NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 10 G 4.0345 8.2127 108.0253 46.2312 0.0000 172.3652 11 Q 4.7580 8.5634 125.2225 53.8865 32.3176 171.5262 12 I 4.5757 9.0434 125.9938 59.0971 41.6731 173.4610 13 R 5.0630 8.3103 127.7335 54.3970 32.6480 174.8713 14 I 4.0087 8.6840 127.9490 61.7241 37.8673 177.0385 15 I 3.6976 9.0763 128.7970 63.3508 37.4492 175.7731 16 G 4.0887 8.5735 106.3424 44.0207 0.0000 172.1586 17 G 3.5746 8.3622 105.7600 44.5770 0.0000 173.9662 18 Q 3.9175 7.5413 116.5642 58.0493 28.9423 177.0314 19 W 4.8597 7.8173 118.2549 56.0550 29.4171 175.2233 20 R 3.9468 7.4651 118.8251 58.4074 29.5243 176.9183 21 G 3.9655 9.1900 113.3050 45.4445 0.0000 173.4678 22 R 4.3278 7.9538 119.6052 55.5848 31.5599 175.5375 23 K 5.0440 8.5332 121.8824 54.6422 34.6207 175.5623 24 L 4.8891 8.8308 124.2594 51.8735 45.3298 174.3954 25 P 4.8204 0.0000 0.0000 63.1635 31.9673 175.9123 26 V 4.6049 7.9635 114.5914 58.7762 35.5266 173.9176 27 P 4.3708 0.0000 0.0000 62.7331 32.3641 176.6404 28 D 4.6314 8.2429 120.3572 53.3325 39.8607 176.2585 29 S 4.5019 7.5402 116.3469 56.8371 64.5898 172.8219 30 P 4.4784 0.0000 0.0000 61.7187 31.6702 175.8064 *36 T 4.1133 8.0608 113.6652 61.0846 71.1528 173.9783 37 D 4.3622 8.5696 122.3431 57.9075 40.8265 179.7604 38 R 3.8501 7.7931 115.7420 59.0381 29.6640 178.5032 39 V 3.1523 7.2737 119.1765 65.8925 31.4596 178.1312 40 R 3.9129 7.7161 117.1270 59.1905 29.8436 178.7240 41 E 3.8748 8.5206 119.3059 59.5402 29.5972 178.6171 42 T 3.4622 7.6240 115.7599 66.5372 68.4841 176.0255 43 L 3.1691 7.1797 121.4646 58.1417 41.8647 179.1883 44 F 4.0859 7.7478 115.6223 59.8671 38.9778 177.3387 45 N 4.5414 8.2961 116.9008 56.2535 38.1785 177.2374 46 W 4.4904 8.0238 118.9837 59.5425 29.4549 177.6833 47 L 4.4587 8.0041 116.3542 54.6357 41.1832 178.2468 48 A 4.0815 7.7234 122.9105 54.8019 18.3283 177.1240 49 P 4.5671 0.0000 0.0000 63.9022 31.8374 176.8287 50 V 4.3753 7.6511 110.8402 61.1422 33.5886 176.5800 51 I 3.8786 7.8224 120.6010 63.5791 38.2077 176.1088 52 V 4.0775 7.7290 120.0145 64.0648 31.7066 174.9688 53 D 4.5298 9.2240 125.5846 55.0409 39.1444 173.7772 54 A 4.4050 7.8147 121.3749 51.9919 20.2207 177.3145 55 Q 4.9499 8.8828 119.6219 54.8324 30.6270 174.6412 56 C 5.8410 9.0157 122.0001 56.9829 31.7431 172.7502 57 L 5.0208 8.2372 124.0156 53.2347 44.4436 174.1517 58 D 5.4761 9.0302 126.8033 52.9957 42.3581 176.4421 59 C 3.8818 9.0414 125.2016 61.8516 28.8384 174.6140 60 F 4.7695 8.0509 116.2675 55.6129 39.3872 174.0055 61 A 4.5372 8.8215 127.9411 51.9876 19.9442 179.6438 62 G 4.1964 8.1806 104.9378 47.5060 0.0000 174.6641 63 S 4.3357 8.8135 120.7217 58.5584 62.7803 174.5373 64 G 3.8325 8.7937 109.4059 46.1189 0.0000 175.4117 65 A 3.8790 8.1535 123.4081 55.2122 18.0269 180.4472 66 L 4.0212 7.7325 116.3962 57.3880 42.0104 179.5884 67 G 3.6911 7.8506 105.0978 47.9636 0.0000 175.6381 68 L 4.1533 8.4654 122.2969 57.2338 41.6483 179.2366 69 E 3.5996 7.7786 118.8404 58.9314 29.4798 178.5565 70 A 4.1183 7.9310 120.8219 55.3432 18.4788 179.5503 71 L 3.8740 7.9050 117.2812 58.0911 41.7469 179.5594 72 S 2.8145 8.1350 113.1485 60.7127 61.8526 175.3287 73 R 4.2381 7.0590 118.2118 55.9861 30.6477 176.1050 74 Y 3.5207 7.2580 114.4923 58.5488 35.6762 169.0838 75 A 4.5953 7.8047 120.7356 52.5549 18.4874 178.8014 76 A 4.1335 8.8468 123.0725 55.0825 19.1442 178.0941 77 G 4.6918 7.8369 98.9217 45.3345 0.0000 172.5982 78 A 5.3563 8.2205 121.4475 50.6897 22.9670 175.0650 79 T 4.8643 9.2462 119.9667 61.9670 70.8065 173.6999 80 L 5.0000 8.9423 127.1387 52.9632 44.5728 175.4117 81 I 4.5593 8.4289 125.3976 59.6124 39.6597 174.7238 82 E 4.3866 8.5529 127.2548 54.8774 33.9295 172.7408 *84 D 4.5254 8.5198 117.8274 53.9636 42.1315 176.2688 85 R 3.8616 8.6864 126.5888 59.4761 30.3178 178.1106 86 A 3.9953 8.0262 120.1295 55.0828 18.4377 179.6668 87 V 3.5329 8.3784 117.1685 66.2035 31.7015 178.4883 88 S 4.1376 8.3667 114.3729 61.5415 62.8787 176.4690 89 Q 3.9827 8.2104 121.6949 58.7824 28.3703 178.4544 90 Q 3.9681 8.0274 120.2484 58.7690 28.9481 177.9406 91 L 3.8927 8.0377 121.6119 58.1340 42.1386 178.8978 92 I 3.6637 7.7402 119.6952 64.4797 37.0217 178.5825 93 K 3.9644 7.9308 118.8990 59.5350 31.8676 179.2570 94 N 4.2501 8.5017 117.1987 56.1057 38.4112 177.4292 95 L 3.8176 8.2012 120.6199 57.6553 41.6783 179.4696 96 A 3.9388 7.9516 120.6573 55.4115 18.1037 179.6451 97 T 3.7291 7.6627 113.1736 66.8292 68.6638 176.2673 98 L 3.6602 7.5189 117.9906 54.3508 41.7699 177.0771 99 K 3.6698 7.5600 117.0103 57.2254 29.9277 175.9588 100 A 4.5795 7.9696 123.3979 51.1389 17.9157 178.4208 101 G 3.8587 8.6031 111.5807 48.3453 0.0000 172.0470 102 N 4.9584 8.0233 118.1508 52.6035 37.4488 174.3979 103 A 5.3286 7.8166 118.5579 52.0769 22.9656 176.5629 104 R 4.7159 8.8954 114.6288 54.5861 33.5278 174.1085 105 V 4.7334 8.3882 120.1744 61.1794 33.9275 174.5878 106 V 4.1665 8.5565 128.5154 61.1496 33.5310 174.2226 107 N 5.6818 8.7660 127.5815 52.5816 38.0749 173.5011 108 S 4.8082 7.9618 118.1800 56.4546 65.9500 173.3862 109 N 4.5556 8.7756 121.5607 52.5663 37.9648 176.2228 110 A 4.2149 8.1522 120.8265 52.6443 17.5804 180.0720 *112 S 4.3983 8.2501 117.4379 60.2535 64.9452 176.4368 113 F 4.1334 8.0359 120.5778 61.1235 39.0995 176.1053 114 L 3.6625 8.0287 118.2310 56.0025 42.2238 177.4012 115 A 4.4490 7.2714 123.3969 49.4399 17.0150 175.3457 116 Q 4.4746 7.2834 118.6867 54.0566 31.4902 174.5310 117 K 3.7011 8.6164 120.5441 56.9810 32.5004 176.4410 118 G 2.0000 7.9143 116.3469 44.1385 0.0000 172.0485 119 T 4.7003 6.9382 112.8978 59.1271 70.7218 171.8890 120 P 4.8165 0.0000 0.0000 63.1645 32.3568 175.1466 121 H 5.1335 9.1667 119.8132 54.1506 32.2830 173.8889 122 N 4.7537 8.8866 117.5580 53.1788 39.2190 174.1585 123 I 4.9044 7.8162 120.9077 59.5780 40.9749 174.4558 124 V 4.5896 8.4679 126.4665 60.9064 35.0355 173.9229 125 F 5.4828 9.0723 126.1890 56.0973 41.6341 174.9429 126 V 4.8558 9.4109 123.6842 60.9368 32.5912 171.9549 127 D 5.4118 8.7208 124.2082 50.8866 41.5830 172.9911 128 P 2.9700 0.0000 0.0000 60.3147 32.3430 176.5192 129 P 4.1734 0.0000 0.0000 65.1020 31.5559 176.1988 130 F 4.8747 6.3255 109.4148 55.7147 40.9011 173.8711 131 R 4.2011 8.5807 117.5549 57.6145 30.6450 176.8795 132 R 4.2262 7.9618 118.0836 57.3080 30.2567 176.6274 133 G 4.1729 9.4186 112.2534 45.0949 0.0000 173.4623 134 L 4.5880 8.2186 117.7672 55.9926 44.4215 178.7196 135 L 3.9095 7.9150 119.2470 58.1758 42.1783 178.3452 136 E 3.8425 8.0478 118.7689 59.2500 29.5867 178.3376 137 E 3.9603 8.1283 118.1415 59.6734 29.4825 179.3763 138 T 3.8734 8.0317 115.5993 66.6772 68.6039 176.5515 139 I 3.7374 7.6549 121.7070 64.7287 37.0822 178.1909 140 N 4.2586 7.9906 116.8906 56.2927 38.4846 177.5478 141 L 4.0800 8.1676 120.4505 57.6836 41.2658 179.3855 142 L 4.3050 8.3439 119.3056 58.0656 41.4364 179.3389 143 E 4.2127 8.2798 117.6823 59.5602 29.7562 178.1926 144 D 4.6346 8.3741 117.5088 55.9578 41.2634 176.9784 145 N 4.7210 8.1906 115.1615 52.7086 38.8806 175.5161 146 G 3.8432 8.1967 105.2686 46.2632 0.0000 174.8679 147 W 5.1532 7.8263 118.8550 56.8012 30.2534 175.8712 148 L 5.2825 7.7875 119.7821 52.3575 43.2129 176.4100 149 A 4.1362 8.7364 126.0788 52.0441 18.9087 177.0507 150 D 4.4683 8.9147 118.7275 56.8114 42.1212 176.3902 151 E 5.1047 8.1030 118.2107 54.2372 31.8405 175.1071 152 A 4.9155 8.7265 127.5059 50.3932 23.6069 174.3500 153 L 5.1201 8.8982 119.6352 52.8870 45.2943 175.7193 154 I 4.8941 8.7125 124.6278 59.5370 40.0951 174.1171 155 Y 5.1593 9.2446 129.8749 57.3204 40.3288 174.2929 156 V 4.7350 8.7903 126.1297 61.1525 34.8855 173.3262 157 E 4.9297 8.4709 129.4301 54.4810 31.1995 175.0029 158 S 4.6315 8.4276 119.7681 56.8635 66.9635 173.3008 159 E 4.5305 8.5857 121.3142 56.4648 29.2691 177.7841 160 V 3.5293 9.3095 125.6668 64.5598 31.7479 176.8284 161 E 3.7556 8.6858 117.4947 59.9772 29.5388 177.0281 162 N 4.3768 7.8713 118.6744 52.0567 39.4266 175.1633 163 G 3.8720 8.2638 109.8038 44.9332 0.0000 173.0711 164 L 4.3262 8.0623 119.3774 54.1172 41.3882 175.1489 165 P 4.4675 0.0000 0.0000 62.8542 32.0266 176.1164 166 T 4.2845 8.4184 110.6866 61.0498 69.9380 174.5303 167 V 3.8384 7.5462 115.2831 58.3131 35.2285 173.8019 168 P 4.2095 0.0000 0.0000 62.3180 31.7062 177.6044 169 A 4.0712 8.4498 122.4279 54.8333 18.5932 178.2413 170 N 4.8574 8.2971 111.7442 52.6970 37.9517 173.9715 171 W 5.5597 8.1472 119.3840 55.6472 31.1630 175.7278 172 S 4.9462 9.3809 117.4876 56.3523 66.5312 173.0084 173 L 3.9568 8.7931 124.1399 56.1084 41.6913 175.5162 174 H 4.7410 9.1900 126.3897 57.3757 31.7753 174.7722 175 R 4.3001 7.2297 114.6722 54.5713 34.5624 173.9246 176 E 5.2691 8.0310 121.3239 54.9497 33.0762 173.9639 177 K 4.8229 9.5948 127.4195 54.6792 35.6799 174.5682 178 V 5.0557 8.7399 126.7017 61.1758 33.5363 174.6094 179 A 4.7061 8.7419 130.4505 51.2480 22.5156 175.1080 180 G 3.7783 8.6005 111.8378 47.4753 0.0000 174.1421 181 Q 4.5490 8.5211 120.3942 55.7215 29.4269 174.3737 182 V 4.7788 7.6575 117.6396 60.9522 34.6532 173.8989 183 A 4.8881 9.1012 130.1969 50.9059 20.8801 175.2626 184 Y 4.9029 9.3941 121.6295 56.6284 39.9038 175.2635 185 R 5.2674 9.0478 123.4639 54.1372 34.6344 174.3577 186 L 5.3032 8.4820 124.0498 53.6664 44.7240 174.5908 187 Y 5.0652 9.2035 124.1910 56.4320 40.7785 174.3793 188 Q 4.7677 9.2173 124.9496 54.9589 31.1190 174.2113 189 R 4.9987 8.8822 126.4919 54.4628 33.1544 173.8637 190 E 5.2491 8.6914 124.5494 54.0700 32.6468 175.8351 191 A 4.1593 8.6189 125.9153 52.0615 19.3487 177.7399 192 Q 4.1172 8.5813 118.8749 56.2715 28.9389 176.2124 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 10 G 8.21 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 11 Q 8.56 4.76 0.00 2.08 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.73 6.66 0.00 0.00 0.00 0.00 0.00 2.21 2.53 0.00 12 I 9.04 4.58 1.84 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 1.07 1.41 0.93 0.00 0.00 13 R 8.31 5.06 0.00 1.78 1.72 0.00 3.27 0.00 0.00 3.20 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.75 0.00 14 I 8.68 4.01 2.02 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 1.33 0.25 0.94 0.00 0.00 15 I 9.08 3.70 1.91 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 1.34 0.41 0.86 0.00 0.00 16 G 8.57 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 0.00 0.00 0.00 17 G 8.36 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.54 3.92 0.00 1.86 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.90 7.19 0.00 0.00 0.00 0.00 0.00 1.16 1.16 0.00 19 W 7.82 4.86 0.00 3.39 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 20 R 7.47 3.95 0.00 1.67 1.96 0.00 3.42 0.00 0.00 3.22 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.61 0.00 21 G 9.19 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 22 R 7.95 4.33 0.00 1.91 1.79 0.00 3.15 0.00 0.00 3.21 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.80 0.00 23 K 8.53 5.04 0.00 1.56 1.79 0.00 1.56 0.00 0.00 1.75 0.00 0.00 2.99 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.32 1.46 7.81 24 L 8.83 4.89 0.00 1.43 1.58 0.76 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 25 P 0.00 4.82 0.00 2.04 2.02 0.00 3.75 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.96 0.00 26 V 7.96 4.60 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 0.68 0.00 0.00 0.91 0.00 0.00 27 P 0.00 4.37 0.00 2.03 1.98 0.00 3.66 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.06 0.00 28 D 8.24 4.63 0.00 2.61 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 29 S 7.54 4.50 0.00 3.90 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 P 0.00 4.48 0.00 2.18 2.09 0.00 3.81 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 1.95 1.94 0.00 *36 T 8.06 4.11 4.21 0.00 0.00 0.00 0.00 0.00 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 37 D 8.57 4.36 0.00 2.74 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 38 R 7.79 3.85 0.00 1.93 2.11 0.00 2.92 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.56 0.00 39 V 7.27 3.15 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 1.00 0.00 0.00 0.73 0.00 0.00 40 R 7.72 3.91 0.00 2.15 1.95 0.00 3.06 0.00 0.00 3.06 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.60 0.00 41 E 8.52 3.87 0.00 1.92 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 2.25 2.31 0.00 42 T 7.62 3.46 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 0.07 0.00 0.00 43 L 7.18 3.17 0.00 1.04 1.24 0.68 -0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 44 F 7.75 4.09 0.00 3.15 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 45 N 8.30 4.54 0.00 2.91 2.93 0.00 0.00 6.83 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 46 W 8.02 4.49 0.00 3.48 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 47 L 8.00 4.46 0.00 1.70 1.74 0.66 0.56 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 48 A 7.72 4.08 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 49 P 0.00 4.57 0.00 2.20 2.20 0.00 3.47 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.14 0.00 50 V 7.65 4.38 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 0.71 0.00 0.00 0.96 0.00 0.00 51 I 7.82 3.88 2.16 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.38 1.08 0.00 0.00 52 V 7.73 4.08 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 0.86 0.00 0.00 1.01 0.00 0.00 53 D 9.22 4.53 0.00 2.86 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 A 7.81 4.41 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.88 4.95 0.00 2.03 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.70 0.00 0.00 0.00 0.00 0.00 2.33 2.46 0.00 56 C 9.02 5.84 0.00 2.98 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 57 L 8.24 5.02 0.00 1.19 1.26 0.73 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 58 D 9.03 5.48 0.00 3.07 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 59 C 9.04 3.88 0.00 2.70 2.22 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 60 F 8.05 4.77 0.00 3.06 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 61 A 8.82 4.54 1.35 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 62 G 8.18 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 0.00 0.00 0.00 0.00 63 S 8.81 4.34 0.00 3.86 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 64 G 8.79 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 0.00 0.00 0.00 65 A 8.15 3.88 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 66 L 7.73 4.02 0.00 1.51 0.65 0.75 0.75 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 67 G 7.85 3.69 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 0.00 0.00 0.00 0.00 0.00 0.00 68 L 8.47 4.15 0.00 1.70 1.76 0.90 0.95 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 69 E 7.78 3.60 0.00 1.87 1.18 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 1.47 1.47 0.00 70 A 7.93 4.12 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 0.00 0.00 0.00 0.00 0.00 71 L 7.90 3.87 0.00 2.15 1.88 1.11 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 72 S 8.14 2.81 0.00 4.05 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 73 R 7.06 4.24 0.00 1.94 1.93 0.00 3.00 0.00 0.00 3.24 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.48 0.00 74 Y 7.26 3.52 0.00 3.19 3.04 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 0.00 0.00 0.00 75 A 7.80 4.60 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 76 A 8.85 4.13 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 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4.00 1.35 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 87 V 8.38 3.53 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 1.06 0.00 0.00 0.94 0.00 0.00 88 S 8.37 4.14 0.00 4.04 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 89 Q 8.21 3.98 0.00 2.09 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.84 0.00 0.00 0.00 0.00 0.00 2.52 2.50 0.00 90 Q 8.03 3.97 0.00 2.18 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.81 0.00 0.00 0.00 0.00 0.00 2.33 2.42 0.00 91 L 8.04 3.89 0.00 1.88 1.82 0.89 0.81 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 92 I 7.74 3.66 2.00 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 1.50 0.52 0.89 0.00 0.00 93 K 7.93 3.96 0.00 2.08 1.81 0.00 1.64 0.00 0.00 1.62 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.64 7.81 94 N 8.50 4.25 0.00 2.74 2.73 0.00 0.00 7.03 6.37 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 95 L 8.20 3.82 0.00 1.79 1.67 0.91 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 96 A 7.95 3.94 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 97 T 7.66 3.73 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 1.09 0.00 0.00 98 L 7.52 3.66 0.00 1.12 0.21 0.17 -0.23 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 99 K 7.56 3.67 0.00 1.99 1.94 0.00 1.72 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.33 1.52 7.81 100 A 7.97 4.58 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.60 3.86 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 0.00 0.00 0.00 102 N 8.02 4.96 0.00 2.98 3.10 0.00 0.00 5.93 7.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 *112 S 8.25 4.40 0.00 3.98 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 0.00 113 F 8.04 4.13 0.00 2.93 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 0.00 114 L 8.03 3.66 0.00 1.62 1.55 0.73 -0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 115 A 7.27 4.45 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 0.00 116 Q 7.28 4.47 0.00 2.09 2.05 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 2.41 2.34 0.00 117 K 8.62 3.70 0.00 1.68 1.62 0.00 1.67 0.00 0.00 1.59 0.00 0.00 2.66 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.21 1.32 7.81 118 G 7.91 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 0.00 0.00 0.00 0.00 0.00 0.00 119 T 6.94 4.70 4.14 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 1.36 0.00 0.00 120 P 0.00 4.82 0.00 2.09 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0.00 0.00 0.00 0.00 2.31 2.35 0.00 137 E 8.13 3.96 0.00 2.26 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 2.42 2.47 0.00 138 T 8.03 3.87 4.49 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 1.28 0.00 0.00 139 I 7.65 3.74 1.79 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.88 -0.05 0.00 0.00 140 N 7.99 4.26 0.00 2.87 2.83 0.00 0.00 7.11 6.89 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 0.00 141 L 8.17 4.08 0.00 1.86 1.80 0.94 0.54 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 0.00 142 L 8.34 4.31 0.00 2.18 2.02 1.12 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 143 E 8.28 4.21 0.00 2.26 2.19 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 2.41 2.50 0.00 144 D 8.37 4.63 0.00 2.79 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 0.00 145 N 8.19 4.72 0.00 3.24 3.00 0.00 0.00 6.84 6.95 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 0.00 146 G 8.20 3.84 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 0.00 0.00 0.00 147 W 7.83 5.15 0.00 3.57 3.33 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 0.00 148 L 7.79 5.28 0.00 1.54 1.52 1.04 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 149 A 8.74 4.14 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 0.00 150 D 8.91 4.47 0.00 2.59 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 0.00 151 E 8.10 5.10 0.00 1.88 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 2.13 2.28 0.00 152 A 8.73 4.92 1.12 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 0.00 153 L 8.90 5.12 0.00 1.49 1.53 0.89 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 154 I 8.71 4.89 1.70 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.39 1.14 0.00 0.00 155 Y 9.24 5.16 0.00 3.25 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 0.00 156 V 8.79 4.74 2.39 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 0.95 0.00 0.00 1.23 0.00 0.00 157 E 8.47 4.93 0.00 1.72 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 2.05 1.85 0.00 158 S 8.43 4.63 0.00 3.85 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 0.00 159 E 8.59 4.53 0.00 1.85 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 2.27 2.31 0.00 160 V 9.31 3.53 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 0.76 0.00 0.00 0.93 0.00 0.00 161 E 8.69 3.76 0.00 2.08 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 0.00 2.28 2.35 0.00 162 N 7.87 4.38 0.00 2.70 2.80 0.00 0.00 6.85 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 163 G 8.26 3.87 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 0.00 0.00 0.00 164 L 8.06 4.33 0.00 1.81 1.71 0.96 0.65 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 0.00 165 P 0.00 4.47 0.00 2.09 2.05 0.00 3.84 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.01 0.00 166 T 8.42 4.28 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 1.17 0.00 0.00 167 V 7.55 3.84 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 -0.11 0.00 0.00 0.84 0.00 0.00 168 P 0.00 4.21 0.00 2.15 1.85 0.00 2.20 0.00 0.00 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.69 0.00 169 A 8.45 4.07 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 0.00 170 N 8.30 4.86 0.00 3.16 3.13 0.00 0.00 6.19 8.88 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 0.00 171 W 8.15 5.56 0.00 3.18 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 0.00 172 S 9.38 4.95 0.00 3.89 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 0.00 173 L 8.79 3.96 0.00 1.65 1.60 0.55 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 174 H 9.19 4.74 0.00 3.02 3.33 0.00 5.97 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 0.00 175 R 7.23 4.30 0.00 0.81 0.66 0.00 2.21 0.00 0.00 2.58 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.50 0.00 176 E 8.03 5.27 0.00 1.83 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 2.27 2.37 0.00 177 K 9.59 4.82 0.00 2.34 1.99 0.00 1.64 0.00 0.00 1.44 0.00 0.00 2.77 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.48 1.49 7.81 178 V 8.74 5.06 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 0.89 0.00 0.00 0.98 0.00 0.00 179 A 8.74 4.71 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 0.00 180 G 8.60 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 181 Q 8.52 4.55 0.00 2.17 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.73 6.80 0.00 0.00 0.00 0.00 0.00 2.38 2.38 0.00 182 V 7.66 4.78 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 0.15 0.00 0.00 0.94 0.00 0.00 183 A 9.10 4.89 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 0.00 184 Y 9.39 4.90 0.00 3.18 3.18 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 0.00 185 R 9.05 5.27 0.00 1.84 1.37 0.00 3.12 0.00 0.00 2.82 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.54 0.00 186 L 8.48 5.30 0.00 1.79 1.41 1.26 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 187 Y 9.20 5.07 0.00 2.91 2.94 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 0.00 188 Q 9.22 4.77 0.00 1.97 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.75 0.00 0.00 0.00 0.00 0.00 2.25 2.28 0.00 189 R 8.88 5.00 0.00 0.85 1.27 0.00 3.10 0.00 0.00 3.08 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.10 0.00 190 E 8.69 5.25 0.00 1.88 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 2.21 2.20 0.00 191 A 8.62 4.16 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 0.00 192 Q 8.58 4.12 0.00 2.08 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.91 6.60 0.00 0.00 0.00 0.00 0.00 2.39 2.39 0.00 * Residues marked with a * may have inaccurate shift predictions.