.9406 103 R 3.6802 8.2602 124.3417 54.8286 28.2519 176.4539 104 G 3.8499 7.7009 113.1025 45.4264 0.0000 169.4326 105 Y 4.3917 7.9281 122.5981 56.8157 41.6959 173.8719 106 F 4.3618 5.6580 115.8624 56.7662 39.7590 172.9713 107 M 5.0389 8.0085 118.4667 53.2935 32.9420 175.6404 108 R 4.2476 6.9143 114.4413 54.4310 34.2729 175.1099 109 L 3.7921 8.2225 122.0912 54.2309 41.4892 175.0235 110 P 4.1134 0.0000 0.0000 62.5438 31.7620 174.6822 111 S 5.0664 8.1113 111.7774 56.0257 65.7341 174.8427 112 S 4.0407 8.9619 114.2545 61.7006 62.5967 176.2591 113 H 4.4624 7.6824 116.2161 58.1672 28.5493 176.1274 114 N 4.4228 8.1631 115.5710 54.3200 38.6423 174.9165 115 F 4.7792 7.6995 116.8044 55.5113 41.4322 175.1907 116 R 4.6092 8.4201 117.9980 56.9158 32.0328 175.4388 117 Y 5.0624 8.1453 118.3433 56.4751 39.3909 175.1657 118 W 5.2226 9.0605 123.4649 54.8052 32.9917 175.5538 119 G 4.1316 9.1169 110.8570 45.7711 0.0000 173.6317 120 Q 4.4223 8.7820 117.1884 55.9302 29.2648 176.7051 121 G 3.7518 10.4934 105.6235 45.1896 0.0000 173.7817 122 T 4.4527 7.9317 114.5853 62.1705 73.0210 173.3801 123 Q 4.3199 8.8672 129.2326 56.1598 30.6191 174.9151 124 V 4.7347 8.8316 125.7613 61.5194 34.7041 174.0237 125 T 4.8728 9.1210 125.3165 61.7026 71.3373 173.1934 126 V 5.5889 9.3469 127.0708 60.3006 33.5623 174.8609 127 S 4.8789 8.4231 121.0850 56.1184 66.6506 173.3594 128 S 4.4407 8.7141 118.2248 59.0188 63.3789 174.8853 *129 R 4.1503 8.3094 120.1553 56.4587 29.8986 176.0030 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 2 V 8.04 4.08 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 0.76 0.00 0.00 -0.13 0.00 0.00 3 Q 7.47 4.45 0.00 2.05 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.73 0.00 0.00 0.00 0.00 0.00 2.17 2.34 0.00 4 L 8.64 5.16 0.00 1.51 1.53 0.92 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 5 V 8.56 4.36 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 0.99 0.00 0.00 0.93 0.00 0.00 6 E 8.89 5.17 0.00 2.06 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 2.36 2.35 0.00 7 S 9.61 4.44 0.00 3.38 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 8 G 8.62 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 0.00 0.00 0.00 9 G 8.47 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 0.00 0.00 0.00 10 G 7.10 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 S 8.12 5.39 0.00 3.85 3.84 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 0.00 0.00 0.00 12 V 9.21 4.57 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 0.70 0.00 0.00 0.94 0.00 0.00 13 Q 8.56 4.79 0.00 2.15 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.97 0.00 0.00 0.00 0.00 0.00 2.39 2.36 0.00 14 A 8.46 4.19 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 15 G 9.21 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 16 G 8.14 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 17 S 8.03 4.88 0.00 3.82 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 18 L 7.43 4.30 0.00 1.53 1.19 0.75 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 19 R 7.91 4.57 0.00 2.06 1.66 0.00 3.17 0.00 0.00 3.30 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.50 0.00 20 L 8.18 4.40 0.00 0.48 0.82 0.23 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 21 S 8.72 5.36 0.00 3.93 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 9.78 5.55 0.00 2.85 2.85 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 23 T 9.09 5.46 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 24 A 8.55 5.05 1.19 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 25 S 8.51 4.50 0.00 3.85 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 26 G 9.00 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 27 G 7.79 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 28 S 8.32 4.56 0.00 3.97 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 *31 S 7.58 4.31 0.00 3.98 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 32 Y 8.69 3.99 0.00 3.01 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 S 8.33 4.45 0.00 4.05 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 34 T 7.90 4.11 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 1.04 0.00 0.00 35 F 8.39 4.99 0.00 2.50 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 36 S 8.76 4.82 0.00 3.56 3.24 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 0.00 37 L 9.13 5.47 0.00 1.62 1.50 0.81 1.05 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 38 G 8.79 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 39 W 9.77 5.46 0.00 3.40 3.38 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 40 F 9.73 5.40 0.00 3.29 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 41 R 9.02 5.09 0.00 0.80 0.89 0.00 2.47 0.00 0.00 2.88 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.41 0.00 42 Q 8.62 4.77 0.00 2.35 2.20 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 2.34 2.37 0.00 43 A 8.59 4.84 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 44 P 0.00 4.37 0.00 2.07 2.05 0.00 3.68 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.11 0.00 45 G 8.81 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 0.00 0.00 0.00 0.00 46 Q 7.35 4.15 0.00 2.05 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.84 0.00 0.00 0.00 0.00 0.00 2.41 2.35 0.00 47 E 8.28 4.27 0.00 1.98 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 2.31 2.30 0.00 48 R 8.37 4.50 0.00 1.74 1.83 0.00 3.25 0.00 0.00 3.03 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 2.10 0.00 49 E 8.63 4.88 0.00 2.12 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.23 0.00 50 A 8.34 3.75 0.70 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 51 V 8.56 4.25 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 1.33 0.00 0.00 1.04 0.00 0.00 52 A 7.69 5.10 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 A 8.91 5.18 1.46 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 54 I 10.02 5.27 1.99 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 1.20 2.84 1.08 0.00 0.00 55 A 8.85 4.29 1.12 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 0.00 0.00 56 S 8.50 4.53 0.00 4.18 4.11 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 0.00 0.00 0.00 57 M 9.35 3.07 0.00 1.67 1.34 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 2.19 0.00 58 G 8.62 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 59 G 7.29 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 L 8.28 4.73 0.00 1.75 1.41 1.03 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 61 T 7.91 4.99 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 1.31 0.00 0.00 62 Y 8.58 4.76 0.00 2.91 2.85 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 63 Y 8.62 5.40 0.00 2.83 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 64 A 9.19 4.18 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 65 D 8.89 4.30 0.00 2.71 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 S 8.07 4.16 0.00 3.90 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 67 V 7.30 3.93 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 0.00 0.00 0.05 0.00 0.00 0.90 0.00 0.00 68 K 7.76 4.00 0.00 1.86 1.66 0.00 1.76 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.34 1.27 7.81 69 G 8.75 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 R 7.70 4.29 0.00 2.03 2.17 0.00 3.28 0.00 0.00 3.35 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.63 0.00 71 F 8.03 4.80 0.00 2.88 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 72 T 8.84 4.64 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 73 I 9.17 5.12 2.13 0.00 0.00 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 1.50 1.29 0.87 0.00 0.00 74 S 9.41 5.02 0.00 3.93 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 75 R 8.48 5.20 0.00 2.00 2.04 0.00 3.07 0.00 0.00 3.23 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.74 0.00 76 D 9.31 4.72 0.00 2.69 2.54 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 77 N 8.97 4.62 0.00 2.89 3.02 0.00 0.00 6.92 7.54 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 78 A 8.16 3.97 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 K 8.56 4.10 0.00 1.64 1.77 0.00 1.91 0.00 0.00 1.68 0.00 0.00 2.95 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.38 1.54 7.81 80 N 7.20 3.14 0.00 2.61 2.17 0.00 0.00 6.68 6.93 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 81 T 7.49 5.16 4.20 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 1.32 0.00 0.00 82 V 9.27 5.08 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 1.35 0.00 0.00 1.08 0.00 0.00 83 T 9.60 5.26 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 1.21 0.00 0.00 84 L 8.68 4.84 0.00 0.36 0.30 1.09 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 85 Q 9.08 4.35 0.00 2.08 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.64 6.61 0.00 0.00 0.00 0.00 0.00 2.22 2.27 0.00 86 M 7.99 3.68 0.00 0.96 1.48 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.81 0.00 87 N 8.60 4.25 0.00 2.72 2.81 0.00 0.00 6.93 7.76 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 88 N 7.66 4.74 0.00 2.74 2.78 0.00 0.00 6.98 7.78 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 89 L 8.18 4.52 0.00 1.74 1.60 0.82 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 90 K 9.21 4.98 0.00 1.71 1.81 0.00 1.69 0.00 0.00 1.66 0.00 0.00 2.84 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.36 1.62 7.81 91 P 0.00 4.50 0.00 2.19 2.14 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 2.13 2.14 0.00 92 E 8.11 4.16 0.00 1.98 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.28 0.00 93 D 8.57 4.67 0.00 2.90 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 94 T 7.51 4.24 4.41 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 1.26 0.00 0.00 95 A 8.63 4.35 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 96 I 7.71 4.61 1.84 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 0.39 1.25 1.00 0.00 0.00 97 Y 9.15 5.08 0.00 3.06 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 98 Y 9.23 5.18 0.00 3.29 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 99 C 8.91 4.39 0.00 2.16 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 0.00 100 A 7.81 4.87 -0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 9.09 5.80 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 0.00 102 V 8.39 4.51 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 0.44 0.00 0.00 0.80 0.00 0.00 103 R 8.26 3.68 0.00 0.96 1.53 0.00 3.02 0.00 0.00 3.04 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.04 0.00 104 G 7.70 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 0.00 105 Y 7.93 4.39 0.00 2.64 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 0.00 106 F 5.66 4.36 0.00 2.73 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 0.00 107 M 8.01 5.04 0.00 2.05 2.00 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.45 0.00 108 R 6.91 4.25 0.00 1.51 1.64 0.00 3.15 0.00 0.00 3.10 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.50 0.00 109 L 8.22 3.79 0.00 1.65 1.59 0.81 0.79 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 0.00 110 P 0.00 4.11 0.00 1.91 0.64 0.00 3.34 0.00 0.00 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.91 0.00 111 S 8.11 5.07 0.00 4.08 4.05 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 0.00 112 S 8.96 4.04 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 0.00 113 H 7.68 4.46 0.00 3.26 3.41 0.00 5.65 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 0.00 114 N 8.16 4.42 0.00 2.65 2.26 0.00 0.00 6.84 6.78 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 0.00 115 F 7.70 4.78 0.00 2.43 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 0.00 116 R 8.42 4.61 0.00 1.62 1.86 0.00 2.40 0.00 0.00 2.89 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.62 0.00 117 Y 8.15 5.06 0.00 3.22 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 W 9.06 5.22 0.00 3.07 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 0.00 119 G 9.12 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 Q 8.78 4.42 0.00 2.14 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.69 0.00 0.00 0.00 0.00 0.00 2.40 2.35 0.00 121 G 10.49 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 0.00 122 T 7.93 4.45 4.35 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 1.26 0.00 0.00 123 Q 8.87 4.32 0.00 2.19 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.85 0.00 0.00 0.00 0.00 0.00 2.44 2.44 0.00 124 V 8.83 4.73 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.64 0.00 0.00 125 T 9.12 4.87 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 1.22 0.00 0.00 126 V 9.35 5.59 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 0.82 0.00 0.00 0.94 0.00 0.00 127 S 8.42 4.88 0.00 3.89 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 0.00 128 S 8.71 4.44 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 *129 R 8.31 4.15 0.00 1.62 1.73 0.00 3.28 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.69 0.00 * Residues marked with a * may have inaccurate shift predictions.