NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 S 4.3038 8.3344 115.4132 58.0388 64.2976 173.5359 1 L 4.2312 8.1954 126.2419 52.3070 40.9851 173.6735 2 K 4.7052 8.1772 124.3609 56.3059 37.2591 175.7367 3 G 4.0043 8.5298 105.0960 45.0056 0.0000 171.9467 4 L 4.4913 8.3737 120.5993 55.3187 42.3002 177.8741 5 R 4.4619 9.5427 123.7862 56.7724 32.1822 176.6715 6 R 5.7784 7.6474 117.2875 53.7352 34.0312 173.7979 7 L 5.2904 8.5342 123.7711 52.9581 46.5698 175.5403 8 V 4.8194 8.5959 121.7633 61.3556 34.2058 173.9919 9 L 5.1844 9.2176 128.7886 52.9693 44.5553 175.2723 10 D 4.9044 9.3018 124.1860 53.4025 42.4439 175.2169 11 V 4.8663 8.8102 125.9212 60.9459 35.3736 173.7670 12 L 5.2501 8.4571 128.2617 53.4052 45.0155 175.0772 13 K 4.7183 8.3430 122.1331 55.5655 36.1475 172.9470 14 P 4.7992 0.0000 0.0000 62.1277 31.9285 176.1345 15 H 4.3268 7.7150 119.7753 58.5632 28.8841 175.9400 16 E 4.6837 7.9125 117.3672 53.7375 31.1376 174.1071 17 P 4.6384 0.0000 0.0000 61.6074 32.6275 175.8617 18 K 4.2164 8.4039 118.3777 56.5686 32.6391 178.4768 19 T 3.9883 8.3707 111.0099 64.6101 68.6855 176.7682 20 I 3.7462 7.7967 115.9538 64.0686 37.5433 178.5408 21 V 3.6856 7.6541 112.8175 64.0378 31.2849 178.4964 22 F 3.9116 8.5308 116.8955 60.6033 38.7644 177.3224 23 A 4.0462 8.5092 120.7058 55.0211 18.0708 179.5191 24 L 3.8683 8.0420 118.6981 58.3581 42.0856 179.1928 25 K 3.9096 8.2532 117.3572 59.6554 32.1720 179.0848 26 L 4.1477 8.3274 119.6598 57.6053 41.2903 179.5644 27 S 4.2314 7.7726 113.2007 60.6740 63.1880 175.4040 28 E 4.2679 7.5847 119.7932 55.8276 30.0090 176.6228 29 L 4.1797 7.2092 121.0996 53.9681 42.4473 176.4459 30 E 4.0972 8.3581 123.0396 57.6143 30.4046 176.5520 31 N 4.5733 8.9437 120.3049 53.1156 37.1995 174.2020 32 V 4.5249 7.1417 117.5425 61.6000 31.6564 175.4405 33 D 4.4932 8.9748 128.9738 56.2313 41.3038 176.6347 34 G 4.3486 7.0646 104.9810 45.9027 0.0000 172.4079 35 V 5.0373 8.4404 120.1065 60.8241 35.1832 174.1191 36 N 4.9811 9.3262 125.2078 51.8960 41.8700 172.7995 37 I 4.8506 8.5474 127.0200 59.9752 39.4060 174.2740 38 H 4.7764 9.1971 128.5327 54.3261 31.7819 173.5201 39 L 4.4075 8.1818 128.1337 55.0249 41.9055 176.3039 40 S 4.3993 8.8699 123.5997 60.9122 63.4206 174.4399 41 E 4.7161 7.7663 117.6453 55.3776 32.8847 173.6076 42 I 4.6339 8.3781 125.8656 59.7035 39.3459 174.8576 43 D 5.2226 8.3732 126.6420 52.6812 43.4294 175.2538 44 Q 4.0467 8.7785 117.4760 59.5469 27.8530 177.3376 45 A 4.7971 7.9218 116.3621 51.9401 21.2694 174.3193 46 T 4.8678 7.5466 109.4493 60.1655 71.9544 171.6060 47 E 4.9706 8.8584 122.2201 54.6975 33.6744 173.0547 48 N 5.4658 9.7193 126.0025 51.7459 41.4197 173.2111 49 I 5.0183 8.5624 118.9006 58.8749 41.8213 174.1643 50 K 4.8448 9.1025 125.1339 54.9550 34.5563 174.6218 51 I 4.9365 8.7571 129.3658 60.0157 39.4803 174.7680 52 T 5.0717 9.2185 124.5220 61.8725 70.9028 173.3924 53 I 4.8829 8.9758 127.8590 59.3622 40.0480 174.4398 54 L 5.0206 9.3057 128.9151 52.7816 44.5594 176.7316 55 G 4.5265 7.2199 109.9486 46.1885 0.0000 170.3788 56 N 4.9185 8.5393 119.1819 53.1043 42.1545 175.1166 57 N 4.1349 8.5248 122.8230 54.6600 37.7515 174.0175 58 L 4.1105 8.0972 118.4191 54.7163 43.1047 177.6303 59 D 4.7779 8.4085 121.3104 52.7878 42.3070 176.5232 60 Y 4.0598 8.5546 128.4749 61.0328 39.0484 177.4623 61 E 3.8561 8.5040 118.9783 59.3752 29.5056 179.2047 62 Q 3.8452 8.0696 119.0045 59.2375 29.4128 177.9128 63 I 3.6191 7.5232 120.7968 64.3544 37.1493 178.2938 64 K 3.8100 8.3832 120.8465 59.1968 31.7985 179.0896 65 G 3.4764 7.8359 105.9746 47.8035 0.0000 175.5806 66 V 3.4757 7.4158 119.9966 65.7041 31.6207 177.9099 67 I 3.8120 7.5593 118.8745 64.5678 36.8124 178.3408 68 E 4.8087 7.9071 119.2066 58.7991 29.4265 180.3150 69 D 4.5495 8.5382 119.7607 53.9178 41.2287 177.8195 *71 G 3.9184 8.1976 108.4238 44.9924 0.0000 174.0963 72 G 4.1191 8.3019 107.9887 46.3222 0.0000 172.9261 73 V 4.8201 8.5138 119.1093 61.2273 35.5214 174.0974 74 I 4.5954 8.3885 128.3009 60.6253 36.8439 175.2798 75 H 4.6689 9.2403 126.6890 58.6398 29.4281 176.3607 76 S 4.5329 7.8064 109.1716 57.6345 65.7196 175.6435 77 V 4.4661 8.4730 122.7512 61.8466 30.5058 174.9343 78 D 4.6153 8.8253 128.8219 56.6969 41.6414 176.6114 79 E 4.7647 7.9512 117.7645 54.7034 33.4212 174.1158 80 V 4.8566 8.3080 124.7007 61.1595 34.8203 174.3358 81 V 4.5469 8.9438 127.3068 61.0509 34.0593 174.0452 82 A 5.0366 8.9552 128.3164 51.2258 22.1353 174.6053 83 G 3.8008 8.4811 105.6932 44.5610 0.0000 173.9970 84 K 4.4971 8.6954 117.6362 57.5962 32.8014 177.1478 85 I 4.4483 7.3230 117.5796 59.1470 39.0685 175.3098 86 I 3.8956 8.2642 125.4957 61.1315 37.4217 175.5321 87 V 4.3719 8.2654 125.0477 60.9928 33.4438 174.4741 88 E 4.6590 8.3355 125.5061 54.2401 31.5322 175.8374 89 S 4.1506 8.4070 116.2912 58.5176 63.1414 174.3686 90 V 3.8714 8.2703 125.4779 63.1115 31.2881 175.4396 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 0 S 8.33 4.30 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 1 L 8.20 4.23 0.00 1.83 1.62 0.92 0.04 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 2 K 8.18 4.71 0.00 1.97 1.87 0.00 1.51 0.00 0.00 1.82 0.00 0.00 2.98 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.39 1.69 7.81 3 G 8.53 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 4 L 8.37 4.49 0.00 1.65 1.65 0.95 0.84 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 5 R 9.54 4.46 0.00 1.69 1.96 0.00 3.40 0.00 0.00 3.26 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.55 0.00 6 R 7.65 5.78 0.00 1.83 1.70 0.00 3.17 0.00 0.00 3.31 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 7 L 8.53 5.29 0.00 1.65 1.56 1.16 0.80 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 8 V 8.60 4.82 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 0.99 0.00 0.00 0.94 0.00 0.00 9 L 9.22 5.18 0.00 1.60 1.59 0.97 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 10 D 9.30 4.90 0.00 2.89 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 11 V 8.81 4.87 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 0.87 0.00 0.00 0.95 0.00 0.00 12 L 8.46 5.25 0.00 1.35 1.25 0.93 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 13 K 8.34 4.72 0.00 1.76 1.71 0.00 0.61 0.00 0.00 1.22 0.00 0.00 2.69 0.00 0.00 2.63 0.00 0.00 0.00 0.00 1.06 1.21 7.81 14 P 0.00 4.80 0.00 2.15 2.00 0.00 3.76 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.11 0.00 15 H 7.71 4.33 0.00 3.34 3.39 0.00 5.63 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 E 7.91 4.68 0.00 1.97 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 2.27 2.24 0.00 17 P 0.00 4.64 0.00 2.28 2.11 0.00 3.97 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 2.34 1.99 0.00 18 K 8.40 4.22 0.00 1.89 1.81 0.00 1.69 0.00 0.00 1.88 0.00 0.00 2.94 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.56 1.47 7.81 19 T 8.37 3.99 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 1.04 0.00 0.00 20 I 7.80 3.75 1.90 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 1.68 0.83 0.93 0.00 0.00 21 V 7.65 3.69 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 0.79 0.00 0.00 1.16 0.00 0.00 22 F 8.53 3.91 0.00 3.25 3.13 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 23 A 8.51 4.05 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 24 L 8.04 3.87 0.00 2.07 1.75 0.93 0.31 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 25 K 8.25 3.91 0.00 1.69 1.78 0.00 1.72 0.00 0.00 1.83 0.00 0.00 2.99 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.54 1.53 7.81 26 L 8.33 4.15 0.00 1.78 1.74 1.02 1.05 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 27 S 7.77 4.23 0.00 3.98 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 28 E 7.58 4.27 0.00 2.08 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 0.00 2.32 2.44 0.00 29 L 7.21 4.18 0.00 1.75 1.57 0.95 0.77 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 30 E 8.36 4.10 0.00 1.92 1.85 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 2.29 2.33 0.00 31 N 8.94 4.57 0.00 2.97 3.20 0.00 0.00 6.53 7.68 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 32 V 7.14 4.52 2.23 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 0.90 0.00 0.00 1.06 0.00 0.00 33 D 8.97 4.49 0.00 2.76 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 34 G 7.06 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 0.00 0.00 0.00 0.00 35 V 8.44 5.04 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 0.90 0.00 0.00 0.94 0.00 0.00 36 N 9.33 4.98 0.00 2.75 2.62 0.00 0.00 6.94 7.92 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 37 I 8.55 4.85 1.87 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.80 0.84 0.00 0.00 38 H 9.20 4.78 0.00 3.22 3.29 0.00 5.77 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 L 8.18 4.41 0.00 1.59 1.45 0.96 0.93 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 40 S 8.87 4.40 0.00 3.88 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 41 E 7.77 4.72 0.00 1.99 1.71 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 2.25 2.30 0.00 42 I 8.38 4.63 1.87 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.74 0.94 0.00 0.00 43 D 8.37 5.22 0.00 2.62 2.61 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.78 4.05 0.00 2.05 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.38 0.00 45 A 7.92 4.80 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 46 T 7.55 4.87 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 1.19 0.00 0.00 47 E 8.86 4.97 0.00 1.96 1.69 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 2.12 2.21 0.00 48 N 9.72 5.47 0.00 2.78 2.59 0.00 0.00 6.52 7.52 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 49 I 8.56 5.02 1.78 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.52 0.76 0.00 0.00 50 K 9.10 4.84 0.00 1.82 1.75 0.00 1.58 0.00 0.00 1.64 0.00 0.00 2.86 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.33 1.39 7.81 51 I 8.76 4.94 1.90 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.56 0.99 0.00 0.00 52 T 9.22 5.07 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 1.27 0.00 0.00 53 I 8.98 4.88 1.91 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.77 0.93 0.00 0.00 54 L 9.31 5.02 0.00 1.75 1.49 0.98 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 55 G 7.22 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.54 4.92 0.00 2.59 2.66 0.00 0.00 7.26 7.82 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 57 N 8.52 4.13 0.00 2.94 2.76 0.00 0.00 7.25 7.77 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 58 L 8.10 4.11 0.00 1.73 1.63 0.98 0.86 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 59 D 8.41 4.78 0.00 2.75 2.56 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 60 Y 8.55 4.06 0.00 3.09 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 61 E 8.50 3.86 0.00 2.20 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 2.53 2.38 0.00 62 Q 8.07 3.85 0.00 2.11 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.89 0.00 0.00 0.00 0.00 0.00 2.39 2.42 0.00 63 I 7.52 3.62 1.83 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.01 0.85 0.00 0.00 64 K 8.38 3.81 0.00 1.13 1.71 0.00 1.59 0.00 0.00 1.59 0.00 0.00 3.09 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.52 1.33 7.81 65 G 7.84 3.48 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 0.00 0.00 0.00 0.00 66 V 7.42 3.48 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 0.75 0.00 0.00 0.93 0.00 0.00 67 I 7.56 3.81 2.03 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.67 1.05 0.00 0.00 68 E 7.91 4.81 0.00 1.92 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 2.49 2.52 0.00 69 D 8.54 4.55 0.00 2.73 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.20 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 72 G 8.30 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 0.00 0.00 0.00 0.00 73 V 8.51 4.82 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 1.10 0.00 0.00 0.96 0.00 0.00 74 I 8.39 4.60 1.94 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 1.36 0.70 1.06 0.00 0.00 75 H 9.24 4.67 0.00 3.22 3.36 0.00 5.71 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 76 S 7.81 4.53 0.00 3.86 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 77 V 8.47 4.47 2.07 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 0.80 0.00 0.00 1.00 0.00 0.00 78 D 8.83 4.62 0.00 2.64 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 79 E 7.95 4.76 0.00 2.00 1.72 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 2.28 2.31 0.00 80 V 8.31 4.86 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 0.81 0.00 0.00 0.89 0.00 0.00 81 V 8.94 4.55 2.16 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 0.91 0.00 0.00 0.96 0.00 0.00 82 A 8.96 5.04 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 83 G 8.48 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 K 8.70 4.50 0.00 1.76 1.87 0.00 1.77 0.00 0.00 0.61 0.00 0.00 3.02 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.62 1.41 7.81 85 I 7.32 4.45 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.56 0.91 0.00 0.00 86 I 8.26 3.90 1.87 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.74 0.91 0.00 0.00 87 V 8.27 4.37 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 0.83 0.00 0.00 0.95 0.00 0.00 88 E 8.34 4.66 0.00 1.98 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 2.23 2.21 0.00 89 S 8.41 4.15 0.00 3.82 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 90 V 8.27 3.87 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 0.82 0.00 0.00 0.93 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.