NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 L 4.2419 8.1849 120.6346 53.9011 43.2249 176.4039 8 P 4.4542 0.0000 0.0000 60.3922 32.3285 173.2419 9 P 4.3568 0.0000 0.0000 64.9088 32.4351 176.3802 10 G 3.6113 9.0806 111.2119 44.7040 0.0000 172.8592 11 W 4.9322 7.6396 119.6605 56.4855 29.7847 175.9350 12 E 4.9687 10.0478 123.2071 54.5393 34.0418 174.3818 13 K 4.3753 8.7017 122.8267 56.0220 33.2955 175.5380 14 A 4.6164 8.2684 127.5933 50.2742 23.2168 173.9212 15 M 4.7733 8.2966 118.5091 53.9613 34.1055 175.5190 16 S 4.6049 9.5679 122.1041 58.4229 63.1926 174.9328 17 R 4.3242 8.7789 122.8672 57.7950 30.3857 178.0443 18 S 4.3175 8.2969 114.8281 61.0332 63.0898 175.0484 19 S 4.4913 8.2075 112.5683 57.5160 64.1070 175.4893 20 G 4.0666 8.3187 108.6356 45.3097 0.0000 173.9650 21 R 4.2973 8.1049 119.6467 55.8721 31.2389 176.8907 22 V 4.4401 8.4828 115.9829 62.0872 32.6516 174.7096 23 Y 5.1074 8.6599 120.8926 56.1955 42.2902 172.8127 24 Y 5.2405 9.5802 116.2460 56.3089 41.3747 175.1314 25 F 5.5930 9.5922 124.9602 56.4318 43.6294 172.9768 26 N 4.5254 7.4922 122.8940 51.6327 40.5971 174.3401 27 H 4.1535 8.5441 121.9542 56.7435 28.9104 176.5076 28 I 3.9480 7.7804 120.7206 63.2168 37.6957 176.6817 29 T 4.1800 7.4202 107.3611 60.4876 69.5307 174.4022 30 N 4.0357 7.8127 118.4553 54.0500 37.1441 173.6624 31 A 4.3930 7.1518 119.7540 52.2426 19.6861 177.6488 32 S 5.5599 8.5288 113.8611 57.4330 66.1994 173.1780 33 Q 4.4949 9.3858 119.6424 55.2296 31.7323 175.5757 34 W 4.6393 8.7323 120.1036 59.7775 29.5507 177.6228 35 E 4.1972 8.2315 116.7712 55.8359 29.5150 176.6394 36 R 2.5100 8.2069 123.6808 54.7452 30.6312 174.3742 37 P 3.9610 0.0000 0.0000 62.6863 33.1068 173.0174 38 S 3.9720 7.9388 122.2671 58.1308 68.7647 177.7519 *51 E 4.0862 9.2651 117.6261 54.7194 30.0890 172.6919 52 P 4.4239 0.0000 0.0000 62.8806 31.9952 176.1936 53 A 4.2845 8.5691 122.5891 54.4626 18.8855 178.1489 54 R 5.0900 7.7346 111.8907 54.5741 34.0465 175.5519 55 V 4.3192 7.8613 113.8019 59.3625 36.1354 174.3405 56 R 4.9496 8.2900 122.5486 54.0710 32.5256 174.5343 57 C 5.3628 8.7886 121.7941 58.4058 33.1716 172.9324 58 S 5.6351 8.8852 116.7463 57.6415 65.8471 172.6011 59 H 5.7700 9.5927 116.5415 54.6698 32.8923 171.7539 60 L 4.8764 9.2827 120.1710 53.1263 45.1442 174.5081 61 L 5.1368 8.9528 128.6070 53.2193 44.8493 174.9496 62 V 4.7795 8.7575 126.2138 61.1238 33.7445 175.1649 63 K 4.6824 9.0412 128.1127 56.1725 33.5896 175.5378 64 H 5.0210 8.8429 117.0203 53.7752 31.7805 174.3493 65 S 4.0799 9.2838 114.3614 61.2644 62.4599 175.3146 66 Q 4.4256 8.1513 117.0258 55.5637 29.0090 175.9292 67 S 4.4028 7.7404 115.2821 58.4016 63.4869 174.5898 68 R 3.9814 8.8265 120.9932 58.6079 29.0172 176.9739 69 R 4.4034 7.6310 114.5282 53.3624 31.4822 174.1372 70 P 4.5912 0.0000 0.0000 60.9727 30.3631 175.4586 71 S 4.8963 7.3008 112.0305 57.8331 66.2195 172.3681 72 S 4.6302 8.8985 120.1267 56.6849 65.8772 175.1693 73 W 4.3660 8.7691 117.4194 59.6072 27.7535 177.7806 74 R 3.4196 6.7077 117.3157 58.2559 29.9453 176.9875 75 Q 4.3871 7.6183 118.3605 54.6128 32.2284 174.5173 76 E 3.9493 9.0094 126.8711 58.1857 29.9539 176.3229 77 K 4.3645 7.6934 118.9195 54.3072 33.9636 175.1134 78 I 4.3150 9.0235 128.7658 60.2492 37.2208 176.0003 79 T 4.3753 8.3205 115.7385 61.9279 70.3613 175.4787 80 R 4.1520 7.8629 118.9853 56.5278 29.8965 176.0934 81 T 4.3891 8.8458 111.0034 61.2184 71.0256 175.6560 82 K 3.6217 8.5484 123.4655 60.0643 32.1619 178.3042 83 E 4.0413 8.0924 118.7166 59.0325 29.7104 178.2120 84 E 3.9165 8.4301 118.6899 59.2671 29.4975 179.0746 85 A 3.9477 8.3424 121.1812 55.1480 18.4165 179.4605 86 L 3.8638 8.0085 118.7590 58.2068 42.1633 178.9377 87 E 3.8999 8.1532 118.5984 59.3054 29.3144 179.2936 88 L 3.4522 7.6839 118.7641 57.6683 41.5946 179.3795 89 I 3.7053 7.5059 119.5331 64.6820 37.0057 178.1162 90 N 4.3917 8.4932 117.4710 56.2627 38.3799 177.5718 91 G 3.5365 7.9121 106.9601 48.1718 0.0000 175.3025 92 Y 4.4585 7.7530 119.4629 60.7526 37.8643 178.7783 93 I 3.8103 8.1964 121.0027 64.4879 37.2185 178.1266 94 Q 4.0318 8.3195 119.2251 59.4304 28.7440 179.8434 95 K 4.0907 8.2397 118.9564 59.2086 31.8032 179.7320 96 I 4.3317 8.1167 121.9609 64.0317 36.9035 178.6752 97 K 4.0924 8.5381 118.5511 59.1380 31.9350 179.0592 98 S 4.4351 8.3095 113.4400 59.1242 63.3911 175.4047 99 G 3.9846 7.6531 110.2066 45.1472 0.0000 173.8634 100 E 4.1220 7.9212 120.5887 58.5437 30.0132 176.8787 101 E 4.8059 8.2457 116.3161 53.7752 33.8784 174.3920 102 D 5.1089 8.2853 120.9737 51.8411 42.7308 177.1832 103 F 3.9310 8.7980 122.2864 61.8437 39.3180 177.0782 104 E 3.9965 8.5031 117.3420 59.6541 29.2822 179.3275 105 S 4.0059 7.9259 112.4939 61.4310 62.4507 176.2545 106 L 3.8621 7.7321 121.2927 57.4610 41.2549 179.3922 107 A 3.7126 7.7634 120.9562 55.1396 17.7636 179.8432 108 S 4.2191 7.9137 113.6429 61.9269 62.6679 176.9352 109 Q 3.9205 7.5205 119.3848 57.5687 28.5154 176.8487 110 F 5.0087 7.8147 115.0867 56.7098 41.2287 175.3749 111 S 4.3894 7.9386 116.2766 58.5235 62.4072 173.4890 112 D 4.3902 9.0358 126.9877 54.8418 40.9906 175.9012 113 C 4.6208 7.7977 120.9386 58.1324 32.8449 174.4926 114 S 4.1981 8.7786 121.1674 61.1895 62.5117 176.4683 115 S 4.2007 8.3592 117.3302 60.8492 62.4164 175.8300 116 A 4.0051 8.2980 125.2938 55.4811 17.8301 179.5397 117 K 3.8980 7.8510 115.2005 57.9691 32.3728 177.5180 118 A 4.6638 7.6257 122.4799 51.8505 19.5617 176.4426 119 R 3.8472 8.1167 114.7865 58.0083 28.3267 178.1418 120 G 4.1253 8.3555 104.2113 46.2500 0.0000 173.7165 121 D 4.9104 7.9318 119.6375 53.8249 41.4152 175.8874 122 L 4.3801 8.8506 125.9511 53.8560 42.3615 177.9713 123 G 3.8899 8.5260 109.1637 44.5231 0.0000 172.4380 124 A 4.8099 8.3198 119.7936 51.5098 20.2431 176.9110 125 F 5.1758 8.4471 113.8287 56.1385 41.7163 172.9747 126 S 5.4247 9.2016 114.2663 56.1515 66.3490 173.6824 127 R 3.9871 8.1945 118.7029 57.6339 30.0813 177.4679 128 G 4.0313 9.1618 109.4066 45.4992 0.0000 173.8884 129 Q 4.4321 7.5924 117.6923 56.8941 30.7258 176.1003 130 M 4.2641 7.7146 114.8208 53.1720 34.0728 176.0585 131 A 3.9870 8.2732 121.5294 52.6847 19.8422 178.3596 132 K 3.8293 8.8230 124.9486 59.3854 32.2473 177.1750 133 P 4.3125 0.0000 0.0000 65.5484 31.1789 178.1950 134 F 3.8865 8.2608 118.7920 61.2659 39.2566 176.4757 135 E 4.3682 8.9334 119.1819 59.7361 29.5938 178.5644 136 D 4.4105 8.7849 119.0079 57.2115 40.8264 178.5357 137 A 3.9129 8.2001 121.3912 55.3055 18.1537 179.8979 138 S 3.9199 8.0251 112.4265 61.8688 63.0796 176.8745 139 F 4.0315 8.5723 118.6448 59.6131 38.7098 176.8577 140 A 4.3196 7.6905 118.5304 52.3608 19.1751 177.6746 141 L 4.2713 7.0007 117.0040 54.6296 42.4987 177.0239 142 R 4.4451 9.7103 121.9771 54.6456 31.6917 176.3122 143 T 3.8521 8.2121 116.0537 65.8221 68.6443 174.6803 144 G 3.9693 9.2767 115.4734 45.0578 0.0000 173.4536 145 E 4.3954 8.1562 119.6033 56.0210 31.0679 175.2651 146 M 5.1214 8.4062 122.1209 53.6799 34.7047 175.5521 147 S 4.3529 8.8982 120.9706 58.0319 64.6467 174.4504 148 G 4.1849 8.0814 107.5908 44.4520 0.0000 171.1186 149 P 4.5789 0.0000 0.0000 63.0167 32.1098 176.2837 150 V 4.4824 8.7912 124.3435 61.1476 34.4253 173.9601 151 F 5.2198 9.2943 126.9948 56.4449 40.3918 175.2316 152 T 4.8886 9.0651 112.9978 59.5969 72.1402 174.3950 153 D 4.4928 8.6591 119.8557 57.2417 41.0321 179.4581 154 S 4.2191 8.2385 115.3113 59.3370 63.8545 175.4452 155 G 3.9768 6.3536 109.1341 46.1653 0.0000 171.2337 156 I 4.7301 8.2927 124.5664 59.7406 40.0834 174.6643 157 H 5.6222 9.4257 124.0398 54.1781 32.1542 173.3096 158 I 4.8394 8.5898 121.6963 59.6970 39.9112 174.6378 159 I 4.9655 8.8493 127.8044 59.2895 40.4184 174.2513 160 L 4.7465 8.7331 128.4769 53.0254 44.7481 175.0044 161 R 4.6190 8.8279 128.2656 56.0652 30.4930 176.4449 162 T 4.4559 8.6565 116.9916 62.1892 70.6686 174.7836 163 E 4.1889 7.6817 126.8367 56.9035 30.5500 174.6819 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 L 8.18 4.24 0.00 1.77 1.80 1.19 0.61 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 8 P 0.00 4.45 0.00 2.45 2.04 0.00 3.54 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 2.01 2.11 0.00 9 P 0.00 4.36 0.00 2.06 2.06 0.00 3.74 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 2.08 2.16 0.00 10 G 9.08 3.61 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 0.00 0.00 0.00 11 W 7.64 4.93 0.00 3.43 3.22 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 12 E 10.05 4.97 0.00 1.93 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 2.37 2.51 0.00 13 K 8.70 4.38 0.00 1.73 1.58 0.00 1.62 0.00 0.00 1.55 0.00 0.00 2.86 0.00 0.00 2.99 0.00 0.00 0.00 0.00 0.97 0.65 7.81 14 A 8.27 4.62 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 M 8.30 4.77 0.00 2.06 1.98 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 2.60 2.63 0.00 16 S 9.57 4.60 0.00 4.30 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 17 R 8.78 4.32 0.00 1.99 2.08 0.00 3.08 0.00 0.00 3.23 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.65 0.00 18 S 8.30 4.32 0.00 3.95 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 19 S 8.21 4.49 0.00 3.94 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 20 G 8.32 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 21 R 8.10 4.30 0.00 1.64 1.94 0.00 2.93 0.00 0.00 3.01 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.54 0.00 22 V 8.48 4.44 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 0.70 0.00 0.00 0.98 0.00 0.00 23 Y 8.66 5.11 0.00 3.07 2.88 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 24 Y 9.58 5.24 0.00 3.04 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 25 F 9.59 5.59 0.00 3.11 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 26 N 7.49 4.53 0.00 1.44 1.45 0.00 0.00 7.07 7.87 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 27 H 8.54 4.15 0.00 3.19 3.54 0.00 5.80 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 I 7.78 3.95 1.74 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.24 0.88 0.00 0.00 29 T 7.42 4.18 4.06 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 1.03 0.00 0.00 30 N 7.81 4.04 0.00 3.08 3.03 0.00 0.00 6.82 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 A 7.15 4.39 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 32 S 8.53 5.56 0.00 4.11 4.23 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 33 Q 9.39 4.49 0.00 2.37 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.87 0.00 0.00 0.00 0.00 0.00 2.51 2.64 0.00 34 W 8.73 4.64 0.00 3.43 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 35 E 8.23 4.20 0.00 1.93 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 2.35 2.44 0.00 36 R 8.21 2.51 0.00 1.44 1.55 0.00 3.16 0.00 0.00 3.15 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.85 0.00 37 P 0.00 3.96 0.00 1.16 0.49 0.00 2.69 0.00 0.00 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.44 0.00 38 S 7.94 3.97 0.00 3.81 2.86 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 *51 E 9.27 4.09 0.00 2.04 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 2.25 2.48 0.00 52 P 0.00 4.42 0.00 2.39 2.02 0.00 3.89 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.91 0.00 53 A 8.57 4.28 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 54 R 7.73 5.09 0.00 1.60 1.86 0.00 3.17 0.00 0.00 3.23 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.63 0.00 55 V 7.86 4.32 1.52 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 -0.15 0.00 0.00 -0.54 0.00 0.00 56 R 8.29 4.95 0.00 1.76 1.66 0.00 3.32 0.00 0.00 3.25 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.42 0.00 57 C 8.79 5.36 0.00 3.29 2.92 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 58 S 8.89 5.64 0.00 3.89 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 59 H 9.59 5.77 0.00 3.64 3.80 0.00 5.22 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 L 9.28 4.88 0.00 1.35 1.48 0.42 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 61 L 8.95 5.14 0.00 1.73 1.44 0.77 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 62 V 8.76 4.78 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 0.97 0.00 0.00 1.11 0.00 0.00 63 K 9.04 4.68 0.00 1.76 1.65 0.00 1.74 0.00 0.00 1.89 0.00 0.00 2.92 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.65 1.33 7.81 64 H 8.84 5.02 0.00 3.38 3.39 0.00 5.47 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 S 9.28 4.08 0.00 3.97 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 66 Q 8.15 4.43 0.00 2.21 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.98 0.00 0.00 0.00 0.00 0.00 2.35 2.41 0.00 67 S 7.74 4.40 0.00 3.81 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 68 R 8.83 3.98 0.00 1.88 2.09 0.00 3.00 0.00 0.00 3.27 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.58 0.00 69 R 7.63 4.40 0.00 1.87 1.94 0.00 3.03 0.00 0.00 3.27 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.57 0.00 70 P 0.00 4.59 0.00 2.23 2.38 0.00 3.68 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.94 0.00 71 S 7.30 4.90 0.00 3.79 3.71 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 72 S 8.90 4.63 0.00 3.97 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 73 W 8.77 4.37 0.00 3.53 3.27 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 74 R 6.71 3.42 0.00 1.38 1.49 0.00 2.85 0.00 0.00 2.94 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 75 Q 7.62 4.39 0.00 1.94 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.90 6.80 0.00 0.00 0.00 0.00 0.00 2.28 2.24 0.00 76 E 9.01 3.95 0.00 1.97 1.96 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 2.29 2.30 0.00 77 K 7.69 4.36 0.00 1.69 1.64 0.00 1.81 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.29 1.41 7.81 78 I 9.02 4.31 1.84 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 1.07 1.28 0.88 0.00 0.00 79 T 8.32 4.38 4.23 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 1.20 0.00 0.00 80 R 7.86 4.15 0.00 2.09 2.10 0.00 3.10 0.00 0.00 3.36 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.65 0.00 81 T 8.85 4.39 4.23 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 1.24 0.00 0.00 82 K 8.55 3.62 0.00 1.63 1.83 0.00 1.72 0.00 0.00 1.87 0.00 0.00 2.96 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.55 1.28 7.81 83 E 8.09 4.04 0.00 2.08 1.91 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 2.36 2.38 0.00 84 E 8.43 3.92 0.00 2.19 1.94 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 2.29 2.30 0.00 85 A 8.34 3.95 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 86 L 8.01 3.86 0.00 1.88 1.88 0.97 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 87 E 8.15 3.90 0.00 2.05 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 2.29 2.34 0.00 88 L 7.68 3.45 0.00 1.66 1.21 0.82 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 89 I 7.51 3.71 1.94 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.85 0.90 0.00 0.00 90 N 8.49 4.39 0.00 2.79 2.84 0.00 0.00 6.97 7.28 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 91 G 7.91 3.54 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 0.00 92 Y 7.75 4.46 0.00 3.20 2.92 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 93 I 8.20 3.81 2.06 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.80 0.97 0.00 0.00 94 Q 8.32 4.03 0.00 2.29 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.81 0.00 0.00 0.00 0.00 0.00 2.41 2.67 0.00 95 K 8.24 4.09 0.00 1.94 1.94 0.00 1.79 0.00 0.00 1.73 0.00 0.00 3.03 0.00 0.00 3.29 0.00 0.00 0.00 0.00 1.51 1.71 7.81 96 I 8.12 4.33 2.12 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 1.68 2.05 1.05 0.00 0.00 97 K 8.54 4.09 0.00 1.83 1.94 0.00 1.74 0.00 0.00 1.81 0.00 0.00 3.13 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.54 1.61 7.81 98 S 8.31 4.44 0.00 4.06 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 0.00 99 G 7.65 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 0.00 0.00 0.00 100 E 7.92 4.12 0.00 1.99 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 0.00 2.37 2.33 0.00 101 E 8.25 4.81 0.00 2.08 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 2.29 2.47 0.00 102 D 8.29 5.11 0.00 3.11 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 0.00 103 F 8.80 3.93 0.00 3.24 3.16 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 0.00 104 E 8.50 4.00 0.00 2.15 2.04 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 2.49 2.65 0.00 105 S 7.93 4.01 0.00 3.92 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 0.00 106 L 7.73 3.86 0.00 1.59 1.32 0.98 0.84 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 0.00 107 A 7.76 3.71 0.97 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 0.00 0.00 108 S 7.91 4.22 0.00 3.96 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 0.00 109 Q 7.52 3.92 0.00 0.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.73 0.00 0.00 0.00 0.00 0.00 2.08 2.22 0.00 110 F 7.81 5.01 0.00 2.74 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 0.00 111 S 7.94 4.39 0.00 3.85 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 0.00 112 D 9.04 4.39 0.00 2.73 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 0.00 113 C 7.80 4.62 0.00 3.03 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 0.00 114 S 8.78 4.20 0.00 4.06 4.17 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 0.00 115 S 8.36 4.20 0.00 4.31 4.25 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 0.00 0.00 0.00 0.00 116 A 8.30 4.01 1.67 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 0.00 0.00 117 K 7.85 3.90 0.00 1.59 1.68 0.00 1.19 0.00 0.00 1.13 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.27 1.26 7.81 118 A 7.63 4.66 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 0.00 119 R 8.12 3.85 0.00 2.05 2.06 0.00 3.19 0.00 0.00 3.10 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.51 0.00 120 G 8.36 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 0.00 121 D 7.93 4.91 0.00 2.72 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 0.00 122 L 8.85 4.38 0.00 1.94 1.69 0.84 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 123 G 8.53 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 0.00 0.00 0.00 124 A 8.32 4.81 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 0.00 125 F 8.45 5.18 0.00 3.20 3.14 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 0.00 0.00 0.00 0.00 126 S 9.20 5.42 0.00 3.97 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 0.00 127 R 8.19 3.99 0.00 1.59 1.78 0.00 2.89 0.00 0.00 3.21 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.66 0.00 128 G 9.16 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 0.00 0.00 0.00 129 Q 7.59 4.43 0.00 1.98 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.76 6.72 0.00 0.00 0.00 0.00 0.00 2.34 2.38 0.00 130 M 7.71 4.26 0.00 1.80 2.03 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.90 0.00 131 A 8.27 3.99 1.29 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 0.00 132 K 8.82 3.83 0.00 1.91 1.87 0.00 1.64 0.00 0.00 1.85 0.00 0.00 3.07 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.53 1.64 7.81 133 P 0.00 4.31 0.00 2.39 2.19 0.00 3.74 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 2.28 2.22 0.00 134 F 8.26 3.89 0.00 3.03 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 0.00 135 E 8.93 4.37 0.00 2.23 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 0.00 2.43 2.61 0.00 136 D 8.78 4.41 0.00 2.93 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 0.00 137 A 8.20 3.91 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 0.00 138 S 8.03 3.92 0.00 4.22 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 0.00 139 F 8.57 4.03 0.00 3.12 3.15 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 0.00 140 A 7.69 4.32 1.25 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 0.00 0.00 0.00 0.00 0.00 0.00 141 L 7.00 4.27 0.00 1.65 1.55 0.83 1.18 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 0.00 142 R 9.71 4.45 0.00 1.97 1.81 0.00 3.24 0.00 0.00 3.23 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.63 0.00 143 T 8.21 3.85 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 0.00 144 G 9.28 3.97 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 0.00 0.00 0.00 145 E 8.16 4.40 0.00 2.09 1.91 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 2.35 2.26 0.00 146 M 8.41 5.12 0.00 2.01 1.86 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.52 0.00 147 S 8.90 4.35 0.00 3.97 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 0.00 148 G 8.08 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 0.00 0.00 0.00 0.00 149 P 0.00 4.58 0.00 1.99 1.83 0.00 3.71 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 2.09 2.10 0.00 150 V 8.79 4.48 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 0.98 0.00 0.00 0.92 0.00 0.00 151 F 9.29 5.22 0.00 2.99 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 0.00 152 T 9.07 4.89 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 1.35 0.00 0.00 153 D 8.66 4.49 0.00 2.76 2.79 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 0.00 0.00 0.00 154 S 8.24 4.22 0.00 3.94 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 0.00 155 G 6.35 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 0.00 0.00 0.00 156 I 8.29 4.73 1.72 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 0.60 0.73 0.36 0.00 0.00 157 H 9.43 5.62 0.00 3.10 3.46 0.00 5.56 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 I 8.59 4.84 2.16 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.87 1.15 0.00 0.00 159 I 8.85 4.97 1.66 0.00 0.00 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.67 0.64 0.00 0.00 160 L 8.73 4.75 0.00 0.55 0.49 0.76 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 161 R 8.83 4.62 0.00 1.78 1.86 0.00 3.11 0.00 0.00 3.24 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.46 0.00 162 T 8.66 4.46 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 1.14 0.00 0.00 163 E 7.68 4.19 0.00 1.92 1.73 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 2.27 2.25 0.00 * Residues marked with a * may have inaccurate shift predictions.