NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.4146 8.1233 123.5890 51.0294 20.7720 178.6316 3 E 3.7722 8.9321 117.6900 57.8065 30.5513 177.2603 4 K 4.1126 8.4954 120.9909 59.4717 32.6241 178.2480 5 A 4.2356 8.0471 120.7049 55.1259 18.5062 179.1632 6 L 4.0061 8.6007 118.9410 58.0280 41.5483 179.1699 7 A 4.1043 7.8887 120.9896 55.2621 18.1273 179.6970 8 T 4.4007 7.8749 108.3452 64.1273 69.3006 176.3296 9 L 4.0457 7.7989 123.1565 58.0870 40.6403 179.1244 10 K 4.0565 8.0457 118.1177 59.3936 31.7751 179.0111 11 E 4.3652 8.0767 118.3589 58.6847 29.4573 178.5378 12 L 4.5910 7.3263 116.2849 55.3320 43.4163 178.5630 13 A 3.6596 8.2808 121.3017 54.3086 18.3159 178.0040 14 F 4.8912 7.6368 112.6339 57.2407 39.2537 175.3845 15 L 4.3707 7.8274 121.8283 54.2175 42.0639 176.7145 16 E 4.1578 9.1396 125.2058 58.9176 29.8183 176.8418 17 D 4.7325 7.6046 118.4440 51.2634 41.2457 172.6307 18 P 4.5308 0.0000 0.0000 61.6548 32.6199 177.8134 19 S 4.4285 9.8422 116.8186 57.2005 65.4638 173.6270 20 P 4.1823 0.0000 0.0000 65.3763 30.8988 179.3052 21 V 3.5497 7.6225 116.7592 66.0880 31.5498 177.7062 22 E 3.9393 7.9272 117.9102 59.3212 29.2772 179.3812 23 R 3.5806 7.8675 118.5423 59.5487 30.1817 178.2804 24 D 4.3841 8.1210 118.3903 57.3761 40.7925 178.7227 25 A 4.0424 8.2552 121.0884 55.1217 18.3440 179.5815 26 A 4.0209 8.2991 119.5492 55.2615 18.4288 180.0191 27 I 3.8225 7.8587 118.5764 64.4719 37.3015 178.3541 28 Q 3.9887 8.2204 120.4317 59.4151 28.9442 178.6692 29 R 2.5207 8.0304 119.0380 58.5741 29.9787 178.7416 30 F 4.2140 8.3145 120.6420 61.3149 39.3479 176.7258 31 E 3.5559 7.9718 118.3483 59.7309 29.4797 179.0828 32 Y 4.3734 7.7364 116.6440 59.9981 38.0302 178.1536 33 T 4.1300 7.8609 118.3668 66.2829 68.4909 176.4936 34 F 4.1509 8.5088 123.0437 61.4286 39.3026 176.9282 35 E 4.2462 8.5353 117.9679 59.6913 29.4477 179.4011 36 A 3.9257 8.0282 120.1650 54.7109 18.4137 179.5964 37 F 4.0585 8.4310 119.9486 61.2894 39.5708 177.5763 38 W 3.8987 8.2139 116.4745 59.1424 27.8718 178.4477 39 K 3.1592 6.9680 119.3115 58.8562 31.3198 179.1380 40 A 3.8800 7.5544 120.8038 54.9108 18.2440 179.7207 41 L 3.7830 7.4049 117.4453 57.7694 41.6764 179.3331 42 Q 3.9480 8.3225 119.6810 59.3413 28.9124 178.4406 43 A 3.9526 7.9633 121.6149 55.1485 18.3392 179.0122 44 Y 3.8857 8.1514 118.0502 60.9121 38.9651 178.2094 45 L 4.0286 8.4910 120.3758 57.6367 41.5252 179.5488 46 R 4.0073 7.9422 119.9124 59.1180 29.9140 178.5524 47 E 3.8950 8.1936 117.3813 58.9811 29.6056 178.8382 48 K 4.0715 7.9121 117.0562 57.1572 32.5826 177.3686 49 E 4.3446 7.9523 116.3417 55.3574 31.5832 176.8553 50 G 3.8312 7.8610 105.8605 45.7394 0.0000 172.6470 51 L 4.6180 7.8610 119.6796 52.5647 43.2974 175.3815 52 E 4.5712 8.7909 122.8725 54.4148 31.2621 175.5828 53 G 4.1905 8.6132 112.0240 43.7373 0.0000 172.0959 54 A 4.4726 8.7982 125.6847 53.1873 20.1709 178.0121 55 S 4.4946 7.5210 109.3800 55.5987 66.9649 173.1527 56 P 3.5134 0.0000 0.0000 65.7095 30.9635 179.1467 57 K 4.0954 7.8146 116.6313 59.3141 32.0352 179.5909 58 G 3.5937 7.8380 106.1272 47.7038 0.0000 176.0234 59 V 3.6936 8.1429 120.9953 65.8047 31.4755 178.2457 60 I 3.7977 7.9014 119.6237 64.4406 36.9639 178.5966 61 R 3.9513 8.1029 118.9141 59.2777 29.8972 179.1912 62 L 4.0310 8.1301 118.5948 57.6344 41.6824 179.2274 63 A 4.0620 8.5761 121.2038 55.1000 18.2520 179.7347 64 R 4.1922 8.6475 119.0452 59.1616 30.0529 178.6504 65 E 4.0473 8.0930 116.2447 59.2155 29.6051 178.8164 66 V 3.8944 7.7840 118.2360 62.5413 31.7828 177.0975 67 G 4.0565 8.1236 108.7337 45.1416 0.0000 175.4289 68 L 3.8596 7.6342 119.0399 56.7574 41.9274 177.3986 69 L 4.9654 7.5014 118.3842 52.0955 44.9600 176.6434 70 R 4.2060 9.6956 123.2546 55.6533 32.1073 177.4254 71 D 4.4268 8.6951 120.4569 57.8958 40.7878 179.0590 72 E 3.9619 8.1374 118.9846 59.2489 29.6544 178.5347 73 E 3.9583 8.1970 117.9184 59.2715 29.5432 178.6670 74 A 4.0513 8.4084 121.2182 55.6263 18.4271 179.8907 75 R 3.8864 8.1380 116.1930 59.4109 29.9103 179.1386 76 L 4.0769 7.8829 118.9721 57.9115 42.1105 178.6489 77 A 4.1760 8.1464 120.5653 55.2594 18.7638 179.4129 78 L 4.2680 8.4184 117.8966 57.3722 41.6254 179.2568 79 G 4.1663 7.9926 106.3391 44.9348 0.0000 175.9095 *81 V 3.7743 7.8022 121.8485 62.5814 33.7805 177.0169 82 D 4.3471 7.9175 119.0076 57.5034 40.5743 178.5293 83 D 4.4360 8.3992 119.5656 57.2150 40.9125 178.7789 84 R 3.8707 7.5507 119.6535 59.0647 29.7315 178.1998 85 S 4.3752 7.6757 111.8810 59.8096 63.5465 175.1837 86 L 4.5838 7.7570 122.2629 55.1970 41.9895 178.2016 87 T 3.8968 7.5728 109.1157 64.4807 68.6775 176.1686 88 V 3.8836 7.7371 119.0552 63.1002 32.1435 176.0061 89 H 4.9727 8.4085 118.5480 56.1115 29.0149 174.4358 90 T 4.4417 7.5643 108.8291 62.3728 68.6007 175.4144 91 Y 4.2998 7.8139 125.1212 60.5474 39.2534 175.6268 92 N 4.2955 7.9211 118.2058 52.1157 39.7021 175.0635 93 E 3.8488 8.6408 125.9515 59.6989 29.5996 177.0538 94 P 4.1278 0.0000 0.0000 65.7022 31.2267 177.7601 95 L 3.8217 7.9056 117.6077 58.5831 42.0394 178.8922 96 A 4.0141 8.1756 120.1939 55.7206 18.3808 179.9464 97 R 3.9076 8.5766 116.2668 59.2627 29.8779 179.2102 98 A 3.9985 8.2407 120.2204 55.0770 18.5970 179.5364 99 I 3.7159 8.5293 118.9090 64.5192 37.0747 178.3103 100 F 3.8988 8.3167 121.4688 61.4528 38.8729 177.3565 101 R 3.7685 7.7990 116.4398 58.4937 30.1565 178.3524 102 R 3.8086 7.6199 117.2086 57.1693 30.3578 178.3075 103 L 3.5242 6.6695 119.3643 57.1607 41.4709 177.3640 104 P 3.8675 0.0000 0.0000 65.8547 31.2745 178.2315 105 D 4.3324 7.6933 116.6503 57.5495 40.5655 178.2712 106 Y 4.3633 7.1347 115.3367 61.0855 37.9559 178.2297 107 A 4.1693 8.1960 120.6745 55.3117 18.7008 179.6573 108 R 4.1344 8.0669 116.4138 59.2785 30.0791 179.3235 109 L 4.0559 8.0857 117.2839 56.3671 42.2021 177.8866 *111 E 4.2745 8.0779 119.5883 56.0801 31.3988 177.9043 112 Q 4.0506 8.3648 117.9288 58.7681 28.4556 178.8448 113 V 3.6316 7.9856 118.7223 66.0829 32.0362 177.5829 114 L 4.2345 8.2905 118.4384 57.9134 41.4439 179.2704 115 G 3.7155 7.9586 104.9489 48.2940 0.0000 175.6758 116 R 3.9986 7.6105 120.4831 58.6016 30.4596 178.5427 117 L 3.7422 7.4772 115.9618 55.5151 41.0832 179.1854 118 R 4.0767 7.4483 115.4150 57.0525 29.5162 176.7240 119 R 4.3113 8.3221 125.0689 56.6842 32.1079 174.6691 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 2 A 8.12 4.41 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 3 E 8.93 3.77 0.00 2.04 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 0.00 2.36 2.53 0.00 4 K 8.50 4.11 0.00 1.81 1.84 0.00 1.77 0.00 0.00 1.87 0.00 0.00 3.03 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.54 1.47 7.81 5 A 8.05 4.24 1.63 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 6 L 8.60 4.01 0.00 1.89 1.91 1.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 7 A 7.89 4.10 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 8 T 7.87 4.40 4.39 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 1.33 0.00 0.00 9 L 7.80 4.05 0.00 1.69 1.89 0.89 1.04 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 10 K 8.05 4.06 0.00 2.14 2.20 0.00 1.99 0.00 0.00 1.94 0.00 0.00 3.16 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.71 1.80 7.81 11 E 8.08 4.37 0.00 2.26 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 2.40 2.68 0.00 12 L 7.33 4.59 0.00 1.73 1.77 0.99 1.02 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 13 A 8.28 3.66 0.63 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 14 F 7.64 4.89 0.00 3.10 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 L 7.83 4.37 0.00 2.00 1.70 0.96 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 16 E 9.14 4.16 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 2.32 2.34 0.00 17 D 7.60 4.73 0.00 2.62 2.50 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 0.00 0.00 0.00 18 P 0.00 4.53 0.00 1.77 1.65 0.00 3.65 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.44 0.00 19 S 9.84 4.43 0.00 3.88 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 20 P 0.00 4.18 0.00 2.15 2.11 0.00 3.56 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.08 0.00 21 V 7.62 3.55 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 1.07 0.00 0.00 0.93 0.00 0.00 22 E 7.93 3.94 0.00 1.98 1.95 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 2.32 2.29 0.00 23 R 7.87 3.58 0.00 1.61 1.92 0.00 2.99 0.00 0.00 3.06 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.27 0.00 24 D 8.12 4.38 0.00 2.92 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 25 A 8.26 4.04 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 26 A 8.30 4.02 1.59 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 0.00 0.00 27 I 7.86 3.82 2.12 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 1.49 0.84 1.02 0.00 0.00 28 Q 8.22 3.99 0.00 2.23 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.81 0.00 0.00 0.00 0.00 0.00 2.48 2.60 0.00 29 R 8.03 2.52 0.00 1.77 1.64 0.00 3.21 0.00 0.00 3.17 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.79 0.00 30 F 8.31 4.21 0.00 3.06 3.32 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 31 E 7.97 3.56 0.00 2.30 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 2.24 2.58 0.00 32 Y 7.74 4.37 0.00 3.16 3.24 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 33 T 7.86 4.13 4.41 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 1.29 0.00 0.00 34 F 8.51 4.15 0.00 2.46 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 35 E 8.54 4.25 0.00 2.16 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 0.00 2.86 2.66 0.00 36 A 8.03 3.93 1.46 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 37 F 8.43 4.06 0.00 3.23 3.21 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 0.00 38 W 8.21 3.90 0.00 3.36 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 39 K 6.97 3.16 0.00 1.49 1.47 0.00 1.03 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.72 0.00 0.00 0.00 0.00 0.34 1.06 7.81 40 A 7.55 3.88 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 41 L 7.40 3.78 0.00 1.62 1.61 0.69 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 42 Q 8.32 3.95 0.00 2.21 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.33 2.58 0.00 43 A 7.96 3.95 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 44 Y 8.15 3.89 0.00 3.13 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 45 L 8.49 4.03 0.00 1.92 1.85 1.02 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 46 R 7.94 4.01 0.00 1.97 2.05 0.00 3.11 0.00 0.00 3.23 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.79 0.00 47 E 8.19 3.90 0.00 1.88 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 2.29 2.40 0.00 48 K 7.91 4.07 0.00 0.86 1.43 0.00 1.50 0.00 0.00 1.52 0.00 0.00 2.97 0.00 0.00 3.13 0.00 0.00 0.00 0.00 0.86 0.21 7.81 49 E 7.95 4.34 0.00 2.05 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 2.08 2.23 0.00 50 G 7.86 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 51 L 7.86 4.62 0.00 1.72 1.58 0.93 0.65 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 52 E 8.79 4.57 0.00 1.94 1.87 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 2.21 2.21 0.00 53 G 8.61 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 0.00 0.00 0.00 0.00 54 A 8.80 4.47 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 55 S 7.52 4.49 0.00 3.82 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 56 P 0.00 3.51 0.00 1.86 1.60 0.00 3.08 0.00 0.00 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.44 0.00 57 K 7.81 4.10 0.00 1.73 1.82 0.00 1.63 0.00 0.00 1.80 0.00 0.00 2.97 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.52 1.46 7.81 58 G 7.84 3.59 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 0.00 0.00 0.00 59 V 8.14 3.69 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 1.04 0.00 0.00 1.18 0.00 0.00 60 I 7.90 3.80 2.03 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.69 0.96 0.00 0.00 61 R 8.10 3.95 0.00 1.98 1.99 0.00 3.29 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.89 0.00 62 L 8.13 4.03 0.00 1.87 1.74 0.98 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 63 A 8.58 4.06 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 64 R 8.65 4.19 0.00 1.90 2.16 0.00 3.39 0.00 0.00 3.34 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.56 0.00 65 E 8.09 4.05 0.00 2.19 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 2.54 2.36 0.00 66 V 7.78 3.89 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 0.84 0.00 0.00 0.96 0.00 0.00 67 G 8.12 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 0.00 0.00 0.00 0.00 68 L 7.63 3.86 0.00 1.88 1.76 1.07 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 69 L 7.50 4.97 0.00 1.52 1.56 1.06 0.95 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 70 R 9.70 4.21 0.00 1.81 1.87 0.00 3.33 0.00 0.00 3.19 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.83 0.00 71 D 8.70 4.43 0.00 2.73 2.75 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 72 E 8.14 3.96 0.00 2.05 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 2.40 2.42 0.00 73 E 8.20 3.96 0.00 2.24 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 2.43 2.41 0.00 74 A 8.41 4.05 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 75 R 8.14 3.89 0.00 2.01 2.02 0.00 3.32 0.00 0.00 3.12 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.81 0.00 76 L 7.88 4.08 0.00 1.92 1.92 1.06 1.37 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 77 A 8.15 4.18 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 8.42 4.27 0.00 1.86 1.75 0.94 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 79 G 7.99 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 0.00 0.00 0.00 *81 V 7.80 3.77 2.24 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 0.95 0.00 0.00 1.22 0.00 0.00 82 D 7.92 4.35 0.00 2.88 2.70 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 83 D 8.40 4.44 0.00 2.77 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 84 R 7.55 3.87 0.00 0.85 1.60 0.00 2.75 0.00 0.00 2.36 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 1.36 0.00 85 S 7.68 4.38 0.00 4.10 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 86 L 7.76 4.58 0.00 1.91 1.77 0.93 0.54 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 87 T 7.57 3.90 4.37 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 1.45 0.00 0.00 88 V 7.74 3.88 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 0.53 0.00 0.00 0.87 0.00 0.00 89 H 8.41 4.97 0.00 3.37 3.33 0.00 5.80 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 T 7.56 4.44 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 1.29 0.00 0.00 91 Y 7.81 4.30 0.00 2.97 3.10 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 92 N 7.92 4.30 0.00 2.70 2.62 0.00 0.00 7.14 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 93 E 8.64 3.85 0.00 1.90 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 2.32 2.30 0.00 94 P 0.00 4.13 0.00 2.11 2.02 0.00 3.52 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 2.06 2.11 0.00 95 L 7.91 3.82 0.00 1.69 1.69 1.04 1.04 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 96 A 8.18 4.01 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 97 R 8.58 3.91 0.00 2.03 1.99 0.00 3.17 0.00 0.00 3.14 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.70 0.00 98 A 8.24 4.00 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 99 I 8.53 3.72 2.00 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 1.63 0.85 0.80 0.00 0.00 100 F 8.32 3.90 0.00 3.19 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 0.00 101 R 7.80 3.77 0.00 1.91 1.88 0.00 3.18 0.00 0.00 3.22 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 2.02 0.00 102 R 7.62 3.81 0.00 1.35 0.90 0.00 3.08 0.00 0.00 3.23 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.43 0.00 103 L 6.67 3.52 0.00 1.07 1.33 0.87 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 104 P 0.00 3.87 0.00 2.02 2.18 0.00 3.32 0.00 0.00 3.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 2.04 0.00 105 D 7.69 4.33 0.00 2.61 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 0.00 106 Y 7.13 4.36 0.00 2.96 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 0.00 107 A 8.20 4.17 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 0.00 108 R 8.07 4.13 0.00 2.07 2.03 0.00 3.19 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 2.05 0.00 109 L 8.09 4.06 0.00 1.90 1.78 0.94 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 *111 E 8.08 4.27 0.00 2.24 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.39 0.00 112 Q 8.36 4.05 0.00 2.30 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.59 0.00 0.00 0.00 0.00 0.00 2.39 2.49 0.00 113 V 7.99 3.63 2.48 0.00 0.00 0.00 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 1.11 0.00 0.00 114 L 8.29 4.23 0.00 1.81 1.77 1.08 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 115 G 7.96 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 0.00 116 R 7.61 4.00 0.00 1.78 1.99 0.00 3.17 0.00 0.00 3.23 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.90 0.00 117 L 7.48 3.74 0.00 1.69 1.36 0.66 0.22 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 0.00 118 R 7.45 4.08 0.00 1.83 1.97 0.00 3.15 0.00 0.00 3.16 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.86 0.00 119 R 8.32 4.31 0.00 1.82 2.17 0.00 3.37 0.00 0.00 3.29 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.48 0.00 * Residues marked with a * may have inaccurate shift predictions.