NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 T 4.2668 8.1593 117.3739 63.5410 69.5170 173.6263 2 S 4.3785 8.3914 121.6396 55.9114 65.0301 173.2883 3 K 4.0021 9.4140 121.7782 59.7385 32.7378 179.4727 4 K 3.8353 8.1476 118.1515 59.7761 31.7621 178.8198 5 K 3.9567 7.6296 118.2035 59.2063 32.1054 177.9708 6 R 4.3463 7.6253 115.5495 56.5586 30.5273 177.9591 7 Q 4.1736 8.0601 119.8812 57.1746 28.3986 175.7867 8 R 4.1201 7.5611 118.7188 59.3328 29.9359 176.2259 9 G 4.1039 8.9716 111.3961 45.5851 0.0000 174.2023 10 S 4.1357 8.1084 113.7540 58.8886 63.4965 174.6424 11 R 4.1643 8.0714 125.1953 57.3937 29.1512 176.7191 12 T 4.2652 7.6340 104.9326 61.3470 69.8781 173.9064 13 H 4.6497 8.4946 118.5501 56.1879 26.7942 175.3495 14 G 3.9106 8.2694 102.6060 46.3511 0.0000 174.6544 15 G 3.8652 8.2800 107.3615 45.5009 0.0000 175.1499 16 G 4.0204 7.6370 107.6268 44.8649 0.0000 176.2668 17 S 4.2773 8.5749 119.5677 57.7916 62.6180 174.0642 18 H 4.4153 8.8267 121.3513 57.2127 28.2837 175.7220 19 K 4.1562 7.7677 119.3371 56.6631 31.4337 177.0724 20 N 4.3946 7.4115 116.7812 55.1595 39.6012 176.6393 21 R 4.4519 7.4754 120.0223 56.9360 28.9430 177.2645 22 R 4.6357 7.1754 122.5318 56.2352 31.1159 179.8430 23 G 3.9534 8.5157 123.1626 46.7532 0.0000 173.8477 24 A 4.3743 8.6333 122.4632 53.0710 18.8228 179.5191 25 G 3.5957 7.9273 105.1246 47.5614 0.0000 174.8475 26 H 4.6159 7.7387 117.3869 57.3868 29.9451 175.5445 27 R 4.4281 7.4133 116.7252 55.7279 31.1372 175.3727 28 G 3.9021 8.9999 105.8239 47.1964 0.0000 173.8886 29 G 4.1134 7.8020 105.1637 43.5816 0.0000 174.4656 30 R 4.1412 8.6686 120.5233 56.4368 31.7822 175.9332 31 G 3.8632 8.2772 113.3729 47.5448 0.0000 173.5613 32 D 4.7174 8.6015 123.9426 53.9156 40.7363 175.6153 33 A 4.0664 7.3640 123.0251 53.9838 18.7979 179.0452 34 G 3.8244 8.9859 109.7578 45.5732 0.0000 175.0928 35 R 4.0020 7.6826 115.3577 57.5687 29.1719 177.2280 36 D 5.1273 7.8432 115.4945 52.7943 42.0993 175.0305 37 K 4.5693 9.3052 117.0480 57.7082 32.3743 177.1132 38 H 4.5962 9.7377 125.2494 58.1377 29.1506 176.1893 39 E 4.6770 7.6401 120.6676 55.7224 30.4708 177.9003 40 F 5.0368 8.2523 115.4306 59.3302 38.3415 175.4144 41 H 3.6616 6.0228 114.8370 57.3942 29.1103 174.7864 42 N 4.1167 9.0215 121.6474 54.2322 35.1227 175.7907 43 H 4.5911 7.8942 113.9556 54.1860 31.6694 173.6562 44 E 3.8311 8.8735 123.4516 55.7191 29.7418 176.0431 45 P 4.3536 0.0000 0.0000 62.8306 31.6140 175.8932 46 L 4.1393 8.0739 119.1743 54.9385 42.2621 175.8028 47 G 4.1013 8.2321 105.9554 44.1617 0.0000 173.4569 48 K 4.6156 8.2036 118.6148 54.7428 34.3785 176.5214 49 S 4.3389 8.3226 115.3002 58.0646 65.0686 175.4201 50 G 4.0342 9.0124 118.3989 44.8287 0.0000 171.1922 51 F 5.0623 8.4774 112.6032 55.2331 41.1794 173.4050 52 K 4.3022 8.3492 118.6234 54.4912 35.3249 176.2522 53 R 4.5889 8.0179 120.9217 53.5879 31.8621 174.7044 54 P 4.2216 0.0000 0.0000 63.4623 31.6986 176.5525 55 Q 3.9258 9.1349 122.2531 59.2222 28.6406 179.3979 56 K 4.2646 8.0532 111.4035 57.8594 32.2681 177.0963 57 V 4.2631 7.9492 117.9412 62.8077 32.0573 174.7631 58 Q 4.5577 8.0730 118.2916 54.8222 30.0643 174.8541 59 E 4.4157 8.5037 121.9361 54.7896 31.3674 175.3161 60 E 4.4384 8.1445 122.5984 54.0363 31.8695 174.4500 61 A 3.8497 8.2778 128.8718 51.5327 19.7034 176.6070 62 A 4.5136 9.2221 125.0459 50.8362 19.9499 176.2705 63 T 5.4917 8.1764 111.0350 60.8622 71.4299 174.2034 64 I 4.5772 7.8182 121.4516 60.0528 41.8183 173.6892 65 D 5.6547 8.6108 127.7988 53.0099 42.3398 177.8151 66 V 3.6244 8.5947 115.6375 64.9174 31.6112 178.7699 67 R 3.8219 7.5925 116.8617 59.6610 29.5589 177.9431 68 E 3.9036 7.9194 117.8732 59.5758 30.0507 178.2401 69 I 3.7012 7.7861 119.3427 64.3815 36.9484 177.2845 70 D 4.3670 8.4660 118.4171 57.9759 40.8804 178.8724 71 E 4.2504 7.9462 116.6588 58.2231 29.5452 177.2996 72 N 4.9903 8.2981 115.9088 52.4075 40.1529 176.5786 73 V 3.3070 7.3243 112.6545 64.7058 31.5237 178.1449 74 T 3.8425 7.4093 108.4455 65.0680 68.3992 175.9036 75 L 4.0137 7.8868 120.8754 56.8194 42.2201 178.3092 76 L 4.3642 7.9528 119.7200 53.9143 40.1945 178.3898 77 A 4.0900 7.5324 121.1976 54.9452 19.0726 178.1902 78 A 4.5666 7.6758 118.4870 51.5138 19.1046 177.5110 79 D 4.5129 8.1971 118.5621 55.7180 45.7206 175.9113 80 D 4.1370 7.3674 122.2091 52.4383 40.2153 175.6406 81 V 4.3662 8.1363 123.4633 60.8685 31.5481 174.8776 82 A 4.4100 7.8178 129.1556 50.3627 20.7708 177.2231 83 E 3.7227 8.7455 114.1531 59.0630 29.7373 176.8472 *89 F 4.5473 7.7024 117.8236 57.5278 41.0441 173.6248 90 R 5.1775 8.7410 121.0596 54.6391 32.4458 175.0547 91 V 4.5156 8.8546 125.4165 59.9648 35.3549 174.5500 92 D 4.7463 8.7222 123.4460 52.9036 40.9361 176.5001 93 V 3.5961 8.5210 128.1809 66.4300 31.5962 178.3325 94 R 3.6040 7.6122 117.1565 59.7717 29.9032 178.0796 95 D 4.5297 8.1566 116.8387 55.9963 41.0035 178.5824 96 V 3.8882 8.2219 119.4856 64.2386 32.0317 176.6161 97 V 3.6238 7.2459 117.6471 62.8029 31.7357 175.4647 98 E 4.1885 8.6081 126.4956 56.8771 30.2632 176.8176 99 E 3.8209 8.7309 116.5859 57.3372 26.8174 175.3409 100 A 4.2482 7.4593 119.9762 53.0672 18.5272 179.0265 101 D 4.5503 7.4814 116.9366 56.2909 41.6349 178.0084 102 D 4.4439 7.9066 119.6803 55.0628 39.6455 176.7083 103 A 4.2171 7.6058 123.9564 51.9162 18.9899 177.8134 104 D 4.3511 8.5728 120.8266 54.7668 41.8174 175.8444 105 Y 5.0163 6.1199 121.1712 57.6278 41.7010 171.5264 106 V 4.7872 8.7635 121.6365 61.3491 33.7279 174.3686 107 K 4.8663 8.7934 128.8600 54.5291 35.3248 174.6112 108 V 4.5685 8.2869 127.7736 61.9257 32.9403 174.6566 109 L 4.6581 9.4550 128.8789 52.8103 44.1975 176.6690 110 G 4.2847 8.3159 109.4901 44.9540 0.0000 172.7463 111 A 4.6207 8.1247 121.2468 52.7774 21.6128 176.3806 112 G 3.6263 8.7123 107.9284 44.8533 0.0000 172.4409 113 Q 4.4090 8.2873 117.4789 54.6201 30.2061 176.2211 114 V 4.5451 7.8287 117.6966 60.4720 32.5245 175.5758 115 R 4.5489 9.2738 131.1415 55.4871 30.3814 176.0289 116 H 4.6746 7.7254 112.3255 55.1595 32.8746 173.4502 117 E 4.6887 8.8207 120.6504 55.5877 29.9552 175.7773 118 L 5.0013 8.5044 124.9020 53.2492 45.0143 176.0333 119 T 5.3880 8.9392 120.6622 61.1872 69.9372 172.3594 120 L 5.1656 8.2444 126.1328 53.1262 44.4741 175.4853 121 I 5.7006 8.8873 123.7462 59.0397 39.7940 174.6241 122 A 4.8356 8.6721 127.4317 50.6028 22.7093 175.8689 123 D 4.5827 8.6103 117.5161 56.7086 42.0459 176.5383 124 D 4.4782 6.8368 114.6138 53.4630 44.2764 174.4920 125 F 5.6260 9.1709 122.0775 54.5791 43.4943 174.2634 126 S 4.6620 8.5678 114.7556 57.2140 64.9611 174.8466 127 E 4.0759 8.9279 120.6753 59.3677 29.3354 178.9656 128 G 3.6984 8.1122 104.9144 46.9657 0.0000 175.6754 129 A 4.0707 7.8503 122.8233 55.6872 18.3725 179.2970 130 R 3.7621 8.1663 116.6437 58.8870 29.9656 178.9335 131 E 3.9002 8.2476 117.6052 59.7909 29.2671 180.2320 132 K 3.9756 7.9200 117.6895 59.5090 32.2489 179.7233 133 V 3.4610 7.9438 118.5476 65.7816 31.3042 178.0443 134 E 4.7731 8.0210 120.1840 58.6723 29.3789 179.0575 135 G 3.8510 8.2130 103.1480 46.1269 0.0000 173.4518 136 A 4.6646 7.2234 123.2242 51.5917 19.5642 176.4010 137 G 3.8561 8.4188 105.5507 48.6179 0.0000 173.8024 138 G 4.7913 7.9963 104.9498 42.9613 0.0000 172.1879 139 S 5.0411 8.9115 112.6963 56.5131 66.9479 173.2726 140 V 4.4820 8.1477 120.4035 61.1370 33.7899 174.2719 141 E 4.5690 9.4793 129.0449 54.4511 31.3621 175.0403 142 L 4.9526 8.5336 127.8342 54.8735 42.4594 176.7612 143 T 4.1269 9.1375 123.5505 63.6176 69.5776 175.2446 144 D 4.5221 8.8024 122.6088 57.3633 40.5259 178.9557 145 L 4.0015 7.8692 119.7919 58.1630 42.4323 178.9111 146 G 3.9794 7.3853 102.5920 46.0708 0.0000 173.5567 147 E 4.3782 7.9147 121.3343 57.1272 28.9831 177.0912 148 E 4.6421 7.9801 114.1801 56.4305 30.5035 178.2129 149 R 4.2643 7.6424 120.2440 52.8345 28.6566 176.3870 150 Q 4.3155 7.7789 121.6396 56.8479 29.3511 173.0756 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 1 T 8.16 4.27 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 1.20 0.00 0.00 2 S 8.39 4.38 0.00 4.05 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 3 K 9.41 4.00 0.00 1.84 1.84 0.00 1.74 0.00 0.00 1.82 0.00 0.00 2.92 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.50 1.53 7.81 4 K 8.15 3.84 0.00 1.84 1.88 0.00 1.74 0.00 0.00 1.76 0.00 0.00 2.91 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.56 1.53 7.81 5 K 7.63 3.96 0.00 1.67 2.05 0.00 1.67 0.00 0.00 1.70 0.00 0.00 3.15 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.53 7.81 6 R 7.63 4.35 0.00 1.92 1.92 0.00 3.20 0.00 0.00 3.21 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.65 0.00 7 Q 8.06 4.17 0.00 1.95 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.62 6.97 0.00 0.00 0.00 0.00 0.00 2.54 2.48 0.00 8 R 7.56 4.12 0.00 1.79 1.91 0.00 3.36 0.00 0.00 3.26 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.58 0.00 9 G 8.97 4.10 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 S 8.11 4.14 0.00 3.97 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 11 R 8.07 4.16 0.00 1.97 2.10 0.00 3.21 0.00 0.00 3.27 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.60 0.00 12 T 7.63 4.27 4.31 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 1.31 0.00 0.00 13 H 8.49 4.65 0.00 3.26 3.38 0.00 5.75 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 G 8.27 3.91 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 0.00 0.00 0.00 15 G 8.28 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 16 G 7.64 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 0.00 0.00 0.00 17 S 8.57 4.28 0.00 3.86 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 18 H 8.83 4.42 0.00 3.30 3.40 0.00 5.57 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 K 7.77 4.16 0.00 1.70 1.78 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.27 1.25 7.81 20 N 7.41 4.39 0.00 2.77 2.49 0.00 0.00 6.92 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 21 R 7.48 4.45 0.00 1.79 1.92 0.00 3.18 0.00 0.00 3.24 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.66 0.00 22 R 7.18 4.64 0.00 1.75 1.07 0.00 3.16 0.00 0.00 3.20 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.63 0.00 23 G 8.52 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 24 A 8.63 4.37 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 25 G 7.93 3.60 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 0.00 0.00 0.00 26 H 7.74 4.62 0.00 3.29 3.50 0.00 5.89 0.00 0.00 0.00 0.00 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 R 7.41 4.43 0.00 2.02 1.87 0.00 3.39 0.00 0.00 3.22 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.57 0.00 28 G 9.00 3.90 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 0.00 0.00 0.00 0.00 0.00 0.00 29 G 7.80 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 0.00 0.00 0.00 30 R 8.67 4.14 0.00 1.91 1.81 0.00 3.36 0.00 0.00 3.35 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.69 0.00 31 G 8.28 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 32 D 8.60 4.72 0.00 2.73 2.66 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 0.00 0.00 0.00 0.00 33 A 7.36 4.07 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 34 G 8.99 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 0.00 0.00 0.00 35 R 7.68 4.00 0.00 1.68 1.82 0.00 2.74 0.00 0.00 3.18 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.64 0.00 36 D 7.84 5.13 0.00 2.75 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 37 K 9.31 4.57 0.00 1.76 1.69 0.00 1.78 0.00 0.00 1.81 0.00 0.00 2.90 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.40 1.54 7.81 38 H 9.74 4.60 0.00 3.29 3.44 0.00 5.47 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 E 7.64 4.68 0.00 1.88 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 0.00 2.21 2.01 0.00 40 F 8.25 5.04 0.00 3.10 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 41 H 6.02 3.66 0.00 2.92 3.15 0.00 5.79 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 N 9.02 4.12 0.00 2.83 2.86 0.00 0.00 6.90 8.16 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 43 H 7.89 4.59 0.00 3.35 3.23 0.00 5.94 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 E 8.87 3.83 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 2.34 2.36 0.00 45 P 0.00 4.35 0.00 2.18 2.10 0.00 3.79 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.03 0.00 46 L 8.07 4.14 0.00 1.66 1.65 0.92 0.96 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 47 G 8.23 4.10 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 K 8.20 4.62 0.00 1.75 1.74 0.00 1.76 0.00 0.00 1.65 0.00 0.00 2.98 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.36 1.40 7.81 49 S 8.32 4.34 0.00 3.79 3.70 0.00 0.00 0.00 0.00 0.00 0.00 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 G 9.01 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 51 F 8.48 5.06 0.00 3.11 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 52 K 8.35 4.30 0.00 1.68 1.62 0.00 1.71 0.00 0.00 1.66 0.00 0.00 2.76 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.22 1.36 7.81 53 R 8.02 4.59 0.00 1.73 1.86 0.00 3.35 0.00 0.00 3.26 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.43 0.00 54 P 0.00 4.22 0.00 2.22 2.23 0.00 3.78 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.04 0.00 55 Q 9.13 3.93 0.00 2.12 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.79 7.10 0.00 0.00 0.00 0.00 0.00 2.44 2.38 0.00 56 K 8.05 4.26 0.00 1.86 1.91 0.00 1.52 0.00 0.00 1.63 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.41 1.43 7.81 57 V 7.95 4.26 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 0.84 0.00 0.00 0.94 0.00 0.00 58 Q 8.07 4.56 0.00 2.12 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.74 6.44 0.00 0.00 0.00 0.00 0.00 2.28 2.59 0.00 59 E 8.50 4.42 0.00 1.92 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 2.44 2.28 0.00 60 E 8.14 4.44 0.00 1.91 1.68 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 2.13 2.18 0.00 61 A 8.28 3.85 1.09 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 62 A 9.22 4.51 1.24 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 0.00 0.00 0.00 63 T 8.18 5.49 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 1.22 0.00 0.00 64 I 7.82 4.58 1.86 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 1.36 0.95 0.00 0.00 65 D 8.61 5.65 0.00 2.75 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 66 V 8.59 3.62 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 0.91 0.00 0.00 0.96 0.00 0.00 67 R 7.59 3.82 0.00 2.05 2.02 0.00 3.09 0.00 0.00 3.10 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.69 0.00 68 E 7.92 3.90 0.00 2.03 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 0.00 2.31 2.33 0.00 69 I 7.79 3.70 1.98 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.55 0.90 0.00 0.00 70 D 8.47 4.37 0.00 2.80 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 71 E 7.95 4.25 0.00 2.14 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 2.34 2.67 0.00 72 N 8.30 4.99 0.00 2.58 2.68 0.00 0.00 6.81 7.61 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 73 V 7.32 3.31 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 0.00 0.00 0.48 0.00 0.00 0.19 0.00 0.00 74 T 7.41 3.84 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 1.16 0.00 0.00 75 L 7.89 4.01 0.00 1.70 1.78 0.97 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 76 L 7.95 4.36 0.00 1.80 1.77 0.87 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 77 A 7.53 4.09 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 78 A 7.68 4.57 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 79 D 8.20 4.51 0.00 2.91 2.59 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 80 D 7.37 4.14 0.00 3.20 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 81 V 8.14 4.37 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 0.47 0.00 0.00 1.08 0.00 0.00 82 A 7.82 4.41 1.24 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 0.00 0.00 0.00 83 E 8.75 3.72 0.00 2.04 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 0.00 2.26 2.34 0.00 *89 F 7.70 4.55 0.00 3.02 3.20 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 90 R 8.74 5.18 0.00 1.82 1.81 0.00 3.22 0.00 0.00 3.42 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.57 0.00 91 V 8.85 4.52 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 0.71 0.00 0.00 0.95 0.00 0.00 92 D 8.72 4.75 0.00 2.72 2.82 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 93 V 8.52 3.60 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 0.87 0.00 0.00 1.00 0.00 0.00 94 R 7.61 3.60 0.00 1.99 2.03 0.00 3.22 0.00 0.00 3.23 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.71 0.00 95 D 8.16 4.53 0.00 2.78 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 96 V 8.22 3.89 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 0.79 0.00 0.00 0.93 0.00 0.00 97 V 7.25 3.62 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 0.84 0.00 0.00 0.98 0.00 0.00 98 E 8.61 4.19 0.00 2.06 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 2.39 2.32 0.00 99 E 8.73 3.82 0.00 2.10 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 0.00 2.18 2.27 0.00 100 A 7.46 4.25 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 0.00 101 D 7.48 4.55 0.00 2.70 2.63 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.91 4.44 0.00 2.75 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 0.00 103 A 7.61 4.22 1.31 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 0.00 0.00 104 D 8.57 4.35 0.00 2.52 2.33 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 0.00 105 Y 6.12 5.02 0.00 3.28 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 0.00 106 V 8.76 4.79 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 0.91 0.00 0.00 0.93 0.00 0.00 107 K 8.79 4.87 0.00 1.98 1.69 0.00 1.86 0.00 0.00 1.66 0.00 0.00 2.81 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.30 1.33 7.81 108 V 8.29 4.57 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 1.07 0.00 0.00 0.77 0.00 0.00 109 L 9.46 4.66 0.00 1.73 1.59 0.93 -0.25 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 0.00 110 G 8.32 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 0.00 0.00 0.00 0.00 111 A 8.12 4.62 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 0.00 112 G 8.71 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.29 4.41 0.00 2.05 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.93 6.92 0.00 0.00 0.00 0.00 0.00 2.31 2.33 0.00 114 V 7.83 4.55 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 1.10 0.00 0.00 0.95 0.00 0.00 115 R 9.27 4.55 0.00 1.68 1.83 0.00 3.25 0.00 0.00 3.21 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.58 0.00 116 H 7.73 4.67 0.00 3.26 3.33 0.00 5.69 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 E 8.82 4.69 0.00 1.91 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 2.29 2.38 0.00 118 L 8.50 5.00 0.00 1.62 1.60 1.00 0.71 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 0.00 119 T 8.94 5.39 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 1.23 0.00 0.00 120 L 8.24 5.17 0.00 1.77 1.82 1.04 0.83 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 0.00 121 I 8.89 5.70 1.94 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 1.20 1.01 0.00 0.00 122 A 8.67 4.84 0.58 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 0.00 0.00 0.00 0.00 0.00 0.00 123 D 8.61 4.58 0.00 2.68 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 D 6.84 4.48 0.00 2.39 2.13 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 0.00 125 F 9.17 5.63 0.00 2.85 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 0.00 126 S 8.57 4.66 0.00 3.93 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 0.00 127 E 8.93 4.08 0.00 2.07 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 2.39 2.39 0.00 128 G 8.11 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.85 4.07 1.57 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 0.00 130 R 8.17 3.76 0.00 2.02 1.88 0.00 3.17 0.00 0.00 3.13 7.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.51 0.00 131 E 8.25 3.90 0.00 1.98 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 2.34 2.60 0.00 132 K 7.92 3.98 0.00 1.83 1.87 0.00 1.68 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.68 7.81 133 V 7.94 3.46 2.13 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 1.01 0.00 0.00 1.04 0.00 0.00 134 E 8.02 4.77 0.00 2.01 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 2.26 2.30 0.00 135 G 8.21 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 0.00 136 A 7.22 4.66 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 0.00 137 G 8.42 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 0.00 138 G 8.00 4.79 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 0.00 0.00 0.00 139 S 8.91 5.04 0.00 3.80 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 0.00 140 V 8.15 4.48 1.64 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 -0.86 0.00 0.00 0.38 0.00 0.00 141 E 9.48 4.57 0.00 2.03 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 2.23 2.21 0.00 142 L 8.53 4.95 0.00 1.72 1.63 1.19 1.11 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 0.00 143 T 9.14 4.13 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 1.26 0.00 0.00 144 D 8.80 4.52 0.00 2.69 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 0.00 145 L 7.87 4.00 0.00 1.65 1.84 1.01 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 146 G 7.39 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 0.00 147 E 7.91 4.38 0.00 2.10 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 2.35 2.48 0.00 148 E 7.98 4.64 0.00 1.87 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 2.20 2.53 0.00 149 R 7.64 4.26 0.00 1.80 1.89 0.00 3.33 0.00 0.00 3.16 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.72 0.00 150 Q 7.78 4.32 0.00 2.02 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.65 0.00 0.00 0.00 0.00 0.00 2.09 2.12 0.00 * Residues marked with a * may have inaccurate shift predictions.