NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 F 4.6225 8.3249 122.8110 58.1644 41.3248 176.1116 17 F 3.8122 8.0518 118.0685 58.8288 39.4375 176.0528 18 T 3.8914 7.8123 117.6823 66.3661 69.1044 175.4802 19 N 4.9252 7.6922 116.2743 52.8908 37.9112 175.0308 20 K 4.3253 7.7660 115.6451 56.9874 33.0525 176.3386 21 I 3.9035 7.5383 120.9964 62.9434 37.1823 176.2464 22 G 4.0098 8.9577 114.8589 45.1613 0.0000 173.6321 23 C 4.3747 8.0885 118.2613 59.6171 29.4636 173.2285 24 N 5.1531 8.8784 120.3419 53.5240 39.6905 174.5921 25 V 5.2875 9.0202 121.3946 60.5248 35.4147 173.9487 26 S 5.2308 9.4334 116.7144 57.0104 67.0647 172.5916 27 S 4.8940 8.8415 117.0786 56.8398 62.4872 172.2740 28 P 4.5271 0.0000 0.0000 63.2060 31.8314 176.0951 29 L 4.1305 7.6121 121.0386 54.3253 42.0611 177.9937 30 K 3.9082 8.8396 123.8139 59.7418 32.0891 177.5278 31 H 4.4934 8.1513 110.8996 55.9463 29.0057 175.2842 32 V 3.6534 7.1737 121.3149 61.3758 30.7610 174.7181 33 D 4.6443 7.9517 128.2322 51.5074 38.3619 174.2492 34 I 4.5863 7.4771 125.7388 60.1797 41.2183 174.4145 35 V 4.7244 8.3100 126.6545 61.9707 34.1178 173.9468 36 G 4.0754 8.9730 116.5526 46.0569 0.0000 170.9215 37 E 5.2235 8.6277 121.3077 54.2487 33.5623 176.4591 38 I 4.3521 8.7352 127.4476 61.6051 37.5880 176.7856 39 V 4.0893 8.8506 121.1136 62.6866 33.2700 176.1336 40 E 4.8252 7.8141 117.1930 55.0901 34.2301 174.2221 41 E 4.8421 8.6229 120.6967 54.5599 32.7982 173.9134 42 A 4.8420 8.6679 125.7508 49.9701 22.7892 177.0100 43 V 3.4095 9.1547 120.1596 66.4686 31.4921 176.7873 44 Y 4.8592 8.0351 116.1838 58.4791 39.4596 174.7414 45 N 5.1083 7.6498 116.1562 52.3039 41.2539 173.0814 46 F 5.1011 8.0478 113.2582 55.1802 42.1194 172.9232 47 L 4.8762 8.9557 122.2251 53.4801 44.1348 174.9062 48 I 4.8174 8.6814 127.1774 59.5351 39.9921 174.0329 49 D 4.6842 9.0438 127.5884 52.6649 42.1386 176.1710 50 A 4.7685 8.7619 129.6833 51.7676 18.7328 176.8219 51 G 4.0012 8.5380 114.6018 45.7544 0.0000 174.3292 52 D 4.7045 7.6908 116.5638 52.2678 40.8825 176.0228 53 K 4.8720 7.2996 118.2520 56.3016 36.0218 174.5039 54 M 4.7543 7.7713 120.3940 53.7199 35.5165 174.2878 55 C 5.1610 8.4242 116.9621 55.3315 46.3559 173.4192 56 V 4.2530 9.0633 123.2159 61.7127 32.5546 174.7534 57 G 3.3742 7.7117 116.3697 44.2567 0.0000 172.1051 58 N 4.8980 9.0118 124.5831 53.1627 39.1176 175.4780 59 K 4.3776 8.8092 125.3265 59.3129 32.9387 177.5631 60 I 4.2100 8.9127 121.5193 60.3023 35.6661 174.8954 61 G 4.1450 7.8443 112.7797 45.4145 0.0000 170.5847 62 V 4.2831 8.0817 118.8746 60.6441 32.7077 174.5816 63 W 5.3921 8.5892 126.1387 54.8857 33.1370 174.3814 64 K 4.7168 9.6724 125.2914 54.9316 33.7495 175.2513 65 V 5.1096 8.5790 120.1815 59.6737 34.5939 175.7561 66 S 4.6658 9.0059 116.2348 58.7738 65.4904 175.3204 *79 R 4.2796 8.1452 116.7652 56.1941 31.2661 177.5351 80 K 3.9882 8.1127 119.9973 59.3170 33.1337 177.0323 81 S 4.9842 7.9043 111.0687 57.1031 65.5562 173.0675 82 L 4.6114 8.8910 124.7154 54.7896 41.8695 178.2869 83 Y 4.2724 7.7442 118.3366 60.3836 37.8473 177.9328 84 A 4.0760 7.9943 121.6753 54.2434 18.5421 178.4597 85 K 4.0879 7.8400 114.5302 58.0373 32.4735 177.5124 86 V 2.0466 7.1917 119.5577 60.5345 31.9311 173.7820 87 P 4.2086 0.0000 0.0000 61.9827 31.7956 175.9474 88 K 4.0259 8.2815 123.3087 57.6046 32.5685 177.4860 89 G 3.9244 8.8251 112.2470 44.9389 0.0000 173.4885 90 I 4.1175 7.1340 118.9903 60.0945 39.8036 174.9409 91 G 4.1551 8.6029 114.3684 46.2033 0.0000 173.3228 92 V 4.9264 9.0088 118.7830 59.8089 36.1431 174.7920 93 T 4.7761 8.8180 118.1679 61.9238 71.5181 173.5033 94 V 4.6118 8.9286 127.8960 61.7063 33.2430 174.0945 95 Y 4.9044 9.3545 126.7866 56.9721 38.3601 175.2003 96 L 5.3037 9.1320 122.7809 51.7684 44.9761 177.4889 97 A 4.1109 8.7731 122.3154 54.8772 18.3308 178.2162 98 N 4.9395 7.8291 110.0401 51.7813 40.2268 175.2209 99 G 3.9863 7.3260 105.7866 46.3333 0.0000 172.0694 100 R 5.0765 8.2622 115.0892 54.9431 32.8816 174.6702 101 V 4.4306 8.8575 120.3200 61.2500 34.4088 174.1940 102 Q 4.8761 8.4492 126.1149 54.2740 31.9235 175.4314 103 G 3.8492 7.9365 109.9911 45.5721 0.0000 170.9316 104 R 4.6244 7.8598 120.6020 55.2827 31.3994 176.5410 105 L 4.2187 9.0656 129.9571 55.8573 42.5332 177.1776 106 I 3.9279 8.6343 128.1156 63.3439 37.9153 175.5280 107 D 4.4586 7.3658 118.1673 53.7257 44.6452 174.3359 108 I 4.5963 8.2641 122.8072 59.5289 39.8478 175.5091 109 G 4.0694 8.2714 117.4925 44.1615 0.0000 172.6022 110 V 3.4240 8.3544 118.1471 65.7712 31.6201 177.5302 111 Y 4.6518 7.3896 114.0360 57.6964 39.0427 174.7601 112 E 4.8172 7.5204 117.1814 54.6143 33.5932 173.9554 113 V 4.3736 8.4333 121.1941 61.0233 34.3329 174.1575 114 L 5.1189 8.7385 127.6663 52.9683 44.3343 175.5354 115 V 4.7552 8.7658 123.9882 60.8875 35.2527 173.7666 116 E 4.8115 9.2132 129.1611 55.5347 31.0426 174.6346 117 E 4.4423 8.8197 126.4390 55.0282 32.4399 175.8968 118 V 3.0450 8.6507 124.2180 64.5619 30.7845 173.0997 119 G 4.1339 8.7389 107.6512 44.5661 0.0000 172.0453 120 D 4.9670 7.8525 119.4524 51.9871 43.3239 175.4257 121 I 4.5400 8.2065 123.3600 60.9268 38.1039 175.2623 122 I 4.3426 9.0356 129.3478 60.0979 38.6075 174.2588 123 Y 4.8921 8.6876 128.8914 56.6405 40.2329 174.6123 124 I 4.4954 8.0442 126.4651 59.3407 41.1450 174.6367 125 H 4.2172 8.6738 126.9082 55.6936 30.7064 175.9545 126 K 3.8643 8.7190 126.0586 59.8319 32.0727 179.0744 127 D 4.5924 8.4328 116.8960 56.5414 41.1976 176.8940 128 L 4.3425 8.1886 118.2216 54.9991 42.2547 176.4609 129 V 4.1971 7.4647 119.0565 62.0759 30.4394 174.6814 130 Y 4.6890 9.1832 129.7706 60.4663 39.9064 175.2330 131 A 5.1285 7.9430 118.1299 50.7349 23.1361 174.9676 132 L 5.2898 9.1848 121.7201 53.8007 45.1516 174.7810 133 C 5.7337 9.6740 124.3550 55.1485 44.6864 173.0844 134 W 5.7633 8.4617 117.8160 54.1564 31.6348 172.4587 135 P 4.7264 0.0000 0.0000 62.2981 31.9148 176.4237 136 K 4.1884 8.4021 120.7104 56.9886 31.8848 176.8871 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 F 8.32 4.62 0.00 2.80 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 17 F 8.05 3.81 0.00 3.16 2.83 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 18 T 7.81 3.89 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 19 N 7.69 4.93 0.00 2.70 2.78 0.00 0.00 5.83 7.13 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 20 K 7.77 4.33 0.00 1.71 1.61 0.00 1.31 0.00 0.00 1.29 0.00 0.00 2.16 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.83 0.60 7.81 21 I 7.54 3.90 1.83 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.42 0.94 0.00 0.00 22 G 8.96 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 0.00 0.00 0.00 23 C 8.09 4.37 0.00 2.92 2.83 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 24 N 8.88 5.15 0.00 2.89 2.76 0.00 0.00 6.48 6.98 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 25 V 9.02 5.29 2.12 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 0.88 0.00 0.00 1.11 0.00 0.00 26 S 9.43 5.23 0.00 4.04 4.02 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 27 S 8.84 4.89 0.00 3.78 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 28 P 0.00 4.53 0.00 2.19 2.15 0.00 3.84 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 1.93 2.00 0.00 29 L 7.61 4.13 0.00 1.59 1.47 0.61 0.13 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 30 K 8.84 3.91 0.00 1.76 1.91 0.00 1.75 0.00 0.00 1.75 0.00 0.00 3.03 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.45 1.39 7.81 31 H 8.15 4.49 0.00 3.35 3.45 0.00 5.49 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 V 7.17 3.65 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 0.29 0.00 0.00 0.70 0.00 0.00 33 D 7.95 4.64 0.00 2.84 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 34 I 7.48 4.59 1.94 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.62 0.99 0.00 0.00 35 V 8.31 4.72 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 0.79 0.00 0.00 0.95 0.00 0.00 36 G 8.97 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 37 E 8.63 5.22 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 2.16 2.23 0.00 38 I 8.74 4.35 2.00 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.52 0.88 0.00 0.00 39 V 8.85 4.09 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 0.64 0.00 0.00 0.93 0.00 0.00 40 E 7.81 4.83 0.00 1.86 1.77 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 2.29 2.30 0.00 41 E 8.62 4.84 0.00 1.85 1.74 0.00 0.00 0.00 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 2.41 0.00 42 A 8.67 4.84 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 43 V 9.15 3.41 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 0.15 0.00 0.00 0.81 0.00 0.00 44 Y 8.04 4.86 0.00 3.11 2.96 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 45 N 7.65 5.11 0.00 2.47 2.74 0.00 0.00 6.31 8.00 0.00 0.00 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 F 8.05 5.10 0.00 3.02 2.76 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 47 L 8.96 4.88 0.00 1.70 1.52 1.04 1.02 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 48 I 8.68 4.82 1.64 0.00 0.00 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.22 0.83 0.00 0.00 49 D 9.04 4.68 0.00 2.64 2.49 0.00 0.00 0.00 0.00 0.00 0.00 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 8.76 4.77 1.20 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 0.00 0.00 51 G 8.54 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 52 D 7.69 4.70 0.00 2.81 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 53 K 7.30 4.87 0.00 1.81 1.81 0.00 1.46 0.00 0.00 1.81 0.00 0.00 2.79 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.30 1.31 7.81 54 M 7.77 4.75 0.00 1.15 0.57 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.23 0.00 55 C 8.42 5.16 0.00 2.58 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 56 V 9.06 4.25 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 0.23 0.00 0.00 1.04 0.00 0.00 57 G 7.71 3.37 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 0.00 58 N 9.01 4.90 0.00 3.16 3.18 0.00 0.00 7.25 6.35 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 59 K 8.81 4.38 0.00 1.94 2.14 0.00 2.08 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.77 1.87 7.81 60 I 8.91 4.21 2.12 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.75 1.03 0.00 0.00 61 G 7.84 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 0.00 0.00 0.00 62 V 8.08 4.28 1.77 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 0.78 0.00 0.00 0.79 0.00 0.00 63 W 8.59 5.39 0.00 3.50 3.31 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 64 K 9.67 4.72 0.00 1.87 1.88 0.00 1.63 0.00 0.00 1.69 0.00 0.00 2.90 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.43 1.45 7.81 65 V 8.58 5.11 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 1.05 0.00 0.00 1.14 0.00 0.00 66 S 9.01 4.67 0.00 3.86 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 *79 R 8.15 4.28 0.00 1.92 2.26 0.00 2.95 0.00 0.00 3.33 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.66 0.00 80 K 8.11 3.99 0.00 1.82 2.10 0.00 1.79 0.00 0.00 1.84 0.00 0.00 2.87 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.60 1.47 7.81 81 S 7.90 4.98 0.00 3.92 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 82 L 8.89 4.61 0.00 1.67 1.59 0.89 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 83 Y 7.74 4.27 0.00 3.04 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 84 A 7.99 4.08 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 85 K 7.84 4.09 0.00 1.93 2.06 0.00 1.77 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.67 1.62 7.81 86 V 7.19 2.05 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 0.16 0.00 0.00 0.70 0.00 0.00 87 P 0.00 4.21 0.00 2.07 1.86 0.00 2.39 0.00 0.00 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 88 K 8.28 4.03 0.00 1.67 1.68 0.00 1.67 0.00 0.00 1.81 0.00 0.00 2.94 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.35 1.33 7.81 89 G 8.83 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 90 I 7.13 4.12 1.90 0.00 0.00 1.00 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 1.16 0.92 0.00 0.00 91 G 8.60 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 0.00 0.00 0.00 92 V 9.01 4.93 2.17 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 0.87 0.00 0.00 0.96 0.00 0.00 93 T 8.82 4.78 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 0.42 0.00 0.00 94 V 8.93 4.61 2.15 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 1.04 0.00 0.00 0.92 0.00 0.00 95 Y 9.35 4.90 0.00 3.18 3.09 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 96 L 9.13 5.30 0.00 1.63 1.62 0.95 1.11 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 97 A 8.77 4.11 1.20 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 0.00 0.00 98 N 7.83 4.94 0.00 2.70 2.73 0.00 0.00 6.85 7.53 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 99 G 7.33 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 0.00 0.00 0.00 100 R 8.26 5.08 0.00 1.58 1.89 0.00 2.94 0.00 0.00 2.96 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.54 0.00 101 V 8.86 4.43 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 1.01 0.00 0.00 0.93 0.00 0.00 102 Q 8.45 4.88 0.00 1.90 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.66 0.00 0.00 0.00 0.00 0.00 2.16 2.24 0.00 103 G 7.94 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 0.00 104 R 7.86 4.62 0.00 1.92 1.80 0.00 3.09 0.00 0.00 3.08 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.63 0.00 105 L 9.07 4.22 0.00 1.70 1.45 0.90 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 106 I 8.63 3.93 1.96 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 1.09 0.85 0.89 0.00 0.00 107 D 7.37 4.46 0.00 2.70 2.38 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 0.00 108 I 8.26 4.60 1.70 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 1.01 0.58 0.49 0.00 0.00 109 G 8.27 4.07 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 0.00 0.00 0.00 110 V 8.35 3.42 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 -0.10 0.00 0.00 0.73 0.00 0.00 111 Y 7.39 4.65 0.00 3.07 2.74 0.00 0.00 0.00 0.00 0.00 0.00 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 E 7.52 4.82 0.00 1.26 1.83 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 2.13 2.34 0.00 113 V 8.43 4.37 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 0.88 0.00 0.00 0.51 0.00 0.00 114 L 8.74 5.12 0.00 1.56 1.54 0.94 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 115 V 8.77 4.76 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 1.05 0.00 0.00 0.88 0.00 0.00 116 E 9.21 4.81 0.00 2.03 1.79 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 2.42 2.28 0.00 117 E 8.82 4.44 0.00 1.97 1.79 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 2.20 2.35 0.00 118 V 8.65 3.05 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 0.80 0.00 0.00 0.93 0.00 0.00 119 G 8.74 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 D 7.85 4.97 0.00 2.82 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 0.00 121 I 8.21 4.54 1.89 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 1.35 0.49 0.95 0.00 0.00 122 I 9.04 4.34 1.88 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 1.12 1.21 0.94 0.00 0.00 123 Y 8.69 4.89 0.00 2.98 2.80 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 0.00 124 I 8.04 4.50 1.74 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.40 0.89 0.00 0.00 125 H 8.67 4.22 0.00 3.29 3.18 0.00 5.88 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 K 8.72 3.86 0.00 1.83 1.91 0.00 1.75 0.00 0.00 1.69 0.00 0.00 2.50 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.26 1.33 7.81 127 D 8.43 4.59 0.00 2.75 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 0.00 128 L 8.19 4.34 0.00 1.88 1.74 0.96 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 129 V 7.46 4.20 2.31 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 0.91 0.00 0.00 0.98 0.00 0.00 130 Y 9.18 4.69 0.00 3.14 3.26 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 0.00 131 A 7.94 5.13 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 0.00 132 L 9.18 5.29 0.00 1.92 1.83 0.93 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 133 C 9.67 5.73 0.00 3.04 2.96 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 0.00 134 W 8.46 5.76 0.00 3.38 3.26 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 0.00 135 P 0.00 4.73 0.00 2.14 2.12 0.00 4.01 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.06 0.00 136 K 8.40 4.19 0.00 1.76 1.78 0.00 1.83 0.00 0.00 1.71 0.00 0.00 2.93 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.39 1.34 7.81 * Residues marked with a * may have inaccurate shift predictions.