NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 K 4.2905 8.3149 121.7957 56.1194 34.4397 176.3978 5 T 4.2476 7.7653 115.5179 62.0465 70.9013 174.1898 6 F 4.2182 9.7462 126.7432 61.9444 39.3904 177.2645 7 E 4.1721 8.4631 117.4615 59.2993 29.1539 179.1315 8 E 4.0496 8.0585 118.3624 59.4375 29.8101 179.1063 9 L 4.0264 7.9477 118.9663 57.5488 41.6743 179.3990 10 F 4.1516 8.0448 120.4808 61.5847 38.8169 177.4444 11 T 3.7708 7.7370 114.6620 66.2146 68.0571 176.7196 12 E 3.9709 7.7787 121.1151 59.3881 29.3244 179.3054 13 L 3.9972 7.6679 118.5516 57.7278 41.3903 179.5213 14 Q 3.7523 7.3707 117.2261 58.9952 28.8312 178.0395 15 H 4.3391 7.8324 118.5829 59.0753 29.7705 177.3746 16 K 4.0374 7.7452 118.1916 58.2619 31.8580 178.0826 17 A 4.3540 7.5594 119.9618 52.2205 18.8821 178.4587 18 A 4.0216 7.7210 120.1965 53.8756 19.7653 177.6086 19 N 4.8801 6.8287 112.5304 53.5987 38.4858 175.8945 *24 T 4.3244 8.2173 122.8359 64.6361 70.2693 176.0396 25 S 4.2785 7.9828 115.6349 59.2821 63.4603 175.4218 26 R 4.1787 8.6181 119.7219 56.6905 30.8264 177.0591 27 T 4.2148 8.4625 117.1342 62.8912 70.5360 174.6563 28 A 3.9089 7.6032 127.7268 52.3362 17.6842 177.8402 29 E 4.6041 8.4691 125.1209 56.0796 28.7669 177.2689 30 L 4.1502 7.6829 121.4964 57.0188 42.1616 178.7348 31 V 3.5483 7.8118 117.3902 65.9019 31.3453 177.1054 32 D 4.4446 7.4838 116.5369 57.2543 41.2172 178.0914 33 K 4.1426 7.8480 117.5199 57.6622 32.6722 176.6255 34 G 3.8206 8.4398 104.3915 44.1162 0.0000 174.1737 35 V 3.5604 8.5703 116.6784 66.3694 31.1990 177.1413 36 H 4.0060 8.3305 116.9968 59.4719 29.6017 176.8306 37 A 4.0383 8.0057 121.8369 55.2656 18.2194 179.5441 38 I 3.9443 7.8276 118.0970 64.2799 37.1848 178.8683 39 G 3.5736 8.6277 107.1219 47.6191 0.0000 175.7799 40 K 3.9227 7.9499 120.8773 59.2435 32.0255 179.5541 41 K 3.8819 7.6327 117.1500 59.3531 31.9604 179.4986 42 V 3.5933 7.8992 118.5985 66.1269 31.3043 178.2844 43 V 3.6396 7.8732 118.1340 65.9249 31.3763 177.8421 44 E 4.0272 8.4638 117.6199 59.4057 29.5454 178.9714 45 E 4.0523 8.7351 119.8092 58.8262 29.4253 179.0817 46 A 4.0093 8.1630 120.8368 55.2583 18.3028 179.5585 47 A 4.1612 7.6232 117.9830 55.3947 18.4757 179.4474 48 E 4.1042 8.0312 116.5132 59.3650 29.7553 179.2517 49 V 3.8787 8.3736 118.7685 65.7863 31.5732 178.5800 50 W 4.4907 8.3189 123.9803 58.5099 30.2671 176.9956 *52 A 4.3023 7.9752 121.9145 51.7529 19.9094 179.6364 53 A 4.0430 8.4220 118.0258 55.2346 18.7812 178.6257 54 E 4.0183 8.4060 115.9275 58.9156 29.8279 176.9962 55 Y 4.4524 7.8998 113.2290 58.2587 39.3209 175.2554 56 E 4.5522 8.0847 118.8643 54.4527 31.9125 175.7428 57 G 3.9749 8.1683 106.6524 43.9732 0.0000 174.6391 58 K 3.9954 8.4617 118.8168 59.5097 31.9785 179.1875 59 D 4.3210 8.0878 117.5732 57.2644 41.2659 177.9402 60 A 4.0221 8.0205 120.6528 55.1184 18.3910 179.3232 61 A 3.9946 8.1568 119.1633 55.2673 18.4833 179.7804 62 A 3.9741 8.2233 119.3651 55.0158 18.4564 179.5935 63 E 3.9152 8.3450 118.0826 59.5867 29.7717 178.9134 64 E 4.0671 8.2846 118.6748 59.4495 29.3863 179.4613 65 I 3.8305 8.1241 120.4002 64.2311 37.0986 178.5478 66 S 4.2164 8.2785 115.2420 61.6660 62.7959 176.6278 67 Q 4.0995 8.1573 121.5819 58.4518 28.3653 178.5222 68 L 4.0198 8.0612 121.3139 58.3603 42.1546 178.9861 69 L 4.1006 8.3295 119.1868 57.9588 41.5431 178.9827 70 Y 4.0434 8.3572 119.5086 61.2005 38.5803 177.9893 71 H 3.9491 8.0265 115.6439 58.4903 28.8054 177.7391 72 V 3.7419 7.8989 119.8195 66.1321 31.4716 177.7906 73 Q 4.2494 8.0684 116.9000 58.1420 29.8889 178.5454 74 V 3.6688 7.2471 120.5471 62.9639 28.0827 175.9111 *77 V 3.9303 7.7152 122.0023 62.2691 33.4747 177.4239 78 A 4.0312 8.2623 121.4936 54.5102 18.2402 178.1600 79 R 4.3784 7.9641 111.9416 55.4641 30.6808 176.4280 80 G 3.9295 7.7325 105.3576 46.4442 0.0000 173.8714 81 I 4.1776 7.7803 119.7617 60.1444 38.5015 176.1859 82 S 4.9460 8.6494 119.3862 56.6231 66.6190 175.5142 83 L 3.4111 8.1113 121.7604 57.7369 41.1604 179.5667 84 D 4.5050 7.9395 118.5401 57.2276 40.5964 178.2018 85 D 4.3385 7.5630 118.6402 57.3973 41.2022 178.8595 86 V 3.7206 7.4736 118.1492 66.3701 31.4650 177.6151 87 Y 4.4877 8.2637 116.5704 61.2014 37.4226 178.5690 88 A 4.0313 8.1641 121.0719 55.3547 18.7283 178.8476 89 H 4.4966 8.2918 114.3198 58.0425 28.8576 177.2387 90 L 4.2194 7.5360 118.3038 55.9427 41.3640 177.1318 91 L 4.3132 7.6935 124.7997 54.7848 41.9039 176.1432 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 4 K 8.31 4.29 0.00 1.76 1.94 0.00 1.76 0.00 0.00 1.73 0.00 0.00 2.96 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.36 1.50 7.81 5 T 7.77 4.25 4.40 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 1.37 0.00 0.00 6 F 9.75 4.22 0.00 3.14 3.19 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 7 E 8.46 4.17 0.00 2.19 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 2.74 2.68 0.00 8 E 8.06 4.05 0.00 2.20 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 2.44 2.45 0.00 9 L 7.95 4.03 0.00 1.69 1.73 0.99 1.02 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 10 F 8.04 4.15 0.00 3.03 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 11 T 7.74 3.77 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 1.17 0.00 0.00 12 E 7.78 3.97 0.00 2.12 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 2.60 2.50 0.00 13 L 7.67 4.00 0.00 1.61 1.57 0.90 1.15 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 14 Q 7.37 3.75 0.00 1.97 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.07 6.98 0.00 0.00 0.00 0.00 0.00 1.84 1.59 0.00 15 H 7.83 4.34 0.00 3.14 3.41 0.00 5.59 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 K 7.75 4.04 0.00 1.71 1.83 0.00 1.76 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.65 7.81 17 A 7.56 4.35 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 18 A 7.72 4.02 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 19 N 6.83 4.88 0.00 2.50 1.97 0.00 0.00 6.95 7.42 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 *24 T 8.22 4.32 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 1.21 0.00 0.00 25 S 7.98 4.28 0.00 3.85 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 26 R 8.62 4.18 0.00 1.71 1.72 0.00 3.15 0.00 0.00 3.22 7.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.56 0.00 27 T 8.46 4.21 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 1.22 0.00 0.00 28 A 7.60 3.91 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.47 4.60 0.00 2.00 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 2.55 2.28 0.00 30 L 7.68 4.15 0.00 1.70 1.73 1.05 0.86 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 31 V 7.81 3.55 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 0.81 0.00 0.00 0.90 0.00 0.00 32 D 7.48 4.44 0.00 2.83 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 33 K 7.85 4.14 0.00 1.90 1.88 0.00 1.79 0.00 0.00 1.73 0.00 0.00 3.04 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.52 7.81 34 G 8.44 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 V 8.57 3.56 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 0.93 0.00 0.00 0.94 0.00 0.00 36 H 8.33 4.01 0.00 3.29 3.31 0.00 5.92 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 A 8.01 4.04 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 38 I 7.83 3.94 1.99 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 1.47 0.66 0.91 0.00 0.00 39 G 8.63 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 40 K 7.95 3.92 0.00 1.96 1.86 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.99 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.39 1.58 7.81 41 K 7.63 3.88 0.00 1.85 1.48 0.00 1.78 0.00 0.00 1.57 0.00 0.00 2.85 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.65 1.55 7.81 42 V 7.90 3.59 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 1.01 0.00 0.00 43 V 7.87 3.64 2.23 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 1.01 0.00 0.00 0.94 0.00 0.00 44 E 8.46 4.03 0.00 2.24 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 2.54 2.35 0.00 45 E 8.74 4.05 0.00 2.20 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 2.53 2.55 0.00 46 A 8.16 4.01 1.45 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 0.00 0.00 47 A 7.62 4.16 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 48 E 8.03 4.10 0.00 2.18 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 0.00 2.38 2.50 0.00 49 V 8.37 3.88 2.35 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 1.15 0.00 0.00 1.05 0.00 0.00 50 W 8.32 4.49 0.00 3.45 3.23 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 *52 A 7.98 4.30 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 53 A 8.42 4.04 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 54 E 8.41 4.02 0.00 2.01 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 1.73 1.63 0.00 55 Y 7.90 4.45 0.00 2.97 2.96 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 56 E 8.08 4.55 0.00 2.13 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 2.35 2.42 0.00 57 G 8.17 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 58 K 8.46 4.00 0.00 1.82 1.89 0.00 1.68 0.00 0.00 1.75 0.00 0.00 2.89 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.54 1.51 7.81 59 D 8.09 4.32 0.00 2.80 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 60 A 8.02 4.02 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 61 A 8.16 3.99 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 62 A 8.22 3.97 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 63 E 8.35 3.92 0.00 2.18 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 2.33 2.36 0.00 64 E 8.28 4.07 0.00 2.23 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 2.59 2.55 0.00 65 I 8.12 3.83 2.04 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.88 0.96 0.00 0.00 66 S 8.28 4.22 0.00 4.13 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 0.00 67 Q 8.16 4.10 0.00 2.40 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.84 0.00 0.00 0.00 0.00 0.00 2.42 2.57 0.00 68 L 8.06 4.02 0.00 1.85 1.95 1.00 0.76 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 69 L 8.33 4.10 0.00 2.05 2.02 1.06 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 70 Y 8.36 4.04 0.00 3.09 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 71 H 8.03 3.95 0.00 3.37 3.35 0.00 5.71 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 V 7.90 3.74 2.28 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 0.85 0.00 0.00 1.02 0.00 0.00 73 Q 8.07 4.25 0.00 2.14 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 7.13 0.00 0.00 0.00 0.00 0.00 2.12 2.45 0.00 74 V 7.25 3.67 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 0.99 0.00 0.00 0.19 0.00 0.00 *77 V 7.72 3.93 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 0.83 0.00 0.00 0.72 0.00 0.00 78 A 8.26 4.03 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 79 R 7.96 4.38 0.00 1.80 1.95 0.00 3.49 0.00 0.00 3.23 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.54 0.00 80 G 7.73 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 0.00 0.00 0.00 81 I 7.78 4.18 1.88 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 1.47 0.62 0.87 0.00 0.00 82 S 8.65 4.95 0.00 4.10 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 83 L 8.11 3.41 0.00 1.55 1.16 0.99 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 84 D 7.94 4.50 0.00 2.78 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 85 D 7.56 4.34 0.00 2.76 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 86 V 7.47 3.72 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 0.97 0.00 0.00 0.86 0.00 0.00 87 Y 8.26 4.49 0.00 3.04 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 88 A 8.16 4.03 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 89 H 8.29 4.50 0.00 3.39 3.34 0.00 5.63 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 L 7.54 4.22 0.00 1.84 1.74 1.05 0.92 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 91 L 7.69 4.31 0.00 1.63 1.53 0.91 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.