NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 40 Y 4.8428 8.1444 121.7129 57.4217 40.1946 174.0571 41 V 3.4611 7.7694 127.5128 60.6009 31.7748 172.7033 42 P 4.3012 0.0000 0.0000 64.4813 32.4315 176.2252 43 G 3.9907 9.1109 110.7087 46.0139 0.0000 174.4948 44 S 4.3161 7.7683 114.9053 59.1571 63.8748 173.7583 45 V 4.8761 7.9674 121.5560 61.3239 33.8380 174.6849 46 S 5.2817 9.3897 122.0400 56.6832 67.4295 172.9462 47 A 5.0292 9.1024 124.2743 50.4517 20.8119 175.3170 48 A 5.0646 9.1884 124.9449 51.1564 21.6004 175.5634 49 F 5.1515 9.5427 121.3891 55.7336 41.7402 175.0816 50 V 5.3821 8.6728 122.8282 60.3917 34.6458 174.0862 51 T 5.0267 8.7167 124.3045 62.6796 69.8853 173.8775 52 C 4.9751 9.1468 123.5669 57.0283 31.7140 173.6657 53 P 4.4062 0.0000 0.0000 65.6680 31.4356 176.0311 54 N 4.8077 7.4442 114.9180 50.7037 41.0360 174.7031 55 E 4.0096 8.7657 122.5676 59.7196 29.6724 179.0735 *56 K 3.9265 8.0440 123.3567 59.8773 31.7451 181.0945 57 V 3.7134 8.5468 119.9259 65.6334 31.4423 177.8434 58 A 3.9669 7.7730 119.9583 55.1950 18.2460 179.7503 59 K 3.9282 8.3106 117.1298 59.6352 32.1396 179.4064 60 E 3.9749 8.2234 118.7409 59.5144 29.3285 179.5680 61 I 3.8017 8.0139 119.6286 64.2326 37.1276 178.2332 62 A 4.0617 8.5593 124.4631 55.9804 18.1768 180.4156 *63 R 3.8824 8.5550 119.1052 61.4919 29.4238 180.6436 64 A 4.1224 8.0555 121.6254 55.2538 18.4077 180.2017 65 V 3.3858 8.0007 111.0158 64.3262 31.4894 179.1809 66 V 3.7379 7.5244 118.9991 65.4415 31.2342 177.6869 67 E 3.9494 8.2261 120.4200 59.6299 29.5292 178.6886 68 K 4.2210 8.2235 123.3998 56.7490 31.8129 179.9336 69 R 4.0501 7.5739 115.6434 58.1036 27.2811 182.1624 70 L 4.2037 7.9925 119.1320 57.1616 42.1747 176.9997 71 A 4.5642 7.2921 120.1156 50.4034 22.2064 176.5711 72 A 3.9166 8.4858 123.3452 54.7898 19.1593 177.3430 73 C 4.7476 7.5044 107.5359 57.8403 32.9006 173.0821 74 V 4.8414 8.3120 118.3276 61.3003 34.2899 173.8624 75 N 4.9895 9.2376 125.3091 51.6840 40.8193 173.6616 76 L 5.0237 8.5296 123.3117 53.2261 43.7788 175.8284 77 I 4.4505 9.2070 126.0864 59.2282 39.0493 173.8792 78 P 4.7001 0.0000 0.0000 61.8621 33.8585 175.5225 79 Q 3.5354 8.3694 114.4135 56.2506 25.3446 169.8013 80 I 4.4736 7.6417 119.6536 61.0525 39.5066 175.9172 81 T 5.0178 8.4643 122.4986 62.1237 70.4455 173.8118 82 S 4.8261 8.9814 123.3923 57.1996 65.1776 173.4818 83 I 5.1226 8.6653 124.2140 58.7168 39.6862 174.2638 84 Y 4.9424 7.7292 123.9077 55.5213 41.5171 173.1300 85 E 4.9757 8.9108 121.3326 54.7505 31.8647 174.6297 86 W 5.4865 9.8410 135.0000 57.6070 33.8727 175.8129 87 K 3.5530 9.3000 127.5416 55.3944 28.4722 170.9781 88 G 4.2911 8.4879 114.1579 46.2544 0.0000 174.8243 89 K 4.4355 7.6935 120.5070 52.9915 33.2705 176.8228 90 I 4.8427 8.0298 119.6497 60.9057 38.2544 175.3311 91 E 4.5870 8.8784 126.8365 54.6022 32.3278 174.8088 92 E 5.5218 8.3420 120.5164 53.7823 32.5821 175.0396 93 D 5.0791 8.6018 122.7033 52.3593 45.6754 174.9222 94 S 4.8734 8.6686 117.1388 58.7545 63.8475 173.3768 95 E 4.9789 9.4794 122.9408 55.0472 34.8705 174.0428 96 V 4.8383 9.0162 120.3233 61.1293 35.0011 173.7274 97 L 5.2243 9.0498 129.2530 53.6647 44.7209 174.6193 98 M 4.9258 9.3142 126.0445 54.0149 34.5208 174.6674 99 M 4.2655 9.2367 124.0872 53.9690 34.1366 174.2384 100 I 4.7373 8.7361 128.5345 59.6124 39.7135 174.9958 101 K 4.9160 8.7613 127.1315 55.1524 34.2176 175.5631 102 T 4.6602 8.5548 118.6874 60.7977 71.7091 172.6778 103 Q 4.5109 8.4946 122.2267 55.8827 29.5726 178.2471 104 S 4.1934 9.3637 118.5429 61.6058 62.6155 177.3210 105 S 4.2154 8.0350 115.6477 60.8361 63.0499 175.5157 106 L 4.2966 7.5391 121.4396 55.3629 41.6276 178.6764 107 V 3.6014 7.5323 119.4565 65.5608 31.4144 175.8970 108 P 4.2423 0.0000 0.0000 65.6734 31.2088 178.4221 109 A 4.0102 7.9489 118.9928 54.9241 18.3299 179.2162 110 L 3.9583 8.4638 119.2836 58.6239 42.0968 179.3833 111 T 3.8865 8.3516 116.0013 66.7577 68.4408 176.2038 112 D 4.3755 8.2527 120.8149 57.4347 40.6592 178.7792 113 F 4.1366 7.9984 119.6138 61.4244 39.5237 176.9570 114 V 3.4101 7.7584 116.4712 65.7728 31.4816 177.8444 115 R 4.0169 8.1993 118.3954 58.3890 30.0497 177.4331 116 S 4.3202 6.9023 111.6042 59.2199 63.6271 174.1833 117 V 3.1405 8.0289 121.1434 61.8534 31.4284 170.9151 118 H 3.9953 7.3840 113.5237 55.3805 27.5881 172.4889 119 P 4.0711 0.0000 0.0000 66.1403 31.4204 176.1805 120 Y 4.9363 7.2591 112.8923 55.4402 42.1877 175.0690 121 E 3.9743 9.1032 119.9286 59.1876 29.4416 178.0846 122 V 4.1279 7.5306 120.4587 60.6803 32.0748 174.3504 123 A 4.2811 8.3307 130.6826 51.3742 19.4674 176.2579 124 E 4.1491 8.7795 124.1051 56.1463 30.7835 175.7900 125 V 4.8850 8.4000 127.1658 61.1896 34.3636 174.3767 126 I 4.7625 8.7849 121.2723 59.0038 40.6096 174.0138 127 A 5.1815 8.8097 127.4029 50.1092 21.1799 175.3451 128 L 4.9212 8.8460 122.8082 52.1944 44.6008 174.2153 129 P 4.8275 0.0000 0.0000 62.3688 32.9266 175.8517 130 V 4.0623 8.7356 123.5294 62.0247 31.8482 176.2616 131 E 4.0737 9.0756 129.8706 58.7488 29.8769 176.1216 132 Q 4.7752 8.0500 114.1793 53.7173 33.2363 174.2137 133 G 3.7234 7.7081 104.0886 45.2453 0.0000 172.0823 134 N 4.5070 7.9433 119.2248 52.8302 39.1911 175.7967 135 F 4.1181 8.9240 130.4913 61.1265 39.4533 174.6562 136 P 4.1325 0.0000 0.0000 65.9973 31.1211 177.7991 137 Y 4.0280 7.9714 117.2970 60.7433 38.6879 177.7937 138 L 3.9299 8.2845 120.3012 57.8160 41.5683 179.3316 139 Q 3.7275 8.3981 120.1739 58.6363 28.8909 178.0234 140 W 4.0010 8.3245 129.9323 60.4260 30.4926 178.0633 141 V 2.8410 7.4327 117.0753 65.5871 31.1218 177.8058 142 R 3.8766 7.5212 118.4851 59.4547 30.0865 178.3334 143 Q 3.8349 8.0420 118.1139 59.2086 28.7530 178.8875 144 V 3.7089 7.0785 107.5960 61.9768 31.4991 176.6165 145 T 4.4413 7.3260 111.1898 61.5444 69.6280 174.6554 *146 E 4.1581 7.5681 123.0382 56.4204 29.6404 181.6705 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 40 Y 8.14 4.84 0.00 3.43 3.19 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 41 V 7.77 3.46 1.86 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 0.78 0.00 0.00 0.86 0.00 0.00 42 P 0.00 4.30 0.00 2.03 2.03 0.00 3.68 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.13 0.00 43 G 9.11 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 44 S 7.77 4.32 0.00 4.02 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 45 V 7.97 4.88 2.30 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 1.15 0.00 0.00 1.04 0.00 0.00 46 S 9.39 5.28 0.00 3.74 3.73 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 47 A 9.10 5.03 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 48 A 9.19 5.06 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 49 F 9.54 5.15 0.00 3.03 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 50 V 8.67 5.38 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 1.22 0.00 0.00 0.96 0.00 0.00 51 T 8.72 5.03 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 1.34 0.00 0.00 52 C 9.15 4.98 0.00 2.78 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 53 P 0.00 4.41 0.00 2.11 2.09 0.00 3.57 0.00 0.00 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.56 0.00 54 N 7.44 4.81 0.00 2.97 2.93 0.00 0.00 5.93 7.66 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 55 E 8.77 4.01 0.00 2.06 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 2.38 2.38 0.00 *56 K 8.04 3.93 0.00 1.80 1.81 0.00 1.85 0.00 0.00 1.74 0.00 0.00 2.83 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.45 1.08 7.81 57 V 8.55 3.71 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 0.90 0.00 0.00 0.87 0.00 0.00 58 A 7.77 3.97 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 59 K 8.31 3.93 0.00 1.95 1.88 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.47 1.67 7.81 60 E 8.22 3.97 0.00 2.21 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 2.33 2.35 0.00 61 I 8.01 3.80 2.00 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.72 0.98 0.00 0.00 62 A 8.56 4.06 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 *63 R 8.55 3.88 0.00 1.77 1.96 0.00 3.28 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.53 0.00 64 A 8.06 4.12 1.54 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 65 V 8.00 3.39 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 1.00 0.00 0.00 1.03 0.00 0.00 66 V 7.52 3.74 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 1.11 0.00 0.00 0.97 0.00 0.00 67 E 8.23 3.95 0.00 2.20 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 2.29 0.00 68 K 8.22 4.22 0.00 1.85 1.68 0.00 1.99 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.38 1.32 7.81 69 R 7.57 4.05 0.00 1.99 1.92 0.00 3.23 0.00 0.00 3.22 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.46 0.00 70 L 7.99 4.20 0.00 1.62 1.68 0.60 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 71 A 7.29 4.56 1.16 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 72 A 8.49 3.92 0.71 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 0.00 0.00 73 C 7.50 4.75 0.00 3.09 3.29 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 0.00 74 V 8.31 4.84 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 0.84 0.00 0.00 0.93 0.00 0.00 75 N 9.24 4.99 0.00 2.63 2.71 0.00 0.00 6.61 6.28 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 76 L 8.53 5.02 0.00 1.51 1.61 0.93 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 77 I 9.21 4.45 1.95 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 1.34 0.82 0.96 0.00 0.00 78 P 0.00 4.70 0.00 2.08 2.22 0.00 3.94 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.97 0.00 79 Q 8.37 3.54 0.00 2.24 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.84 0.00 0.00 0.00 0.00 0.00 2.18 1.93 0.00 80 I 7.64 4.47 2.01 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 1.26 0.76 0.95 0.00 0.00 81 T 8.46 5.02 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 1.22 0.00 0.00 82 S 8.98 4.83 0.00 3.91 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 83 I 8.67 5.12 1.88 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 1.00 1.55 0.88 0.00 0.00 84 Y 7.73 4.94 0.00 3.05 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 85 E 8.91 4.98 0.00 2.12 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 2.49 2.33 0.00 86 W 9.84 5.49 0.00 3.41 2.91 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 87 K 9.30 3.55 0.00 1.89 1.65 0.00 1.86 0.00 0.00 1.71 0.00 0.00 2.80 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.28 0.98 7.81 88 G 8.49 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 0.00 0.00 0.00 0.00 89 K 7.69 4.44 0.00 1.71 1.68 0.00 1.80 0.00 0.00 1.65 0.00 0.00 2.87 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.32 1.27 7.81 90 I 8.03 4.84 1.83 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 1.33 0.99 0.83 0.00 0.00 91 E 8.88 4.59 0.00 1.16 1.50 0.00 0.00 0.00 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 2.48 0.00 92 E 8.34 5.52 0.00 1.76 1.80 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 2.13 2.06 0.00 93 D 8.60 5.08 0.00 2.75 2.60 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 94 S 8.67 4.87 0.00 3.79 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 95 E 9.48 4.98 0.00 1.89 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 2.33 2.33 0.00 96 V 9.02 4.84 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 1.04 0.00 0.00 0.99 0.00 0.00 97 L 9.05 5.22 0.00 1.84 1.58 1.08 0.90 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 98 M 9.31 4.93 0.00 1.94 2.05 0.00 0.00 0.00 0.00 0.00 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.48 0.00 99 M 9.24 4.27 0.00 1.87 1.64 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 2.20 0.00 100 I 8.74 4.74 1.82 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 1.21 0.68 0.89 0.00 0.00 101 K 8.76 4.92 0.00 1.79 1.83 0.00 1.68 0.00 0.00 1.57 0.00 0.00 2.78 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.35 7.81 102 T 8.55 4.66 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 0.00 103 Q 8.49 4.51 0.00 2.11 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.73 6.68 0.00 0.00 0.00 0.00 0.00 2.43 2.31 0.00 104 S 9.36 4.19 0.00 3.83 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 0.00 105 S 8.03 4.22 0.00 4.00 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 0.00 106 L 7.54 4.30 0.00 1.79 1.70 0.88 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 107 V 7.53 3.60 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 1.09 0.00 0.00 1.00 0.00 0.00 108 P 0.00 4.24 0.00 2.20 2.10 0.00 3.76 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 2.12 2.17 0.00 109 A 7.95 4.01 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 0.00 110 L 8.46 3.96 0.00 1.80 1.90 0.98 0.87 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 0.00 111 T 8.35 3.89 4.42 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 1.23 0.00 0.00 112 D 8.25 4.38 0.00 2.89 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 0.00 113 F 8.00 4.14 0.00 3.05 3.30 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 0.00 114 V 7.76 3.41 2.20 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 0.84 0.00 0.00 1.07 0.00 0.00 115 R 8.20 4.02 0.00 2.06 1.94 0.00 3.18 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.83 0.00 116 S 6.90 4.32 0.00 3.92 3.83 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 0.00 117 V 8.03 3.14 1.58 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 0.57 0.00 0.00 0.50 0.00 0.00 118 H 7.38 4.00 0.00 3.31 3.29 0.00 5.63 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 0.00 119 P 0.00 4.07 0.00 1.79 2.00 0.00 3.67 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 1.91 1.89 0.00 120 Y 7.26 4.94 0.00 2.84 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 0.00 121 E 9.10 3.97 0.00 1.95 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 2.32 0.00 122 V 7.53 4.13 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 0.80 0.00 0.00 0.92 0.00 0.00 123 A 8.33 4.28 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 0.00 124 E 8.78 4.15 0.00 2.05 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 0.00 2.43 2.33 0.00 125 V 8.40 4.88 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 0.93 0.00 0.00 0.96 0.00 0.00 126 I 8.78 4.76 1.94 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 1.28 0.99 0.94 0.00 0.00 127 A 8.81 5.18 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 0.00 128 L 8.85 4.92 0.00 1.82 1.66 1.16 0.78 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 0.00 129 P 0.00 4.83 0.00 2.13 2.08 0.00 3.81 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 2.02 2.00 0.00 130 V 8.74 4.06 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 1.06 0.00 0.00 1.01 0.00 0.00 131 E 9.08 4.07 0.00 2.04 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 2.36 2.38 0.00 132 Q 8.05 4.78 0.00 2.06 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.80 0.00 0.00 0.00 0.00 0.00 2.35 2.41 0.00 133 G 7.71 3.72 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 0.00 0.00 0.00 134 N 7.94 4.51 0.00 2.81 2.75 0.00 0.00 6.54 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 0.00 135 F 8.92 4.12 0.00 3.09 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 0.00 136 P 0.00 4.13 0.00 2.23 2.14 0.00 3.92 0.00 0.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.29 0.00 137 Y 7.97 4.03 0.00 2.97 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 0.00 138 L 8.28 3.93 0.00 1.54 1.33 0.09 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 139 Q 8.40 3.73 0.00 1.22 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.80 0.00 0.00 0.00 0.00 0.00 2.22 2.18 0.00 140 W 8.32 4.00 0.00 3.24 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 0.00 141 V 7.43 2.84 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 0.70 0.00 0.00 0.70 0.00 0.00 142 R 7.52 3.88 0.00 1.81 1.96 0.00 3.16 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.80 0.00 143 Q 8.04 3.83 0.00 1.98 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.18 6.70 0.00 0.00 0.00 0.00 0.00 2.33 2.37 0.00 144 V 7.08 3.71 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 0.11 0.00 0.00 -0.19 0.00 0.00 145 T 7.33 4.44 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 1.03 0.00 0.00 *146 E 7.57 4.16 0.00 2.14 1.76 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 2.26 2.13 0.00 * Residues marked with a * may have inaccurate shift predictions.