NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 G 3.9311 8.3549 109.7164 45.0218 0.0000 174.5778 17 I 3.7442 7.2921 120.1129 62.8268 37.7727 175.2688 18 T 3.8221 7.8651 116.6061 62.8049 69.9307 174.3939 19 G 3.5389 7.2565 113.2004 45.2943 0.0000 170.4254 20 T 4.7613 7.4185 116.6181 61.4771 70.5002 174.3484 21 W 5.1262 8.8836 125.2075 55.0393 33.7329 173.8143 22 Y 5.5392 9.4826 120.4219 56.4410 41.3883 175.0981 23 N 5.5510 9.1692 121.2941 49.9760 40.4818 174.9590 24 Q 4.9495 7.9796 116.9400 54.9344 28.0117 176.3823 25 L 4.5090 8.1661 111.0607 55.0730 43.6389 177.6260 26 G 3.9743 8.6960 104.8111 45.9487 0.0000 174.1174 27 S 5.0521 8.3764 115.5899 57.3163 65.7008 173.3662 28 T 4.8147 8.6525 118.3179 61.7750 72.6213 172.7132 29 F 5.0538 9.0729 128.3307 56.4279 42.2879 173.6066 30 I 4.7082 8.7512 128.2329 59.4106 39.2305 175.1956 31 V 4.6889 8.0619 126.3015 59.9506 35.0628 174.5065 32 T 4.6610 9.0346 119.2913 61.7234 71.2142 172.9740 33 A 4.7411 8.3975 129.0890 50.1621 19.8957 177.1962 34 G 3.8165 8.9986 111.5544 45.4011 0.0000 174.0495 35 A 4.1661 8.4792 122.9206 54.2118 18.5379 178.2903 36 D 4.5054 8.0763 113.6617 53.5118 40.1574 177.2778 37 G 3.4379 8.4376 109.1222 45.0272 0.0000 172.9884 38 A 4.8743 8.0449 121.6429 51.2899 20.5012 176.8091 39 L 5.2395 9.2897 121.2232 53.1441 44.5699 175.8893 40 T 4.8684 9.4046 113.8899 59.4454 72.4803 174.6168 41 G 3.8687 7.0411 108.6909 46.5342 0.0000 170.9848 42 T 5.1326 8.0531 116.4138 61.8890 72.8571 172.6232 43 Y 5.0748 9.2961 127.4338 55.8370 41.1634 173.8503 44 E 5.3848 9.2933 125.6882 54.9148 32.0434 176.5352 45 S 4.7715 9.0752 117.8762 58.8428 64.1196 173.6630 *49 N 4.3816 8.0297 117.4965 53.4282 39.4687 173.7592 50 A 4.4112 8.2592 124.7231 53.2442 19.6685 178.6947 51 E 4.0451 8.0477 114.8484 58.9372 29.8981 177.7335 52 S 4.9940 8.0311 112.6111 58.3752 64.3785 173.5547 53 R 5.1042 7.7433 119.5814 55.2457 31.2184 175.4528 54 Y 4.8154 9.0562 120.6772 55.8974 42.4753 174.9999 55 V 4.3650 8.5733 122.7353 62.8376 32.3596 175.0315 56 L 5.2024 8.7425 126.8118 54.5986 44.1110 175.0735 57 T 4.8208 8.5548 113.2591 61.5970 71.5137 172.9110 58 G 4.7560 8.6932 113.2809 46.2808 0.0000 171.8194 59 R 5.6400 8.9013 117.4089 55.0718 34.8510 174.1548 60 Y 5.2559 8.4746 118.1213 55.7274 41.4818 174.5692 61 D 4.3319 9.2444 120.7254 53.8199 40.2830 176.6609 62 S 4.2202 8.0452 120.2921 58.8892 63.9832 174.5299 63 A 4.6691 7.9061 123.3766 50.3616 18.6096 173.7930 64 P 4.7736 0.0000 0.0000 60.4472 33.0619 177.1156 65 A 4.2304 8.3983 122.1138 52.7703 18.8540 177.6840 66 T 4.7027 8.2851 109.7339 61.8201 69.2652 174.5196 67 D 4.7884 8.5053 117.8914 54.2563 39.8296 176.7770 68 G 3.9699 8.3943 106.9376 45.7255 0.0000 174.3888 69 S 4.3517 7.8050 115.3007 58.0285 63.4916 174.2669 70 G 4.0283 8.3301 110.3889 46.1437 0.0000 172.5902 71 T 4.8121 8.8620 116.6457 61.6688 70.0709 174.9577 72 A 4.8546 8.7213 129.1499 52.1964 20.1004 175.7881 73 L 4.9715 8.6790 119.2861 55.7642 44.6363 173.5708 74 G 4.6044 9.3364 105.9286 45.6907 0.0000 171.9563 75 W 5.7414 8.4936 116.2621 55.7770 32.3105 173.4626 76 T 5.2711 9.2113 116.8482 61.8120 71.9969 173.2722 77 V 4.5797 8.5978 124.9361 60.9489 34.1131 173.9283 78 A 4.6025 8.3372 129.9874 49.8096 20.0369 177.5510 79 W 4.0676 8.5650 126.0311 56.5125 28.8734 176.3933 80 K 5.2186 7.9835 118.6013 54.6483 34.7251 174.2854 81 N 5.0254 8.8483 122.9945 51.7203 39.8695 174.1915 82 N 4.3477 8.2979 114.2902 54.7010 38.8304 175.0976 83 Y 4.7260 7.2682 115.4122 58.7105 39.9846 175.5931 84 R 4.6853 8.6246 114.6592 55.2601 32.6880 173.6994 85 N 5.1810 8.4051 116.4643 52.8856 40.6551 173.6987 86 A 4.2391 8.9719 128.7442 52.0813 19.7791 176.1952 87 H 4.1828 8.5707 113.6320 55.7793 26.8613 173.5411 88 S 5.2024 7.4469 111.0991 57.9689 66.6074 174.8859 89 A 5.0884 9.1199 121.6981 51.0173 22.9975 175.2009 90 T 4.9268 8.9475 118.2716 61.7611 71.5664 173.4283 91 T 4.9101 8.5209 115.9412 59.6119 71.8738 172.8046 92 W 4.8186 8.9635 125.2778 54.7768 31.6606 174.6756 93 S 4.7966 8.8888 119.8554 56.7570 64.8261 173.2127 94 G 4.1136 8.3810 112.7429 46.6868 0.0000 171.7214 95 Q 5.2012 8.4710 117.4998 54.9585 32.8063 173.4531 96 Y 4.8764 9.1443 123.1407 56.9897 40.8544 174.2858 97 V 3.9220 8.2911 126.1315 60.9954 34.3872 175.6055 98 G 3.9772 8.0515 116.2649 44.6052 0.0000 169.9299 99 G 3.7730 9.0984 104.6302 43.7847 0.0000 173.5344 100 A 4.1274 8.8355 121.4560 54.8926 18.5806 178.5254 101 E 4.5848 7.7677 111.8410 53.8953 28.8058 175.2482 102 A 4.5108 7.6577 123.1256 53.8471 19.6345 177.9305 103 R 5.3120 8.8502 115.0710 55.4274 33.7830 173.8743 104 I 4.8747 9.0306 121.6877 59.8566 39.8442 174.2291 105 N 5.5263 9.2725 125.8833 51.8695 40.6502 174.4439 106 T 5.3131 9.4483 113.4853 60.0989 73.0850 172.6913 107 Q 5.2075 9.2852 121.5077 53.8953 32.4328 174.7011 108 W 5.3449 8.3093 118.6397 54.6457 32.4359 173.7763 109 L 5.2732 8.8060 120.1597 52.8926 44.7525 175.2831 110 L 4.9678 9.4319 126.6024 53.7115 44.3350 174.8745 111 T 5.0894 8.8551 123.8045 62.0437 70.8167 173.9380 112 S 5.1216 8.5467 122.4898 56.6388 65.2686 174.2783 113 G 3.9434 8.7907 111.5058 46.4243 0.0000 173.2892 114 T 4.8280 8.3540 114.3942 59.6899 72.4330 173.4798 115 T 4.3178 8.1391 112.6287 60.8576 70.1689 175.2632 116 E 3.9123 8.8207 120.4679 59.4831 29.4471 179.3019 117 A 4.2630 7.9169 119.0979 53.6287 19.2201 177.8646 118 N 5.0651 8.0587 112.0261 53.0281 38.9497 176.1146 119 A 4.4149 7.8892 122.9684 53.3399 18.5358 179.0993 120 F 4.5861 8.5550 112.2693 57.5922 38.6006 176.1597 121 K 4.2021 7.8346 118.5283 56.5843 32.9413 176.9464 122 S 4.6116 7.9568 114.1425 59.9480 64.7276 173.1698 123 T 5.1091 7.6910 117.0868 61.8888 71.3592 173.2630 124 L 4.7841 9.2076 126.9041 53.2623 44.1409 175.9234 125 V 4.3925 7.8860 120.8636 60.3376 34.1839 175.3495 126 G 3.0213 6.5636 108.2040 45.8686 0.0000 171.2537 127 H 5.3698 7.9333 113.9321 54.6110 31.9904 172.6686 128 D 4.9290 9.3355 118.2795 53.4018 45.8550 174.3880 129 T 5.2116 8.5827 118.8648 61.9177 71.4528 172.9574 130 F 5.5996 9.4202 125.0322 56.2571 42.1606 174.8750 131 T 5.5051 9.4415 117.9432 61.9146 72.6816 174.8985 132 K 3.9887 8.7922 120.9332 56.6911 32.5464 177.8685 133 V 3.7742 8.0058 117.8187 61.9739 31.4419 175.8833 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 16 G 8.35 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 17 I 7.29 3.74 1.37 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.59 -0.11 0.56 0.00 0.00 18 T 7.87 3.82 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 1.14 0.00 0.00 19 G 7.26 3.54 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 0.00 20 T 7.42 4.76 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 0.71 0.00 0.00 21 W 8.88 5.13 0.00 3.13 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 22 Y 9.48 5.54 0.00 2.97 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 23 N 9.17 5.55 0.00 2.27 2.16 0.00 0.00 6.55 7.07 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 24 Q 7.98 4.95 0.00 2.21 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 7.52 0.00 0.00 0.00 0.00 0.00 2.30 2.34 0.00 25 L 8.17 4.51 0.00 1.70 1.69 0.97 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 26 G 8.70 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 27 S 8.38 5.05 0.00 4.20 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 28 T 8.65 4.81 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 1.02 0.00 0.00 29 F 9.07 5.05 0.00 2.50 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 30 I 8.75 4.71 1.73 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 1.13 0.21 0.74 0.00 0.00 31 V 8.06 4.69 0.98 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 0.15 0.00 0.00 0.70 0.00 0.00 32 T 9.03 4.66 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 1.14 0.00 0.00 33 A 8.40 4.74 0.60 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 0.00 0.00 34 G 9.00 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 0.00 0.00 0.00 35 A 8.48 4.17 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 36 D 8.08 4.51 0.00 2.79 2.79 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 37 G 8.44 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 0.00 0.00 0.00 38 A 8.04 4.87 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 39 L 9.29 5.24 0.00 1.74 1.60 0.76 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 40 T 9.40 4.87 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 1.22 0.00 0.00 41 G 7.04 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 42 T 8.05 5.13 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 1.24 0.00 0.00 43 Y 9.30 5.07 0.00 2.91 2.86 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 44 E 9.29 5.38 0.00 2.06 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 2.17 2.22 0.00 45 S 9.08 4.77 0.00 4.03 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 *49 N 8.03 4.38 0.00 2.72 2.78 0.00 0.00 6.99 7.96 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 50 A 8.26 4.41 1.24 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 0.00 0.00 51 E 8.05 4.05 0.00 2.24 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 1.96 2.21 0.00 52 S 8.03 4.99 0.00 3.86 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 53 R 7.74 5.10 0.00 1.82 1.84 0.00 3.16 0.00 0.00 3.29 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.84 0.00 54 Y 9.06 4.82 0.00 2.87 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 55 V 8.57 4.36 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 0.80 0.00 0.00 0.93 0.00 0.00 56 L 8.74 5.20 0.00 1.95 1.71 0.75 0.29 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 57 T 8.55 4.82 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 1.26 0.00 0.00 58 G 8.69 4.76 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 59 R 8.90 5.64 0.00 1.76 1.89 0.00 3.34 0.00 0.00 3.25 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.75 0.00 60 Y 8.47 5.26 0.00 3.11 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 61 D 9.24 4.33 0.00 2.79 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 62 S 8.05 4.22 0.00 3.88 3.42 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 63 A 7.91 4.67 1.21 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 0.00 0.00 0.00 64 P 0.00 4.77 0.00 2.28 2.17 0.00 3.44 0.00 0.00 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.05 0.00 65 A 8.40 4.23 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 66 T 8.29 4.70 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 1.25 0.00 0.00 67 D 8.51 4.79 0.00 2.79 2.77 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 68 G 8.39 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 69 S 7.80 4.35 0.00 3.98 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 70 G 8.33 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 71 T 8.86 4.81 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 1.47 0.00 0.00 72 A 8.72 4.85 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 73 L 8.68 4.97 0.00 2.13 1.98 1.01 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 74 G 9.34 4.60 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 0.00 0.00 0.00 75 W 8.49 5.74 0.00 3.49 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 76 T 9.21 5.27 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 1.25 0.00 0.00 77 V 8.60 4.58 1.55 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 -0.47 0.00 0.00 0.78 0.00 0.00 78 A 8.34 4.60 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 79 W 8.57 4.07 0.00 3.33 2.95 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 80 K 7.98 5.22 0.00 1.94 1.73 0.00 1.76 0.00 0.00 1.79 0.00 0.00 3.06 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.34 1.43 7.81 81 N 8.85 5.03 0.00 2.74 2.62 0.00 0.00 6.65 6.58 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 82 N 8.30 4.35 0.00 1.81 2.44 0.00 0.00 6.64 7.46 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 83 Y 7.27 4.73 0.00 3.27 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 84 R 8.62 4.69 0.00 2.07 2.11 0.00 3.05 0.00 0.00 3.36 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.89 0.00 85 N 8.41 5.18 0.00 2.67 2.62 0.00 0.00 6.91 7.96 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 86 A 8.97 4.24 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 87 H 8.57 4.18 0.00 3.35 3.32 0.00 5.66 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 S 7.45 5.20 0.00 4.00 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 89 A 9.12 5.09 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 90 T 8.95 4.93 4.01 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 -0.63 0.00 0.00 91 T 8.52 4.91 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 1.17 0.00 0.00 92 W 8.96 4.82 0.00 1.78 1.91 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 93 S 8.89 4.80 0.00 3.77 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 94 G 8.38 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 0.00 0.00 0.00 95 Q 8.47 5.20 0.00 2.17 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.87 0.00 0.00 0.00 0.00 0.00 2.29 2.36 0.00 96 Y 9.14 4.88 0.00 3.05 2.90 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 97 V 8.29 3.92 1.99 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 0.84 0.00 0.00 0.91 0.00 0.00 98 G 8.05 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 0.00 0.00 0.00 99 G 9.10 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 0.00 0.00 0.00 100 A 8.84 4.13 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 0.00 101 E 7.77 4.58 0.00 2.11 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 2.20 2.30 0.00 102 A 7.66 4.51 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 0.00 103 R 8.85 5.31 0.00 2.04 2.36 0.00 2.79 0.00 0.00 3.28 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.68 0.00 104 I 9.03 4.87 1.69 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 -0.36 1.05 0.00 0.00 105 N 9.27 5.53 0.00 2.69 2.80 0.00 0.00 6.06 7.83 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 0.00 106 T 9.45 5.31 4.45 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 1.40 0.00 0.00 107 Q 9.29 5.21 0.00 1.87 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.70 0.00 0.00 0.00 0.00 0.00 2.21 2.23 0.00 108 W 8.31 5.34 0.00 2.69 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 0.00 0.00 0.00 109 L 8.81 5.27 0.00 1.52 1.54 0.87 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 110 L 9.43 4.97 0.00 1.53 1.66 0.92 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 111 T 8.86 5.09 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 0.00 112 S 8.55 5.12 0.00 3.76 3.78 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 0.00 113 G 8.79 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 0.00 114 T 8.35 4.83 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 1.30 0.00 0.00 115 T 8.14 4.32 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 1.22 0.00 0.00 116 E 8.82 3.91 0.00 2.02 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 2.41 2.26 0.00 117 A 7.92 4.26 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 0.00 118 N 8.06 5.07 0.00 2.82 2.89 0.00 0.00 6.72 6.88 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 0.00 119 A 7.89 4.41 1.44 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 0.00 0.00 120 F 8.55 4.59 0.00 3.20 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 0.00 121 K 7.83 4.20 0.00 1.52 1.20 0.00 1.56 0.00 0.00 1.70 0.00 0.00 3.23 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.50 1.26 7.81 122 S 7.96 4.61 0.00 4.09 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 0.00 123 T 7.69 5.11 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 1.23 0.00 0.00 124 L 9.21 4.78 0.00 1.70 1.74 0.95 0.64 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 0.00 125 V 7.89 4.39 1.89 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 0.52 0.00 0.00 0.69 0.00 0.00 126 G 6.56 3.02 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 0.00 127 H 7.93 5.37 0.00 3.16 3.10 0.00 5.71 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 D 9.34 4.93 0.00 3.16 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 0.00 129 T 8.58 5.21 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 1.40 0.00 0.00 130 F 9.42 5.60 0.00 3.11 3.35 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 0.00 131 T 9.44 5.51 4.48 0.00 0.00 0.00 0.00 0.00 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 0.00 132 K 8.79 3.99 0.00 1.54 1.56 0.00 1.40 0.00 0.00 1.36 0.00 0.00 2.32 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.30 0.45 7.81 133 V 8.01 3.77 1.99 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 0.69 0.00 0.00 0.98 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.