NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 G 3.9514 8.3393 109.7369 44.3467 0.0000 173.2231 8 P 4.2236 0.0000 0.0000 61.4941 31.8497 174.0997 9 I 4.3966 8.3220 120.9643 59.1232 41.3441 176.5744 10 G 3.8134 8.5421 117.1076 44.2745 0.0000 172.4169 11 I 4.0068 8.0133 127.3649 59.1342 37.1634 174.5494 12 P 4.4854 0.0000 0.0000 62.4427 32.1701 176.5013 13 F 4.5490 8.6037 120.4267 54.6748 39.0813 174.1175 14 P 4.3401 0.0000 0.0000 65.0321 31.6071 177.4424 15 D 4.7794 8.0263 116.8482 54.3464 41.7163 177.3034 16 H 4.1254 8.4799 121.0433 59.5116 29.8147 177.1087 17 S 4.0303 8.1807 115.3426 61.7750 62.5724 176.5426 18 S 4.1677 7.9776 118.0483 61.1198 62.7071 176.0425 19 D 4.3476 7.9748 121.5194 57.3921 40.5155 178.8197 20 I 3.5907 7.7068 120.2468 64.3789 37.0469 178.2649 21 L 3.9019 7.7778 121.0152 58.1397 41.8742 178.8066 22 S 4.1899 8.2580 113.2823 61.4256 62.3077 176.5177 23 G 3.5942 8.1138 108.3589 47.7098 0.0000 175.7160 24 L 4.0833 8.2136 121.6436 57.6218 41.6054 179.1875 25 N 4.2084 8.6511 117.3435 56.5932 38.9770 176.7995 26 E 3.9361 8.2313 120.0916 59.3908 29.5289 179.2661 27 Q 3.9690 8.1356 117.9997 59.0703 28.7185 179.0138 28 R 3.7288 7.9219 119.4939 59.7381 29.8090 178.6919 29 T 3.7820 7.7454 114.4629 66.1616 68.5206 175.8285 30 Q 4.3493 7.8124 116.9892 55.0527 29.2565 176.0512 31 G 3.7715 7.5477 108.0982 46.3715 0.0000 173.0329 32 L 4.5371 8.2106 121.3870 54.0334 43.7537 176.0080 33 L 3.6668 8.5273 123.0787 55.7201 39.4886 173.7977 34 C 4.2804 7.4730 114.9037 59.2012 28.3981 173.3631 35 D 4.9900 8.4340 122.7714 53.2788 40.7081 176.1260 36 V 4.7006 7.4694 118.4362 60.2559 35.4420 173.8313 37 V 4.8531 8.9683 122.5279 61.3650 34.1828 174.1799 38 I 4.9729 8.6736 128.7616 60.0646 39.2819 174.5182 39 L 5.5468 9.4130 127.0747 52.9355 44.6637 175.9966 40 V 4.5050 9.1663 123.5046 60.4628 34.5223 175.4960 41 E 3.6667 9.8107 126.4988 57.4423 26.8030 175.6458 42 G 3.9377 7.9776 102.5222 45.9935 0.0000 172.8567 43 R 4.4295 8.2944 120.0309 54.5112 31.5595 174.6134 44 E 4.9910 8.5460 123.5011 54.9521 31.1951 175.2405 45 F 4.7443 9.5995 126.8519 54.8447 40.7764 172.3931 46 P 4.8730 0.0000 0.0000 62.8991 32.0108 175.6946 47 T 4.6265 9.0298 118.3703 61.4650 71.9374 171.0784 48 H 5.3744 8.9784 118.5468 52.8633 30.8216 176.2768 49 R 3.4311 9.0012 121.3687 58.8718 29.1493 179.3263 50 S 4.0480 7.8636 114.6330 61.3877 62.8298 176.6006 51 V 3.4463 7.6204 121.6931 65.3225 31.2413 177.7489 52 L 3.9774 7.9270 118.4982 57.8639 41.2572 179.3171 53 A 4.3342 8.2661 119.4567 55.3283 18.3827 179.3268 54 A 4.0685 7.9409 118.0374 54.5940 18.4471 178.4516 55 C 4.4850 7.5670 115.9593 59.1670 32.8610 173.7842 56 S 4.7366 8.1912 115.2871 55.6290 64.8954 174.3581 57 Q 4.0392 8.8721 128.7776 59.0998 28.6617 177.4733 58 Y 3.8910 7.8639 120.4428 60.8670 38.7453 178.2798 59 F 3.7933 8.0885 118.5207 60.1159 39.0739 177.4912 60 K 3.9564 8.1862 119.3390 59.6161 31.8526 179.0286 61 K 3.8945 7.7844 118.4593 59.1531 31.7265 178.9636 62 L 3.6197 7.1754 119.6152 58.2087 41.9963 178.7884 63 F 4.7436 7.8643 115.2827 59.0423 39.1295 176.8281 64 T 4.4923 7.4523 107.4488 61.8362 69.1118 176.3477 65 S 4.2354 7.7433 121.0898 62.4350 63.5709 174.8248 *72 Q 4.1952 7.6916 116.4425 55.2703 29.4502 176.0126 73 N 5.0602 8.3879 109.3396 54.8403 40.3251 174.8302 74 V 4.9336 7.4954 118.7923 61.1707 34.4703 174.0409 75 Y 4.7452 9.2281 125.2032 56.1557 41.4080 174.0226 76 E 4.8261 9.0812 125.4910 55.2934 30.8581 175.1981 77 I 4.2284 8.7380 129.3103 60.0363 37.7949 175.1395 78 D 4.5854 8.7545 126.5412 54.2620 41.8845 176.5922 79 F 4.8185 7.1969 112.0539 56.9733 38.3159 175.6466 80 V 4.4738 6.8284 113.2550 58.9464 35.4331 175.8649 81 S 4.5629 8.3117 117.0772 57.7528 65.3274 175.0984 82 A 4.0433 8.6607 125.1207 55.4239 18.2034 179.9247 83 E 3.8919 8.2033 116.9475 59.4267 29.8234 178.8143 84 A 3.9941 8.0250 120.7500 55.0838 18.3994 179.3252 85 L 3.8372 8.1832 119.2125 58.4452 42.0890 179.0591 86 T 4.2026 8.2903 115.6675 67.0173 68.5310 176.2716 87 A 4.1159 7.9635 121.8546 55.2434 18.3664 179.6572 88 L 4.2119 8.1236 117.4837 57.9008 41.8878 179.5727 89 M 4.2720 8.5959 119.2126 58.4775 31.9650 178.2751 90 D 4.4947 8.2990 119.0768 57.4912 41.0072 178.3985 91 F 4.5323 8.6657 122.0251 60.8582 39.1037 176.9582 92 A 3.4751 8.0265 118.5230 55.0676 18.2485 178.5145 93 Y 4.2917 7.8249 112.5476 58.9972 38.4918 176.9291 94 T 4.4514 7.7311 108.0652 60.1515 70.4354 174.7724 95 A 3.6243 8.1211 123.1511 52.4523 17.3030 177.2622 96 T 4.7217 7.6918 113.7070 61.6792 71.3015 172.7244 97 L 4.7064 8.6790 127.5796 53.6157 43.4975 175.2970 98 T 4.5682 8.5079 122.7805 62.0545 69.8839 174.2737 99 V 4.6008 8.1599 118.5979 59.5121 35.9591 174.3006 100 S 4.8195 9.2024 115.4966 56.1418 66.1691 175.2430 101 T 3.8015 8.7980 110.7939 65.0421 68.0309 175.2536 102 A 4.1624 7.6270 123.4515 53.3678 18.7644 177.5326 103 N 5.0011 8.0594 111.0872 52.0375 38.3744 176.6030 104 V 3.7155 7.8649 120.3908 66.2608 31.5596 178.1116 105 G 3.5468 8.0028 105.1832 47.5096 0.0000 175.1167 106 D 4.3060 8.0061 119.8650 57.4202 41.3294 178.3204 107 I 3.7476 7.8220 120.3439 64.0879 37.1255 178.2327 108 L 3.9108 8.1644 121.5479 58.2138 42.0173 179.3094 109 S 4.0922 8.3346 115.0606 61.4254 62.7232 176.3021 110 A 3.9801 7.9875 123.3131 55.3461 18.0503 179.6090 111 A 3.9292 8.2163 119.1495 55.2261 18.2196 180.1612 112 R 3.8673 7.8722 116.3178 59.4224 29.9229 179.2438 113 L 4.0123 7.6386 117.5898 57.1965 42.1292 178.6183 114 L 4.0859 8.2189 117.1915 53.8303 43.0878 175.7265 115 E 3.9550 7.6317 117.2397 57.8351 26.9427 175.3016 116 I 4.9271 7.9611 121.1637 58.3256 37.9197 175.1444 117 P 4.2632 0.0000 0.0000 65.2750 31.4711 177.6881 118 A 4.0304 7.9966 119.2894 55.0219 18.3612 179.7006 119 V 3.3909 7.5534 117.0583 65.8902 31.5340 178.5046 120 S 4.1094 7.9221 113.6475 61.4174 62.7499 175.7183 121 H 4.0466 8.0988 121.4766 59.2719 29.6356 177.6836 122 V 3.6059 7.3265 113.4064 64.6791 31.2951 178.4758 123 C 4.1194 8.1723 116.2429 62.5654 27.9210 175.9030 124 A 3.9496 8.2723 122.7972 55.3797 18.0736 179.4896 125 D 4.2756 7.7693 117.4702 57.1657 40.6259 178.6906 126 L 3.9005 7.6312 119.9434 58.0178 42.1996 178.4973 127 L 4.0553 7.8563 118.9687 58.3673 42.1746 177.9897 128 D 4.4470 8.2420 116.8181 57.4001 41.1332 176.7568 129 R 4.2295 7.7462 121.7411 56.3992 30.2661 176.1880 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 7 G 8.34 3.95 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 0.00 0.00 0.00 8 P 0.00 4.22 0.00 2.28 2.07 0.00 3.71 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.02 0.00 9 I 8.32 4.40 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 1.34 0.95 0.92 0.00 0.00 10 G 8.54 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 11 I 8.01 4.01 1.95 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 1.44 0.61 0.59 0.00 0.00 12 P 0.00 4.49 0.00 2.16 2.05 0.00 3.61 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 1.90 1.95 0.00 13 F 8.60 4.55 0.00 3.11 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 14 P 0.00 4.34 0.00 2.19 2.20 0.00 3.72 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.97 0.00 15 D 8.03 4.78 0.00 2.77 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 16 H 8.48 4.13 0.00 3.32 3.49 0.00 5.79 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 S 8.18 4.03 0.00 4.06 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 18 S 7.98 4.17 0.00 4.01 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 19 D 7.97 4.35 0.00 2.88 2.68 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 0.00 0.00 0.00 0.00 20 I 7.71 3.59 1.89 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.74 0.85 0.00 0.00 21 L 7.78 3.90 0.00 1.86 1.63 0.84 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 22 S 8.26 4.19 0.00 4.07 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 23 G 8.11 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.21 4.08 0.00 1.95 1.91 0.83 0.59 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 25 N 8.65 4.21 0.00 3.20 2.98 0.00 0.00 7.21 8.38 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 26 E 8.23 3.94 0.00 2.24 1.97 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 2.32 2.57 0.00 27 Q 8.14 3.97 0.00 2.39 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.81 0.00 0.00 0.00 0.00 0.00 2.40 2.47 0.00 28 R 7.92 3.73 0.00 1.30 1.45 0.00 2.81 0.00 0.00 2.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.57 0.00 29 T 7.75 3.78 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 1.16 0.00 0.00 30 Q 7.81 4.35 0.00 2.14 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.50 0.00 0.00 0.00 0.00 0.00 2.31 2.32 0.00 31 G 7.55 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 32 L 8.21 4.54 0.00 1.64 1.49 0.91 0.66 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 33 L 8.53 3.67 0.00 1.83 1.73 0.93 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 34 C 7.47 4.28 0.00 2.97 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 35 D 8.43 4.99 0.00 2.69 2.84 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 36 V 7.47 4.70 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 0.82 0.00 0.00 1.19 0.00 0.00 37 V 8.97 4.85 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 1.14 0.00 0.00 0.95 0.00 0.00 38 I 8.67 4.97 1.86 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.67 0.87 0.00 0.00 39 L 9.41 5.55 0.00 1.60 1.62 0.96 0.84 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 40 V 9.17 4.51 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 0.94 0.00 0.00 0.97 0.00 0.00 41 E 9.81 3.67 0.00 2.12 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 2.25 2.31 0.00 42 G 7.98 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 43 R 8.29 4.43 0.00 2.20 1.71 0.00 3.12 0.00 0.00 3.17 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.56 0.00 44 E 8.55 4.99 0.00 1.99 1.81 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 2.20 2.36 0.00 45 F 9.60 4.74 0.00 2.89 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 46 P 0.00 4.87 0.00 1.88 1.96 0.00 3.61 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.07 0.00 47 T 9.03 4.63 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 1.24 0.00 0.00 48 H 8.98 5.37 0.00 3.20 3.14 0.00 5.88 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 49 R 9.00 3.43 0.00 0.67 1.08 0.00 2.60 0.00 0.00 2.75 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.35 0.00 50 S 7.86 4.05 0.00 4.03 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 51 V 7.62 3.45 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 0.43 0.00 0.00 0.78 0.00 0.00 52 L 7.93 3.98 0.00 1.87 1.47 0.35 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 53 A 8.27 4.33 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.94 4.07 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 55 C 7.57 4.49 0.00 2.95 3.17 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 56 S 8.19 4.74 0.00 4.05 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 0.00 57 Q 8.87 4.04 0.00 2.25 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.56 0.00 0.00 0.00 0.00 0.00 2.36 2.46 0.00 58 Y 7.86 3.89 0.00 3.12 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 59 F 8.09 3.79 0.00 3.18 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 60 K 8.19 3.96 0.00 2.17 1.99 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.53 7.81 61 K 7.78 3.89 0.00 1.76 1.69 0.00 1.69 0.00 0.00 1.54 0.00 0.00 3.03 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.40 1.51 7.81 62 L 7.18 3.62 0.00 0.73 0.97 0.74 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 63 F 7.86 4.74 0.00 3.06 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 64 T 7.45 4.49 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 1.28 0.00 0.00 65 S 7.74 4.24 0.00 3.79 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 *72 Q 7.69 4.20 0.00 2.10 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.64 6.83 0.00 0.00 0.00 0.00 0.00 2.18 1.96 0.00 73 N 8.39 5.06 0.00 2.61 2.85 0.00 0.00 6.24 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 74 V 7.50 4.93 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 0.84 0.00 0.00 0.92 0.00 0.00 75 Y 9.23 4.75 0.00 3.15 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 9.08 4.83 0.00 2.01 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 2.29 2.44 0.00 77 I 8.74 4.23 1.68 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.10 0.04 0.00 0.00 78 D 8.75 4.59 0.00 2.64 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 79 F 7.20 4.82 0.00 3.06 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 80 V 6.83 4.47 1.98 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 0.62 0.00 0.00 0.68 0.00 0.00 81 S 8.31 4.56 0.00 4.05 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 82 A 8.66 4.04 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.20 3.89 0.00 2.08 1.98 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 2.40 2.41 0.00 84 A 8.02 3.99 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 85 L 8.18 3.84 0.00 1.54 1.29 0.91 0.37 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 86 T 8.29 4.20 4.54 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 1.33 0.00 0.00 87 A 7.96 4.12 1.41 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 0.00 0.00 88 L 8.12 4.21 0.00 1.81 1.87 0.94 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 89 M 8.60 4.27 0.00 2.24 2.33 0.00 0.00 0.00 0.00 0.00 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.92 0.00 90 D 8.30 4.49 0.00 3.08 2.84 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 91 F 8.67 4.53 0.00 3.18 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 92 A 8.03 3.48 1.23 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 0.00 0.00 0.00 0.00 0.00 0.00 93 Y 7.82 4.29 0.00 3.12 3.12 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 94 T 7.73 4.45 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 1.27 0.00 0.00 95 A 8.12 3.62 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 96 T 7.69 4.72 4.32 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 1.27 0.00 0.00 97 L 8.68 4.71 0.00 1.47 1.52 0.93 0.80 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 98 T 8.51 4.57 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 1.24 0.00 0.00 99 V 8.16 4.60 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 0.75 0.00 0.00 0.93 0.00 0.00 100 S 9.20 4.82 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 0.00 101 T 8.80 3.80 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 1.21 0.00 0.00 102 A 7.63 4.16 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 0.00 103 N 8.06 5.00 0.00 2.93 2.99 0.00 0.00 6.44 8.02 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 0.00 104 V 7.86 3.72 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 1.09 0.00 0.00 0.98 0.00 0.00 105 G 8.00 3.55 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 0.00 0.00 0.00 106 D 8.01 4.31 0.00 2.80 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 0.00 107 I 7.82 3.75 1.85 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 0.41 0.86 0.00 0.00 108 L 8.16 3.91 0.00 1.79 1.87 0.95 0.93 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 0.00 109 S 8.33 4.09 0.00 3.89 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 0.00 110 A 7.99 3.98 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 0.00 111 A 8.22 3.93 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 0.00 112 R 7.87 3.87 0.00 1.99 1.95 0.00 3.26 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.85 0.00 113 L 7.64 4.01 0.00 1.78 1.55 1.02 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 114 L 8.22 4.09 0.00 1.74 1.68 1.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 115 E 7.63 3.95 0.00 2.35 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 0.00 2.22 2.38 0.00 116 I 7.96 4.93 1.89 0.00 0.00 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 1.57 1.49 1.09 0.00 0.00 117 P 0.00 4.26 0.00 2.17 2.11 0.00 3.64 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.17 0.00 118 A 8.00 4.03 1.37 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 0.00 119 V 7.55 3.39 1.88 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 0.85 0.00 0.00 0.03 0.00 0.00 120 S 7.92 4.11 0.00 4.06 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 0.00 121 H 8.10 4.05 0.00 3.24 3.33 0.00 5.59 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 V 7.33 3.61 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 0.74 0.00 0.00 0.91 0.00 0.00 123 C 8.17 4.12 0.00 3.01 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 0.00 124 A 8.27 3.95 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 0.00 125 D 7.77 4.28 0.00 2.71 2.67 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 0.00 126 L 7.63 3.90 0.00 1.87 1.76 0.91 1.05 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 0.00 127 L 7.86 4.06 0.00 1.74 1.78 0.91 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 128 D 8.24 4.45 0.00 2.79 2.67 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 0.00 129 R 7.75 4.23 0.00 1.98 1.82 0.00 3.24 0.00 0.00 3.25 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.86 0.00 * Residues marked with a * may have inaccurate shift predictions.