NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 A 4.3678 8.2493 123.5773 51.3318 20.7350 176.4946 6 H 4.7885 8.0561 110.7909 51.2461 32.4621 171.9504 7 R 4.7517 9.0675 123.0478 55.5755 31.3232 177.4388 8 L 4.3617 8.4984 126.4351 55.3415 42.6152 177.0068 9 S 4.6136 9.6761 117.3220 57.1003 65.2202 175.0269 10 A 4.1934 8.7734 123.9524 55.8663 17.3743 180.4794 11 E 3.9512 8.0641 116.4908 61.3171 29.9653 182.3134 12 E 4.1928 8.0475 119.5279 59.2730 29.5567 179.5703 13 R 3.9104 8.4031 118.5432 59.4635 29.9334 178.6531 14 D 4.4761 8.1223 118.6705 56.9883 41.2836 177.7848 15 Q 4.5840 7.4828 117.4003 56.9919 29.4310 180.6544 16 L 4.8158 7.7545 117.3707 56.4976 44.0146 178.3468 17 L 4.1249 8.0043 119.0017 56.8806 41.4627 177.2842 18 P 4.2658 0.0000 0.0000 66.0806 30.1340 178.1969 19 N 4.3532 8.1945 114.2418 56.2871 38.4211 177.3307 20 L 4.4638 7.8434 119.9691 57.7472 41.9378 179.4015 21 R 4.6730 8.7609 119.5404 58.6793 29.7324 178.6916 22 A 4.1128 8.1180 120.1221 54.6686 18.2983 178.5668 23 V 4.1803 7.0372 108.6160 61.6080 31.8049 177.0552 24 G 3.9450 8.0404 110.0201 44.9613 0.0000 175.1161 25 W 4.5156 8.2812 120.3003 57.0135 30.3525 175.1636 26 N 5.4590 9.3705 119.5523 51.6157 42.7751 173.5378 27 E 4.9160 8.8169 120.7282 55.8001 30.7327 176.6087 28 L 4.1201 8.7129 123.9766 54.8999 42.6444 177.7057 29 E 4.1929 8.7107 122.9325 57.4602 28.1830 175.7243 30 G 3.8937 8.2444 109.6909 45.0996 0.0000 171.8060 31 R 4.5246 7.4435 118.7583 54.9893 32.7667 174.6350 32 D 4.5613 8.6001 124.3581 53.3124 39.9287 174.3237 33 A 4.8090 7.8245 125.0042 50.7060 22.9343 174.4892 34 I 5.2094 8.4956 112.7664 59.4784 40.8455 174.4728 35 F 6.0621 9.5011 124.9321 56.4054 43.7240 173.0373 36 K 3.9420 6.7309 119.4442 55.4701 35.0675 173.5353 37 Q 4.5899 8.0921 126.0802 54.7455 30.2157 174.9859 38 F 4.7169 9.1483 121.8689 55.7252 42.6927 173.9880 39 H 5.2119 8.1736 116.2024 54.0556 31.4009 172.1625 40 F 4.7484 8.7606 119.5548 55.4058 42.4119 175.1291 41 K 4.0479 8.9754 119.9976 59.4341 32.1236 176.4007 42 D 4.3034 7.5089 116.0779 50.7980 43.3291 175.3602 43 F 4.4078 7.8391 121.6065 60.8783 39.1799 176.2022 44 N 4.2304 8.2832 115.4165 56.5789 38.2700 177.3500 45 R 3.7214 8.9112 119.1004 59.0672 29.9515 178.7330 46 A 3.0182 7.4121 119.1970 55.1466 18.4192 179.3281 47 F 3.5971 8.1335 118.1347 60.3834 39.5551 177.4529 48 G 3.6485 7.7446 105.9287 47.4822 0.0000 175.9218 49 F 4.2077 7.8297 119.6093 59.1829 39.0972 176.6623 *51 T 4.0436 7.7916 114.7199 63.3178 70.5515 176.3522 52 R 3.9041 7.9515 120.1560 59.4448 29.9919 179.2424 53 V 3.5956 7.7383 117.6756 65.9049 31.4086 177.8481 54 A 3.9243 7.8530 119.9664 55.1889 18.2565 179.3959 55 L 3.8720 7.9015 117.4602 57.9900 41.6659 179.6249 56 Q 3.5707 7.6953 118.7873 58.7418 28.7568 177.8994 57 A 3.9015 7.7904 123.4692 54.2541 18.0511 179.3154 58 E 3.7980 7.6326 117.0342 59.4880 29.8740 178.9344 59 K 4.0124 7.4873 116.7544 59.0829 32.1305 178.6453 60 L 4.1594 7.7759 117.4989 54.2017 41.9603 176.2715 61 D 4.3608 7.8765 116.9340 55.2015 39.9007 172.4486 62 H 4.8578 7.7113 115.1232 54.0100 32.7535 171.4477 63 H 4.6738 8.2832 122.7921 53.0330 31.7703 171.6556 64 P 4.3422 0.0000 0.0000 62.5686 32.8620 175.8817 65 E 4.6871 9.0645 121.4592 54.6478 30.1493 174.9085 66 W 5.7954 8.9622 120.8241 54.4610 31.6482 174.4874 67 F 5.1731 9.5921 123.9722 56.5419 41.8465 173.1865 68 N 5.2364 8.2215 123.6604 51.7231 41.8729 173.8746 69 V 4.0653 8.0177 124.6986 61.4787 34.8835 176.9390 70 Y 3.8732 9.1016 132.9256 58.6744 38.2020 170.6372 71 N 4.7483 9.4693 116.4394 52.5047 39.0550 174.7194 72 K 5.0880 8.1371 119.5217 55.2942 34.9916 176.0253 73 V 4.5190 8.9265 123.3159 62.1452 34.7624 173.2897 74 H 5.1478 9.6916 126.9755 54.5796 30.6041 174.4158 75 I 5.2307 8.4444 124.1730 59.8573 40.4042 174.7604 76 T 5.4786 9.4148 122.7674 61.8972 72.1305 172.8844 77 L 5.0787 8.8920 126.0496 53.1911 45.0606 175.5059 78 S 4.8395 8.2199 115.0339 58.2493 65.7578 174.9724 79 T 4.5164 8.2863 120.5910 62.0071 70.0821 174.9206 80 H 4.1634 9.0733 127.5526 59.1944 30.2559 177.0646 81 E 3.9510 8.3676 117.6741 58.8516 29.3186 177.4477 82 C 4.5487 7.9195 109.8137 56.7890 30.5100 173.5881 83 A 3.6654 7.8986 120.7600 52.1090 16.0235 176.9294 84 G 3.9538 7.1897 108.8099 44.6499 0.0000 171.5465 85 L 5.0336 8.1409 118.5581 54.7375 42.3211 176.1019 86 S 4.7426 8.2714 113.2058 56.2048 65.5694 175.4653 87 E 3.8945 8.9498 122.6471 60.7047 28.8323 180.7597 88 R 3.9714 7.7220 120.0913 61.2865 29.3553 181.3313 89 D 4.5098 8.1207 119.3511 57.4161 40.8388 178.9696 90 I 3.5598 7.5119 119.8205 64.1805 37.2525 177.9330 91 N 4.2633 8.5227 117.6883 56.3689 38.3744 177.0881 92 L 3.9049 8.1306 121.5226 58.1064 42.1652 178.8084 93 A 3.8713 8.0166 120.7280 55.2941 18.2413 179.7495 94 S 4.1241 8.1213 113.6132 61.7874 62.9152 176.7957 95 F 4.0355 8.2634 123.1188 61.2904 39.0431 177.1883 96 I 3.9055 8.3820 119.7783 64.5899 36.8317 178.2894 97 E 4.2563 8.6460 119.4743 59.4522 29.1967 179.3316 98 Q 3.9382 7.9437 118.1849 58.9107 28.4964 179.1074 99 V 3.5356 7.3850 117.9857 65.7609 31.6802 177.6793 100 A 4.2069 8.3329 119.8995 55.3367 18.3775 179.6267 101 V 3.7054 8.0024 115.7122 65.7158 31.6312 176.4183 102 S 4.3887 7.6531 116.6525 58.5303 62.3952 173.3393 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 5 A 8.25 4.37 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 6 H 8.06 4.79 0.00 3.29 3.19 0.00 5.53 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 R 9.07 4.75 0.00 1.80 1.84 0.00 3.12 0.00 0.00 4.01 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.46 0.00 8 L 8.50 4.36 0.00 1.52 1.56 0.88 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 9 S 9.68 4.61 0.00 3.86 4.01 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 10 A 8.77 4.19 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 11 E 8.06 3.95 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 2.31 1.97 0.00 12 E 8.05 4.19 0.00 2.23 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 2.34 2.36 0.00 13 R 8.40 3.91 0.00 1.80 1.98 0.00 3.12 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.78 0.00 14 D 8.12 4.48 0.00 2.90 2.86 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 15 Q 7.48 4.58 0.00 2.20 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.53 0.00 0.00 0.00 0.00 0.00 2.21 2.23 0.00 16 L 7.75 4.82 0.00 1.62 1.66 0.89 0.99 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 17 L 8.00 4.12 0.00 1.87 1.72 0.92 0.89 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 18 P 0.00 4.27 0.00 2.16 2.14 0.00 3.60 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.22 0.00 19 N 8.19 4.35 0.00 2.74 2.90 0.00 0.00 7.08 6.74 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 20 L 7.84 4.46 0.00 1.79 1.51 0.59 0.79 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 21 R 8.76 4.67 0.00 2.02 2.04 0.00 3.19 0.00 0.00 3.32 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.76 0.00 22 A 8.12 4.11 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 23 V 7.04 4.18 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 0.78 0.00 0.00 1.29 0.00 0.00 24 G 8.04 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 25 W 8.28 4.52 0.00 3.39 3.22 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 0.00 0.00 0.00 0.00 26 N 9.37 5.46 0.00 2.74 2.73 0.00 0.00 6.99 7.26 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 27 E 8.82 4.92 0.00 1.90 1.92 0.00 0.00 0.00 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 2.41 0.00 28 L 8.71 4.12 0.00 1.76 1.58 0.92 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 29 E 8.71 4.19 0.00 1.91 1.92 0.00 0.00 0.00 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 2.35 0.00 30 G 8.24 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 31 R 7.44 4.52 0.00 1.74 1.76 0.00 3.26 0.00 0.00 3.18 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.63 0.00 32 D 8.60 4.56 0.00 2.76 2.57 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 33 A 7.82 4.81 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.50 5.21 2.17 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.36 0.96 0.00 0.00 35 F 9.50 6.06 0.00 3.19 2.95 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 36 K 6.73 3.94 0.00 0.79 0.74 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.30 0.54 7.81 37 Q 8.09 4.59 0.00 1.73 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.70 6.50 0.00 0.00 0.00 0.00 0.00 1.95 2.30 0.00 38 F 9.15 4.72 0.00 3.07 2.41 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 39 H 8.17 5.21 0.00 3.03 3.07 0.00 5.47 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 F 8.76 4.75 0.00 2.76 2.90 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 41 K 8.98 4.05 0.00 1.74 1.85 0.00 1.80 0.00 0.00 1.76 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.45 7.81 42 D 7.51 4.30 0.00 2.86 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 43 F 7.84 4.41 0.00 2.90 3.03 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 44 N 8.28 4.23 0.00 2.95 2.84 0.00 0.00 7.10 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 45 R 8.91 3.72 0.00 1.82 1.80 0.00 3.29 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 1.76 1.78 0.00 46 A 7.41 3.02 1.16 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 0.00 0.00 0.00 47 F 8.13 3.60 0.00 1.90 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 48 G 7.74 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 49 F 7.83 4.21 0.00 2.45 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.79 4.04 4.26 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 1.18 0.00 0.00 52 R 7.95 3.90 0.00 1.94 2.08 0.00 3.14 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.84 0.00 53 V 7.74 3.60 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 0.88 0.00 0.00 0.26 0.00 0.00 54 A 7.85 3.92 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 55 L 7.90 3.87 0.00 1.82 1.67 0.91 0.44 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 56 Q 7.70 3.57 0.00 0.93 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.79 0.00 0.00 0.00 0.00 0.00 1.16 1.83 0.00 57 A 7.79 3.90 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 7.63 3.80 0.00 1.96 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 2.28 2.33 0.00 59 K 7.49 4.01 0.00 1.72 1.77 0.00 1.59 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.40 1.57 7.81 60 L 7.78 4.16 0.00 1.48 1.62 0.77 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 61 D 7.88 4.36 0.00 2.74 2.68 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 0.00 0.00 0.00 62 H 7.71 4.86 0.00 3.07 2.95 0.00 5.85 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 H 8.28 4.67 0.00 2.96 2.95 0.00 5.94 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 P 0.00 4.34 0.00 1.56 1.65 0.00 3.15 0.00 0.00 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.44 0.00 65 E 9.06 4.69 0.00 2.27 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 2.30 2.25 0.00 66 W 8.96 5.80 0.00 3.35 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 67 F 9.59 5.17 0.00 3.15 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 68 N 8.22 5.24 0.00 2.51 2.46 0.00 0.00 6.82 7.71 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 69 V 8.02 4.07 2.08 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 0.94 0.00 0.00 0.60 0.00 0.00 70 Y 9.10 3.87 0.00 3.18 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 71 N 9.47 4.75 0.00 2.94 2.64 0.00 0.00 5.84 7.76 0.00 0.00 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 K 8.14 5.09 0.00 1.85 1.82 0.00 1.73 0.00 0.00 1.70 0.00 0.00 2.88 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.47 1.48 7.81 73 V 8.93 4.52 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 1.28 0.00 0.00 1.06 0.00 0.00 74 H 9.69 5.15 0.00 3.46 3.38 0.00 5.63 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 I 8.44 5.23 2.18 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.18 1.24 0.00 0.00 76 T 9.41 5.48 4.56 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 1.42 0.00 0.00 77 L 8.89 5.08 0.00 1.56 1.69 0.73 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 78 S 8.22 4.84 0.00 3.87 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 79 T 8.29 4.52 4.42 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 1.20 0.00 0.00 80 H 9.07 4.16 0.00 3.22 3.34 0.00 5.88 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 E 8.37 3.95 0.00 1.97 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 2.33 2.39 0.00 82 C 7.92 4.55 0.00 3.01 2.95 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 83 A 7.90 3.67 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 84 G 7.19 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 85 L 8.14 5.03 0.00 1.69 1.56 0.92 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 86 S 8.27 4.74 0.00 4.08 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 87 E 8.95 3.89 0.00 1.96 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 2.42 2.37 0.00 88 R 7.72 3.97 0.00 1.78 1.94 0.00 3.27 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 1.56 1.54 0.00 89 D 8.12 4.51 0.00 2.70 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 90 I 7.51 3.56 1.80 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.87 0.83 0.00 0.00 91 N 8.52 4.26 0.00 2.76 2.83 0.00 0.00 6.67 6.77 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 92 L 8.13 3.90 0.00 1.77 1.66 0.76 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 93 A 8.02 3.87 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 S 8.12 4.12 0.00 4.06 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 95 F 8.26 4.04 0.00 3.14 3.17 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 96 I 8.38 3.91 2.43 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.92 1.24 0.00 0.00 97 E 8.65 4.26 0.00 2.32 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 0.00 3.00 2.82 0.00 98 Q 7.94 3.94 0.00 1.87 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.83 0.00 0.00 0.00 0.00 0.00 2.32 2.59 0.00 99 V 7.39 3.54 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 0.94 0.00 0.00 0.61 0.00 0.00 100 A 8.33 4.21 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 0.00 101 V 8.00 3.71 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 0.85 0.00 0.00 1.03 0.00 0.00 102 S 7.65 4.39 0.00 4.00 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 * Residues marked with a * may have inaccurate shift predictions.