NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 G 3.6526 8.3544 109.7400 45.3065 0.0000 173.9050 *2 N 4.3996 7.8952 120.1374 53.1761 37.6034 173.6089 3 Q 4.2031 8.5094 124.3303 55.9528 29.3347 176.9329 4 S 3.9661 8.2422 113.0750 59.4921 60.8025 171.9067 5 I 4.1657 7.2196 122.0999 61.0658 37.2997 175.6641 6 I 4.4640 8.5018 128.9786 59.4589 39.7020 175.0392 7 F 4.9121 8.9015 125.7451 56.6105 39.4525 175.6301 8 T 4.2714 8.6827 114.1556 60.3064 69.5594 174.7696 9 E 3.7271 8.2055 119.8958 57.8091 27.0105 174.4144 10 Q 4.3223 7.8242 118.7353 55.1805 29.6340 175.0641 11 L 5.0502 8.3593 124.9843 53.0368 43.6258 176.2511 12 T 4.7973 8.7092 113.3828 59.7428 72.9832 172.3971 13 W 4.9647 8.8368 132.3613 56.5358 32.2470 174.9358 14 D 4.7201 8.1762 127.6934 52.5630 41.2281 177.2590 15 V 3.9081 8.5317 120.5750 64.1175 32.0656 177.9605 16 Q 4.0621 8.1851 120.7604 58.3411 28.8842 176.6354 17 L 4.2543 7.8460 114.4924 53.7662 43.3999 176.0298 18 S 3.5776 7.6739 114.6497 58.9377 60.6961 170.9328 19 A 4.5748 5.8000 120.4834 49.9638 23.6111 176.7239 20 I 4.3073 8.3682 121.4633 61.4686 38.6283 174.5528 21 H 5.0471 9.4938 128.0233 54.5175 31.3994 173.6491 22 F 5.7306 9.0641 120.4075 54.0111 41.9559 173.5368 23 T 4.9391 8.5547 108.8327 59.8748 71.6463 172.6917 24 A 4.8876 8.6864 125.4179 50.2519 22.9603 174.5637 25 Q 4.7005 8.7068 119.3224 54.7253 33.1256 173.3919 26 Q 4.6300 8.2791 125.6340 54.8538 31.8679 174.8301 27 Q 3.1530 9.8579 126.8932 57.0884 26.9735 173.8951 28 G 3.4604 7.7338 100.0133 45.7352 0.0000 173.5674 *30 V 3.9934 7.1427 115.6966 62.7375 33.3702 175.4528 31 I 4.5199 8.5375 128.1331 59.4569 39.8554 174.5289 32 D 4.5729 8.7334 128.1251 54.2320 41.9084 175.4705 33 C 5.0467 8.3528 120.9808 58.0031 31.9503 172.6980 34 Y 5.2470 8.6884 118.1005 56.4184 42.5856 174.0927 35 I 4.8439 9.0161 123.1969 58.9847 41.0561 175.3947 36 G 4.0209 8.8021 118.3623 45.1245 0.0000 173.4541 37 Q 4.2339 8.9992 122.1717 59.5411 28.9185 179.7273 38 K 4.1400 8.0942 118.6077 59.3143 32.0467 179.3705 39 V 3.6099 7.7893 118.1302 66.0152 31.5180 177.7372 40 L 3.9067 8.0843 120.0379 58.0159 41.9239 178.7163 41 E 4.5441 8.4802 120.3188 59.2832 29.2971 179.0275 42 H 4.1708 8.3097 116.3010 58.7555 28.5608 177.5527 43 L 3.6998 7.7948 120.6681 58.0534 42.0049 178.5017 44 A 4.1144 7.8768 117.8537 51.8599 19.1495 176.7108 45 A 3.7253 7.5388 119.2094 52.2730 17.0372 177.0965 46 E 4.6745 8.1017 119.7573 55.6231 33.3677 174.0824 47 K 4.5747 8.5205 125.3978 55.9400 33.1474 176.2249 48 I 4.4905 8.8084 124.7631 60.1860 38.0699 175.4594 49 N 4.9499 9.6795 120.6167 51.4425 38.6864 174.1936 50 N 4.7980 7.6438 116.5968 51.3647 43.2195 175.0119 51 S 3.7453 8.4844 122.2211 61.1657 62.9642 176.4399 52 E 3.8843 8.7563 123.6834 59.1536 29.3114 178.4300 53 Q 3.9103 8.0105 118.9004 59.0561 29.1750 177.7489 54 A 4.0379 7.9675 121.7813 55.3833 18.3358 179.4531 55 L 4.0509 8.0333 118.6684 58.3064 42.0840 179.0197 56 S 4.1284 8.3852 113.3283 61.3468 62.3480 176.2341 57 L 4.1009 8.4199 122.0998 57.6277 41.4417 178.9176 58 F 3.9620 8.4105 120.6648 61.6086 39.3898 177.0487 59 E 4.0583 8.6488 118.1212 59.5011 29.0273 179.0748 60 Q 3.8700 8.1676 118.7544 58.2050 29.1296 177.0826 61 F 4.6933 7.4837 116.2320 57.0299 39.9576 177.0694 62 R 2.8550 7.4169 124.1627 58.8041 29.6091 178.6161 63 F 3.9241 7.9043 116.5554 60.2005 39.0722 177.4381 64 D 4.3580 8.0176 118.3520 57.2725 40.6832 178.6755 65 I 3.5782 7.7049 120.4620 64.5070 37.0713 178.4815 66 E 3.5151 8.0255 119.7297 58.8246 29.0134 178.9606 67 E 3.8807 8.0641 119.5842 59.3983 29.6263 178.7736 68 Q 3.9449 7.9550 118.8312 59.0988 29.0450 177.9183 69 A 4.0684 8.2707 121.9592 55.1709 18.4066 179.1774 70 E 4.0790 8.8211 118.3205 59.3213 29.7313 179.0131 71 K 3.9566 8.1325 119.6554 59.5336 32.2285 178.7386 72 L 3.9636 8.1577 119.4177 57.8202 41.5371 179.5761 73 I 3.4201 7.9462 119.8267 64.5092 36.8685 178.3559 74 E 4.0904 8.2020 118.0285 59.2439 29.3631 178.5759 75 Q 4.2964 8.0880 115.2067 55.1410 29.1348 175.5203 76 E 4.0821 8.0920 118.3023 57.6277 27.9978 174.8716 77 A 4.4615 7.9552 119.4284 51.4640 18.1566 178.6805 78 F 4.4809 7.8602 120.3557 56.7068 40.7832 176.4471 79 D 4.7710 8.8555 124.4623 52.2151 40.8064 177.4416 80 V 3.8501 8.2484 110.5731 63.0637 31.3195 176.9506 81 Q 4.3540 8.2083 117.7856 55.3422 29.0706 176.1458 82 G 3.8915 8.3906 105.5082 46.1492 0.0000 173.3843 83 H 5.2404 8.4735 117.1340 54.3419 31.9548 173.7346 84 I 4.5736 8.5891 120.3648 59.7767 39.4238 174.9699 85 Q 4.9584 8.6534 126.3928 54.1106 30.4781 175.5437 86 V 3.9960 8.8958 126.2753 62.4911 31.2704 175.4002 87 E 4.5733 8.9530 127.3669 56.8046 31.1238 176.7475 88 R 4.6440 7.6312 116.3963 54.5214 34.1345 174.4408 89 V 4.2537 7.7415 121.0266 62.0191 34.5085 174.7346 90 D 4.7661 8.8565 125.4584 54.9924 40.7221 173.4980 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 0 G 8.35 3.65 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *2 N 7.90 4.40 0.00 2.72 2.85 0.00 0.00 6.99 7.08 0.00 0.00 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 Q 8.51 4.20 0.00 2.16 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.52 6.14 0.00 0.00 0.00 0.00 0.00 2.46 2.35 0.00 4 S 8.24 3.97 0.00 4.03 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 5 I 7.22 4.17 1.90 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 1.21 0.48 0.63 0.00 0.00 6 I 8.50 4.46 1.81 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.95 0.93 0.00 0.00 7 F 8.90 4.91 0.00 3.02 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 T 8.68 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 1.24 0.00 0.00 9 E 8.21 3.73 0.00 2.18 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 2.44 2.32 0.00 10 Q 7.82 4.32 0.00 1.94 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.64 6.76 0.00 0.00 0.00 0.00 0.00 2.32 2.32 0.00 11 L 8.36 5.05 0.00 1.39 1.29 0.91 0.39 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 12 T 8.71 4.80 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 13 W 8.84 4.96 0.00 3.43 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 14 D 8.18 4.72 0.00 2.74 2.45 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.53 3.91 2.21 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 1.01 0.00 0.00 1.00 0.00 0.00 16 Q 8.19 4.06 0.00 1.98 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.73 0.00 0.00 0.00 0.00 0.00 2.29 2.30 0.00 17 L 7.85 4.25 0.00 1.39 1.45 0.17 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 18 S 7.67 3.58 0.00 4.05 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 19 A 5.80 4.57 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 I 8.37 4.31 2.02 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 1.53 1.15 0.66 0.00 0.00 21 H 9.49 5.05 0.00 3.13 3.20 0.00 5.54 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 22 F 9.06 5.73 0.00 2.90 2.52 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 0.00 0.00 0.00 0.00 23 T 8.55 4.94 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 1.06 0.00 0.00 24 A 8.69 4.89 0.72 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 25 Q 8.71 4.70 0.00 1.99 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.71 0.00 0.00 0.00 0.00 0.00 2.21 2.26 0.00 26 Q 8.28 4.63 0.00 2.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.50 0.00 0.00 0.00 0.00 0.00 2.35 2.31 0.00 27 Q 9.86 3.15 0.00 2.16 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.08 0.00 0.00 0.00 0.00 0.00 2.28 2.33 0.00 28 G 7.73 3.46 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 0.00 *30 V 7.14 3.99 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 0.78 0.00 0.00 0.95 0.00 0.00 31 I 8.54 4.52 1.83 0.00 0.00 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 1.40 0.66 1.01 0.00 0.00 32 D 8.73 4.57 0.00 2.57 2.26 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 33 C 8.35 5.05 0.00 1.23 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 0.00 0.00 0.00 34 Y 8.69 5.25 0.00 3.00 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 35 I 9.02 4.84 2.13 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.58 1.16 0.00 0.00 36 G 8.80 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 37 Q 9.00 4.23 0.00 2.66 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.75 0.00 0.00 0.00 0.00 0.00 2.51 2.72 0.00 38 K 8.09 4.14 0.00 1.88 1.87 0.00 1.76 0.00 0.00 1.77 0.00 0.00 2.92 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.54 1.54 7.81 39 V 7.79 3.61 2.25 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 1.11 0.00 0.00 1.01 0.00 0.00 40 L 8.08 3.91 0.00 2.02 1.92 0.95 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 41 E 8.48 4.54 0.00 2.11 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 2.51 2.46 0.00 42 H 8.31 4.17 0.00 3.28 3.28 0.00 5.63 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 L 7.79 3.70 0.00 1.49 1.62 0.68 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 44 A 7.88 4.11 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.54 3.73 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.10 4.67 0.00 2.01 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 2.22 2.29 0.00 47 K 8.52 4.57 0.00 1.78 1.71 0.00 1.78 0.00 0.00 1.70 0.00 0.00 2.77 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.41 1.45 7.81 48 I 8.81 4.49 1.99 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.55 0.70 0.00 0.00 49 N 9.68 4.95 0.00 2.65 2.80 0.00 0.00 6.75 8.23 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 50 N 7.64 4.80 0.00 2.65 2.56 0.00 0.00 6.89 7.63 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 51 S 8.48 3.75 0.00 3.91 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 E 8.76 3.88 0.00 2.01 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 2.30 2.31 0.00 53 Q 8.01 3.91 0.00 2.13 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.64 0.00 0.00 0.00 0.00 0.00 2.43 2.43 0.00 54 A 7.97 4.04 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 55 L 8.03 4.05 0.00 1.84 1.86 0.95 0.74 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 56 S 8.39 4.13 0.00 4.01 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 57 L 8.42 4.10 0.00 1.99 1.86 0.98 1.27 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 58 F 8.41 3.96 0.00 3.16 3.28 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 59 E 8.65 4.06 0.00 2.22 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 2.68 2.55 0.00 60 Q 8.17 3.87 0.00 2.01 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 7.27 0.00 0.00 0.00 0.00 0.00 1.18 2.01 0.00 61 F 7.48 4.69 0.00 2.90 2.80 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 0.00 0.00 0.00 62 R 7.42 2.85 0.00 1.53 1.56 0.00 3.07 0.00 0.00 2.81 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 1.03 0.00 63 F 7.90 3.92 0.00 3.07 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 64 D 8.02 4.36 0.00 2.90 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 65 I 7.70 3.58 1.31 0.00 0.00 0.51 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 0.49 0.59 0.00 0.00 66 E 8.03 3.52 0.00 1.37 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 1.84 1.86 0.00 67 E 8.06 3.88 0.00 2.17 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.34 0.00 68 Q 7.95 3.94 0.00 2.24 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.55 2.45 0.00 69 A 8.27 4.07 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 0.00 0.00 0.00 0.00 0.00 70 E 8.82 4.08 0.00 2.41 2.21 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 2.51 2.72 0.00 71 K 8.13 3.96 0.00 1.91 1.98 0.00 1.71 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.45 1.50 7.81 72 L 8.16 3.96 0.00 1.84 1.59 0.93 0.93 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 73 I 7.95 3.42 2.03 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 0.90 1.02 0.00 0.00 74 E 8.20 4.09 0.00 2.11 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 2.69 0.00 75 Q 8.09 4.30 0.00 2.22 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.80 0.00 0.00 0.00 0.00 0.00 2.39 2.53 0.00 76 E 8.09 4.08 0.00 2.23 2.21 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 2.38 2.32 0.00 77 A 7.96 4.46 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 78 F 7.86 4.48 0.00 3.05 3.02 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 79 D 8.86 4.77 0.00 2.88 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 80 V 8.25 3.85 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 0.72 0.00 0.00 0.91 0.00 0.00 81 Q 8.21 4.35 0.00 1.80 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.18 0.00 0.00 0.00 0.00 0.00 2.19 2.25 0.00 82 G 8.39 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 83 H 8.47 5.24 0.00 3.51 3.52 0.00 5.59 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 I 8.59 4.57 1.72 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.73 0.84 0.00 0.00 85 Q 8.65 4.96 0.00 1.93 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.99 0.00 0.00 0.00 0.00 0.00 2.36 2.26 0.00 86 V 8.90 4.00 2.26 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 0.79 0.00 0.00 1.15 0.00 0.00 87 E 8.95 4.57 0.00 1.99 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 2.24 2.49 0.00 88 R 7.63 4.64 0.00 1.99 1.76 0.00 3.26 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 1.53 1.18 0.00 89 V 7.74 4.25 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 0.83 0.00 0.00 0.89 0.00 0.00 90 D 8.86 4.77 0.00 2.84 2.64 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 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.