NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3078 8.2644 123.5811 52.4241 19.7711 176.0106 2 S 4.2237 8.1280 110.8549 56.6207 63.1252 171.5252 3 A 3.7683 7.8825 126.1963 52.3313 17.8119 176.3164 4 A 4.2372 7.1211 121.0512 51.5380 20.0865 177.8158 5 K 4.5902 7.0085 118.4528 56.7949 32.2205 176.2822 6 G 4.0873 9.0880 114.1531 48.8019 0.0000 175.2408 7 D 3.3700 7.3044 113.5894 50.9271 43.6919 175.2875 8 H 3.8999 8.6981 116.5910 57.1985 28.5283 175.9545 9 G 3.9407 8.0228 107.9393 48.5338 0.0000 173.5533 10 G 3.8151 7.1254 105.6190 45.6560 0.0000 171.0188 *12 G 3.8741 7.9136 107.8055 45.4661 0.0000 172.7932 13 A 4.1424 8.6186 119.3850 55.2360 18.3432 179.9080 14 R 3.9300 8.0740 116.7901 60.0354 30.1994 178.7850 15 T 3.9444 7.8973 115.0011 66.4507 68.4932 176.6865 16 W 3.9247 8.4251 120.8156 59.2374 28.9907 178.7133 17 R 3.8698 8.6369 119.5884 59.2630 29.4488 178.2233 18 F 4.2260 8.3535 120.5238 61.5048 39.2572 177.1647 19 L 3.9824 8.1486 118.5645 57.8700 41.2701 179.5569 20 T 3.8031 8.0496 115.7791 66.7597 68.2517 176.4544 21 F 4.7918 8.2919 117.6592 59.1136 39.2661 177.6075 22 G 4.0828 8.5785 104.6276 45.2822 0.0000 173.8747 23 L 4.5261 7.6967 119.7940 56.3494 44.4821 178.0837 24 A 3.9555 8.4330 120.4743 55.4063 18.3121 179.7268 25 L 4.0270 8.3786 117.7714 57.1942 41.6116 177.8319 26 P 4.2771 0.0000 0.0000 65.7499 31.2058 178.4199 27 S 4.1100 8.0337 113.8156 61.8315 62.7393 177.1136 28 V 3.5173 7.8210 120.3674 65.8146 31.2453 177.7624 29 A 3.9920 8.3815 120.9172 55.2302 18.1912 179.6017 30 L 3.9145 8.1731 117.6327 58.3146 41.7621 179.6861 31 C 4.1336 8.3087 116.7942 62.9150 27.9010 176.3716 32 T 3.5072 8.1745 117.9511 66.1781 67.7688 176.4236 33 L 3.9101 7.7297 121.1486 58.1532 42.4851 177.8739 34 N 4.2484 8.3169 117.3592 56.9986 38.4098 176.7875 35 S 3.8818 8.2041 116.3086 60.8505 63.4196 175.9522 36 W 5.5180 7.7426 120.7550 55.4126 27.7129 175.2126 37 L 4.6059 7.3548 122.1961 56.5692 49.3292 174.7067 38 H 5.0042 8.0118 114.4808 56.1129 29.5715 176.4920 39 S 4.6199 7.5362 120.1487 59.9952 63.3940 170.3954 40 G 3.8810 8.9126 116.4794 45.2654 0.0000 172.7554 41 H 4.2381 8.6590 122.0463 56.4730 29.1824 175.4195 42 R 4.4068 8.3326 122.9457 54.5429 31.4454 175.8450 43 E 4.0158 8.5806 121.7246 55.7911 29.7815 176.9912 44 R 4.0736 8.4291 123.7465 55.5940 30.0674 174.7484 45 P 4.5510 0.0000 0.0000 61.6840 32.5124 175.7740 46 A 4.1433 8.5282 122.2021 52.7516 18.7226 177.2278 47 F 4.6147 8.8778 123.8541 57.7810 40.3029 175.0171 48 I 3.9730 7.0466 127.4893 58.7528 40.7282 174.6121 49 P 4.0820 0.0000 0.0000 61.5813 30.1273 176.3805 50 Y 4.1982 6.9776 117.0910 59.6025 38.7418 177.7995 51 H 4.3923 8.9367 120.2997 57.3495 29.2859 175.6486 52 H 4.6851 8.2715 113.6384 55.5445 29.0491 174.4645 53 L 4.7055 7.1429 119.3827 53.3065 45.0665 175.7641 54 R 3.8436 8.5215 115.9804 57.4679 27.4902 177.3455 55 I 3.9166 7.5311 116.7714 61.3709 38.1009 177.1861 56 R 4.2427 8.2085 123.0744 54.8236 31.3944 174.5911 57 T 4.3417 8.0760 112.1436 61.4874 70.2438 175.1051 58 K 4.4695 7.2052 121.5033 54.0557 35.2134 173.5543 59 P 4.2430 0.0000 0.0000 61.9891 32.1672 176.5888 60 F 3.9865 8.0915 120.2292 57.8016 39.0956 175.6466 61 S 4.3783 7.7845 117.9878 58.1417 63.0455 173.9799 62 W 5.0772 7.5413 116.3246 55.9402 31.7559 175.2494 63 G 3.8108 8.5169 107.5989 47.3599 0.0000 174.3333 64 D 4.5923 8.8821 124.7584 53.0588 39.8052 177.6823 65 G 3.8614 8.5401 110.1735 45.5370 0.0000 174.3158 66 N 5.0049 8.4430 115.1384 53.1192 40.1237 173.1148 67 H 4.8763 8.1211 114.0813 54.4299 31.0159 174.3780 68 T 3.6643 8.2646 113.7813 60.9160 69.5949 175.1433 69 F 3.2232 8.6207 123.9281 60.1800 39.4528 175.6037 70 F 5.1024 7.5016 118.3529 56.3975 39.5170 175.2511 71 H 3.9958 7.8502 120.1354 56.7655 30.2120 173.5265 72 N 4.8138 8.4096 124.8692 51.0223 39.6567 172.8316 73 P 4.2862 0.0000 0.0000 65.4559 31.7619 178.2031 74 R 4.0299 8.1556 117.9319 58.6060 29.9721 177.2986 75 V 4.4901 7.7332 106.5742 60.6088 33.4740 174.9770 76 N 4.8736 8.3415 118.3846 50.5224 38.5787 172.8033 77 P 4.0486 0.0000 0.0000 61.8678 32.2503 176.4906 78 L 4.2859 8.0611 120.4477 53.4193 42.4539 176.3259 79 P 4.3032 0.0000 0.0000 66.0198 31.1146 177.6787 80 T 4.2292 7.5416 104.9962 61.0783 69.3358 172.8326 81 G 2.0000 7.2204 108.6766 43.6284 0.0000 173.0459 82 Y 4.3119 7.5322 116.0393 57.7214 38.3906 176.2908 83 E 4.2313 8.5896 122.4633 55.6817 30.5029 177.2703 84 K 4.0496 8.7156 119.8898 57.1890 32.0873 176.8678 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 A 8.26 4.31 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 2 S 8.13 4.22 0.00 3.84 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 3 A 7.88 3.77 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 4 A 7.12 4.24 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 5 K 7.01 4.59 0.00 1.60 1.25 0.00 1.67 0.00 0.00 1.54 0.00 0.00 2.98 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.27 1.31 7.81 6 G 9.09 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 0.00 0.00 0.00 0.00 7 D 7.30 3.37 0.00 2.55 2.27 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 8 H 8.70 3.90 0.00 3.20 3.35 0.00 5.98 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 G 8.02 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 10 G 7.13 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 *12 G 7.91 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 13 A 8.62 4.14 1.39 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 0.00 0.00 0.00 0.00 0.00 0.00 14 R 8.07 3.93 0.00 1.94 2.00 0.00 3.21 0.00 0.00 3.38 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.78 0.00 15 T 7.90 3.94 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 0.74 0.00 0.00 16 W 8.43 3.92 0.00 3.52 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 17 R 8.64 3.87 0.00 1.94 2.18 0.00 3.21 0.00 0.00 3.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.88 0.00 18 F 8.35 4.23 0.00 3.22 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 19 L 8.15 3.98 0.00 1.79 1.60 -0.23 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 20 T 8.05 3.80 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 0.76 0.00 0.00 21 F 8.29 4.79 0.00 3.03 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 22 G 8.58 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 23 L 7.70 4.53 0.00 1.67 1.80 0.91 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 24 A 8.43 3.96 1.39 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 0.00 0.00 0.00 0.00 0.00 0.00 25 L 8.38 4.03 0.00 1.81 1.82 1.07 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 26 P 0.00 4.28 0.00 2.19 2.14 0.00 3.70 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.25 0.00 27 S 8.03 4.11 0.00 4.04 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 28 V 7.82 3.52 2.25 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 1.08 0.00 0.00 0.99 0.00 0.00 29 A 8.38 3.99 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 30 L 8.17 3.91 0.00 1.83 1.71 0.92 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 31 C 8.31 4.13 0.00 2.86 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 32 T 8.17 3.51 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 1.24 0.00 0.00 33 L 7.73 3.91 0.00 1.78 1.88 0.92 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 34 N 8.32 4.25 0.00 2.72 2.84 0.00 0.00 7.32 7.38 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 35 S 8.20 3.88 0.00 2.81 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 36 W 7.74 5.52 0.00 3.20 2.94 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 37 L 7.35 4.61 0.00 1.68 1.86 0.93 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 38 H 8.01 5.00 0.00 3.24 3.29 0.00 5.70 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 S 7.54 4.62 0.00 3.93 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 0.00 40 G 8.91 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 41 H 8.66 4.24 0.00 3.15 3.25 0.00 5.69 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 R 8.33 4.41 0.00 1.84 1.88 0.00 3.25 0.00 0.00 3.18 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 43 E 8.58 4.02 0.00 1.93 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 0.00 2.28 2.24 0.00 44 R 8.43 4.07 0.00 1.94 1.84 0.00 2.52 0.00 0.00 2.96 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.32 0.00 45 P 0.00 4.55 0.00 2.31 2.17 0.00 3.97 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.06 0.00 46 A 8.53 4.14 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 47 F 8.88 4.61 0.00 3.04 3.11 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 48 I 7.05 3.97 1.16 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.60 -0.21 0.00 0.00 49 P 0.00 4.08 0.00 2.06 2.11 0.00 3.36 0.00 0.00 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.93 0.00 50 Y 6.98 4.20 0.00 2.89 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 51 H 8.94 4.39 0.00 3.24 3.41 0.00 5.69 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 H 8.27 4.69 0.00 3.27 3.38 0.00 5.46 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 L 7.14 4.71 0.00 1.58 1.58 0.88 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 54 R 8.52 3.84 0.00 1.95 2.01 0.00 3.34 0.00 0.00 3.30 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.76 0.00 55 I 7.53 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 1.44 0.76 0.89 0.00 0.00 56 R 8.21 4.24 0.00 1.65 1.66 0.00 3.12 0.00 0.00 2.96 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.48 0.00 57 T 8.08 4.34 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 1.17 0.00 0.00 58 K 7.21 4.47 0.00 1.58 1.50 0.00 1.73 0.00 0.00 1.65 0.00 0.00 2.98 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.19 1.37 7.81 59 P 0.00 4.24 0.00 1.95 1.84 0.00 3.62 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.00 0.00 60 F 8.09 3.99 0.00 2.10 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 61 S 7.78 4.38 0.00 4.10 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 0.00 62 W 7.54 5.08 0.00 3.46 3.36 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 63 G 8.52 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 64 D 8.88 4.59 0.00 2.78 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 65 G 8.54 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 66 N 8.44 5.00 0.00 2.62 2.91 0.00 0.00 7.01 7.51 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 67 H 8.12 4.88 0.00 3.18 3.21 0.00 5.95 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 T 8.26 3.66 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 1.34 0.00 0.00 69 F 8.62 3.22 0.00 2.27 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 0.00 0.00 0.00 0.00 70 F 7.50 5.10 0.00 3.14 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 71 H 7.85 4.00 0.00 3.26 3.32 0.00 5.89 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 N 8.41 4.81 0.00 2.74 2.66 0.00 0.00 7.20 7.71 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 73 P 0.00 4.29 0.00 2.12 2.34 0.00 3.74 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.18 0.00 74 R 8.16 4.03 0.00 2.02 1.93 0.00 3.13 0.00 0.00 3.16 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.56 0.00 75 V 7.73 4.49 2.18 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 0.84 0.00 0.00 0.97 0.00 0.00 76 N 8.34 4.87 0.00 2.73 2.84 0.00 0.00 6.97 8.43 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 77 P 0.00 4.05 0.00 1.57 0.57 0.00 3.76 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.88 0.00 78 L 8.06 4.29 0.00 1.68 1.55 0.87 0.73 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 79 P 0.00 4.30 0.00 2.04 2.16 0.00 3.63 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.26 0.00 80 T 7.54 4.23 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 1.20 0.00 0.00 81 G 7.22 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.53 4.31 0.00 2.97 2.87 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 83 E 8.59 4.23 0.00 2.05 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 2.34 2.36 0.00 84 K 8.72 4.05 0.00 1.73 1.76 0.00 1.68 0.00 0.00 1.75 0.00 0.00 3.09 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.46 1.52 7.81 * Residues marked with a * may have inaccurate shift predictions.