NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 E 4.7765 8.4293 121.4949 56.2194 30.7800 174.5069 8 R 4.6445 9.0650 121.8706 54.2432 33.8424 168.2912 9 V 4.8435 8.5783 119.3312 61.2320 33.5656 175.9769 10 V 4.5299 9.2406 127.5009 61.4662 35.1351 174.5910 11 T 4.7943 8.4257 122.1196 61.9793 69.7455 173.6196 12 I 3.9936 8.3412 129.0374 59.7031 38.3701 173.5978 13 P 4.7225 0.0000 0.0000 61.7171 32.6429 175.9987 14 L 4.6547 8.6485 122.9134 54.5066 41.9390 178.1883 15 R 4.1008 8.0458 114.0605 57.9060 29.2125 176.5581 16 D 4.6507 7.8439 117.8329 54.7759 41.8317 177.3859 17 A 4.2173 8.0320 121.4047 53.5546 18.3123 179.4843 18 R 3.9489 7.8399 115.5551 58.4775 30.3290 177.9001 19 A 4.1489 7.5860 119.1237 52.4980 18.7664 176.7599 20 E 4.4909 7.0555 118.2664 53.1276 31.5315 173.8338 21 P 4.3087 0.0000 0.0000 63.0596 32.0689 176.7760 22 N 4.0860 9.1104 120.3285 56.9738 38.5511 176.2482 23 H 4.4592 8.2161 108.4649 56.4607 28.4180 175.5976 24 K 4.4908 8.2577 117.8367 55.7823 34.2644 178.3209 25 R 3.7801 8.0573 121.3326 59.1015 29.7743 178.4797 26 A 3.4844 7.4354 120.5803 55.1171 17.9405 179.4175 27 D 4.3769 7.5711 116.6787 57.3801 40.8932 178.8134 28 K 3.9000 7.7115 119.9168 59.2512 32.1844 178.4143 29 A 3.9179 8.1693 121.5096 55.7130 18.4876 179.2345 30 M 4.0296 8.0598 116.1878 58.7629 31.9982 178.5332 31 I 3.8703 7.4435 119.9693 64.2677 37.5207 177.8918 32 L 3.9196 8.1028 119.9165 58.2194 41.4796 179.9615 33 I 3.6522 7.8066 119.3113 64.3169 37.0181 178.2894 34 R 3.8617 7.5122 118.1548 59.6431 29.9313 178.2253 35 E 3.9545 8.4413 118.5324 59.6557 29.3689 178.9253 36 H 4.1244 8.7354 118.4389 59.3895 30.0295 177.2515 37 L 4.0555 8.1460 120.5334 57.7086 41.4384 179.2972 38 A 4.0014 8.2858 120.9421 55.1721 18.2129 179.7085 39 K 3.8784 8.0435 117.9680 59.9943 32.1796 178.5486 40 H 4.4390 8.5448 114.3667 57.2079 28.7877 175.9930 41 F 4.4228 8.1213 117.9274 56.2514 40.0295 175.6465 42 S 3.6798 7.6604 116.1031 59.2168 60.1562 170.5616 43 V 4.5037 8.3820 118.6570 61.1688 35.5717 173.5451 44 D 4.6111 8.3884 121.9039 53.6062 41.6889 177.4949 45 E 3.8999 9.0315 123.1213 59.8202 29.6741 179.1799 46 D 4.3585 8.2001 116.6230 57.0978 41.0956 177.5519 47 A 4.1497 8.5820 121.9104 53.8391 19.0566 177.2522 48 V 3.9474 7.5520 116.9502 62.9062 32.3844 175.6680 49 R 4.4642 8.8535 128.6679 54.4914 32.1781 174.2716 50 L 4.6598 8.3881 127.4234 53.7874 42.5114 176.6629 51 D 4.4304 9.0638 124.9850 53.4508 42.0712 175.2434 52 P 4.1908 0.0000 0.0000 65.9092 31.2609 178.5928 53 S 4.1148 8.7096 113.3077 62.0194 62.5487 177.0287 54 I 3.7349 8.1178 123.6014 63.7135 36.8292 177.9240 55 N 4.4261 8.0191 117.4180 57.0166 38.7348 176.7474 56 E 4.0879 8.7200 118.4451 58.9696 29.6060 179.0717 57 A 4.1472 7.9906 120.9226 55.2793 18.3265 179.5913 58 A 3.9930 8.0831 117.8407 54.6280 18.4780 178.8496 59 W 4.7592 8.4384 116.0196 56.4297 29.6305 177.8885 60 A 4.0849 7.8498 121.9523 55.7978 17.4545 179.9054 61 R 4.3376 7.6588 114.3616 56.4453 30.8780 177.5585 62 G 3.9131 8.1707 105.6332 44.6034 0.0000 174.4340 63 R 3.8336 8.5957 116.3606 56.2459 31.3041 178.5770 64 A 4.9724 7.7749 118.1824 52.4788 19.9726 176.6493 65 N 4.8367 7.9002 113.1481 51.9495 39.9449 174.4546 66 T 4.6356 8.0347 119.4263 60.4400 71.9736 172.2044 67 P 4.4220 0.0000 0.0000 62.8156 32.0084 176.8004 68 S 4.3326 8.5601 114.8303 61.0581 64.3328 173.2396 69 K 5.2522 7.4465 117.3491 55.4999 36.8029 175.0689 70 I 4.1233 7.7664 116.6913 60.5243 41.2330 173.2980 71 R 4.8182 8.8099 129.6175 55.9402 30.9311 176.2838 72 V 4.5558 9.3542 123.6732 59.8620 35.1556 174.5609 73 R 4.9623 8.8495 124.7373 55.0775 31.2294 174.4866 74 A 5.1499 8.9295 128.5267 49.9591 22.3902 174.6990 75 A 5.1006 8.8853 121.8816 50.1693 22.0924 174.9976 76 R 4.9331 8.8324 123.4197 54.5462 32.1811 176.0027 77 F 4.5163 8.1058 120.3159 58.0798 38.9591 174.6980 *78 E 4.3571 8.2867 117.9258 55.6332 31.6367 175.6322 79 E 3.9164 8.8675 118.2697 59.6252 29.7783 177.9895 80 E 3.7922 8.0272 119.6002 57.7745 29.6908 176.8397 81 G 3.8693 8.7330 108.7850 46.0792 0.0000 171.9287 82 E 4.7469 8.4260 122.3742 54.2793 33.7537 173.9619 83 A 4.9543 8.0699 121.1814 50.1002 22.4403 175.2807 84 I 4.7838 8.3849 121.0821 59.5052 40.3325 175.1044 85 V 5.0476 8.6027 125.8744 61.3484 35.7051 173.5653 86 E 5.0091 8.5749 120.6648 54.7889 33.2995 175.5656 87 A 4.6501 8.4316 121.7600 52.3221 20.0560 177.7958 88 E 4.7219 8.8635 112.5400 57.3284 29.0651 177.1395 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 7 E 8.43 4.78 0.00 2.07 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 2.27 2.62 0.00 8 R 9.07 4.64 0.00 1.90 2.01 0.00 2.78 0.00 0.00 3.08 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.75 0.00 9 V 8.58 4.84 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 0.94 0.00 0.00 0.99 0.00 0.00 10 V 9.24 4.53 2.16 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 1.00 0.00 0.00 1.20 0.00 0.00 11 T 8.43 4.79 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 12 I 8.34 3.99 1.79 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.15 0.74 0.00 0.00 13 P 0.00 4.72 0.00 2.07 2.04 0.00 3.67 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 1.98 2.01 0.00 14 L 8.65 4.65 0.00 1.66 1.63 0.97 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 15 R 8.05 4.10 0.00 1.90 2.05 0.00 3.02 0.00 0.00 3.22 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 16 D 7.84 4.65 0.00 2.72 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 17 A 8.03 4.22 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 18 R 7.84 3.95 0.00 1.90 1.99 0.00 3.19 0.00 0.00 3.21 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.67 0.00 19 A 7.59 4.15 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 0.00 0.00 0.00 0.00 0.00 0.00 20 E 7.06 4.49 0.00 1.90 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 2.18 2.20 0.00 21 P 0.00 4.31 0.00 2.27 2.20 0.00 3.75 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.99 0.00 22 N 9.11 4.09 0.00 2.78 2.93 0.00 0.00 6.91 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 23 H 8.22 4.46 0.00 3.26 3.37 0.00 5.48 0.00 0.00 0.00 0.00 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 K 8.26 4.49 0.00 1.61 1.64 0.00 1.37 0.00 0.00 1.39 0.00 0.00 2.81 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.19 0.85 7.81 25 R 8.06 3.78 0.00 1.80 1.87 0.00 3.27 0.00 0.00 3.54 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.74 0.00 26 A 7.44 3.48 -0.17 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 27 D 7.57 4.38 0.00 2.71 2.79 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 28 K 7.71 3.90 0.00 1.77 1.84 0.00 1.52 0.00 0.00 1.63 0.00 0.00 3.03 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.40 1.47 7.81 29 A 8.17 3.92 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 30 M 8.06 4.03 0.00 2.34 2.36 0.00 0.00 0.00 0.00 0.00 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.81 0.00 31 I 7.44 3.87 2.02 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 1.54 0.82 0.92 0.00 0.00 32 L 8.10 3.92 0.00 1.82 1.77 0.89 1.22 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 33 I 7.81 3.65 2.04 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 1.39 0.88 0.90 0.00 0.00 34 R 7.51 3.86 0.00 1.96 2.12 0.00 3.11 0.00 0.00 3.28 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.67 0.00 35 E 8.44 3.95 0.00 2.19 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 2.47 2.55 0.00 36 H 8.74 4.12 0.00 3.33 3.44 0.00 5.59 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 L 8.15 4.06 0.00 1.82 1.50 0.84 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 38 A 8.29 4.00 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 39 K 8.04 3.88 0.00 1.83 1.87 0.00 1.21 0.00 0.00 1.44 0.00 0.00 2.90 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.31 1.40 7.81 40 H 8.54 4.44 0.00 3.47 3.44 0.00 5.66 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 41 F 8.12 4.42 0.00 3.13 3.08 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 0.00 0.00 0.00 0.00 42 S 7.66 3.68 0.00 3.94 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 43 V 8.38 4.50 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 0.78 0.00 0.00 1.01 0.00 0.00 44 D 8.39 4.61 0.00 2.81 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 45 E 9.03 3.90 0.00 2.02 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 2.41 2.36 0.00 46 D 8.20 4.36 0.00 2.65 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 47 A 8.58 4.15 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 48 V 7.55 3.95 2.16 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 0.65 0.00 0.00 0.98 0.00 0.00 49 R 8.85 4.46 0.00 1.86 1.72 0.00 3.13 0.00 0.00 3.17 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.55 0.00 50 L 8.39 4.66 0.00 1.57 1.60 0.93 1.06 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 51 D 9.06 4.43 0.00 2.76 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 52 P 0.00 4.19 0.00 2.18 2.10 0.00 3.68 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 2.11 2.16 0.00 53 S 8.71 4.11 0.00 4.03 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 54 I 8.12 3.73 1.98 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 1.41 0.66 0.93 0.00 0.00 55 N 8.02 4.43 0.00 2.86 2.99 0.00 0.00 7.21 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 56 E 8.72 4.09 0.00 1.96 2.03 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 2.33 2.43 0.00 57 A 7.99 4.15 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 58 A 8.08 3.99 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 59 W 8.44 4.76 0.00 3.21 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 60 A 7.85 4.08 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 61 R 7.66 4.34 0.00 1.81 1.96 0.00 3.16 0.00 0.00 3.22 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.63 0.00 62 G 8.17 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 63 R 8.60 3.83 0.00 1.93 1.88 0.00 3.38 0.00 0.00 3.51 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.83 0.00 64 A 7.77 4.97 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 65 N 7.90 4.84 0.00 2.84 2.73 0.00 0.00 6.69 7.54 0.00 0.00 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 T 8.03 4.64 4.16 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 1.13 0.00 0.00 67 P 0.00 4.42 0.00 2.38 2.04 0.00 3.71 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.95 0.00 68 S 8.56 4.33 0.00 3.91 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 69 K 7.45 5.25 0.00 1.59 1.71 0.00 1.83 0.00 0.00 2.61 0.00 0.00 2.85 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.33 1.26 7.81 70 I 7.77 4.12 1.86 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 1.34 1.10 0.89 0.00 0.00 71 R 8.81 4.82 0.00 1.74 2.03 0.00 3.20 0.00 0.00 3.28 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.63 0.00 72 V 9.35 4.56 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 0.72 0.00 0.00 0.96 0.00 0.00 73 R 8.85 4.96 0.00 2.13 1.87 0.00 3.07 0.00 0.00 3.20 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.61 0.00 74 A 8.93 5.15 0.61 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 0.00 0.00 75 A 8.89 5.10 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 R 8.83 4.93 0.00 2.22 2.09 0.00 3.59 0.00 0.00 3.35 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 77 F 8.11 4.52 0.00 3.29 3.13 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 *78 E 8.29 4.36 0.00 1.89 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 2.21 2.37 0.00 79 E 8.87 3.92 0.00 2.06 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 0.00 2.30 2.41 0.00 80 E 8.03 3.79 0.00 1.98 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 2.31 2.25 0.00 81 G 8.73 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 82 E 8.43 4.75 0.00 2.07 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 2.08 2.18 0.00 83 A 8.07 4.95 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 84 I 8.38 4.78 2.03 0.00 0.00 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 1.10 0.79 0.96 0.00 0.00 85 V 8.60 5.05 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 1.02 0.00 0.00 0.70 0.00 0.00 86 E 8.57 5.01 0.00 2.02 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 2.29 2.27 0.00 87 A 8.43 4.65 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 88 E 8.86 4.72 0.00 2.21 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 2.10 2.07 0.00 * Residues marked with a * may have inaccurate shift predictions.