NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 T 4.2970 8.1593 110.9398 61.3845 70.4845 173.5164 3 T 4.1205 7.5996 112.1071 59.1842 70.3313 173.4313 4 S 4.4512 8.3945 117.3814 57.9425 66.2753 176.0742 5 Q 4.0240 8.6322 123.5556 59.3993 28.8003 178.7935 6 K 3.9777 8.1062 119.0607 59.6759 32.0649 178.5068 7 H 4.1663 8.2177 118.3080 59.4036 29.3937 177.4247 8 R 4.0199 8.1521 119.7752 59.6456 29.7353 178.9069 9 D 4.4478 8.3086 117.5884 57.2698 40.8483 178.3045 10 F 4.2431 8.2916 120.5886 60.9350 39.5645 177.0101 11 V 4.1658 8.1548 115.8671 64.5007 31.5766 177.0005 12 A 4.4423 7.7170 118.5270 53.2101 18.7197 176.3009 13 E 4.3319 7.2413 113.0544 54.1217 32.8158 175.1758 14 P 4.4574 0.0000 0.0000 62.1219 31.9827 175.6884 *16 G 4.0351 7.9932 110.2169 46.9744 0.0000 172.9530 17 E 4.6420 8.9100 124.0875 55.7401 29.4318 176.0551 18 K 3.9841 7.9849 119.3585 56.1290 32.7975 175.0227 19 P 4.8295 0.0000 0.0000 61.8682 32.4549 177.6233 20 V 3.6595 8.3501 118.0622 64.4916 31.2282 178.3473 21 G 3.7566 7.9635 108.0409 47.5650 0.0000 174.5333 22 S 4.3521 7.9416 115.4614 60.3694 63.4891 174.9185 23 L 3.4221 7.6267 121.5280 53.8161 41.9207 176.6382 24 A 4.2476 8.1240 125.6737 53.6214 18.8627 178.8560 25 G 3.9898 8.7998 108.4624 45.6919 0.0000 174.4663 26 I 4.1170 7.2695 120.9946 59.7915 36.0844 176.2281 27 G 3.9232 7.8610 112.7134 43.4263 0.0000 170.5533 28 E 3.9781 8.6850 118.5903 59.4955 29.1461 179.8892 29 V 3.5381 7.6616 117.4120 66.1395 31.6825 177.9717 30 L 4.0374 7.8992 118.3569 57.4701 41.3945 179.4366 31 G 3.6645 8.4244 106.2111 47.8673 0.0000 175.4710 32 K 4.0588 8.2897 122.8813 59.0651 31.9190 178.9848 33 K 3.9710 7.5879 117.7004 59.2870 32.2927 178.9519 34 L 4.1353 8.1250 119.5043 58.0013 41.5396 179.2236 35 E 4.1369 8.4506 118.5682 59.8968 29.2753 179.5849 36 E 4.0223 8.1474 116.6693 58.8445 29.4999 178.5842 37 R 4.4900 7.8273 116.2322 56.0061 30.4493 177.3434 38 G 3.8531 8.5017 108.8879 45.2183 0.0000 174.9449 39 F 4.3293 7.8321 118.9622 56.3346 37.4013 174.8681 40 D 4.7449 7.9814 120.5499 53.0277 40.6331 177.4047 41 K 4.4987 7.3026 118.4974 53.5744 36.2934 176.8276 42 A 4.0181 8.8388 124.2865 55.5421 18.1512 180.0095 43 Y 4.0625 7.7195 115.5105 59.9588 38.1208 178.6371 44 V 3.7096 7.2441 120.6728 65.7484 31.5056 178.1945 45 V 3.7853 7.8118 117.7794 65.8079 31.5585 177.3712 46 L 3.9494 8.3507 120.6973 58.1929 41.7508 179.0701 47 G 3.7906 8.3843 105.7515 48.0840 0.0000 175.3687 48 Q 3.7936 7.9188 121.8735 58.6042 28.9588 177.7707 49 F 4.0659 8.3770 121.8871 61.5358 39.1910 177.1926 50 L 3.9305 8.1625 118.3590 57.5930 41.2824 179.5414 51 V 3.6047 7.8869 117.4735 65.2431 31.6127 176.9307 52 L 4.4638 7.7212 117.7015 53.2343 41.7759 176.6440 53 K 3.7769 8.6515 116.8397 57.8814 30.1270 175.4624 54 K 2.4800 7.8536 112.9615 56.6036 30.6481 175.6719 55 D 4.4650 7.8425 119.2064 53.7858 41.8890 175.9950 56 E 3.1511 8.8229 127.7792 59.4116 29.6974 178.3427 57 D 4.3067 7.9511 118.1665 57.5168 40.8748 178.8427 58 L 4.0793 8.7636 119.8162 57.6016 41.5522 179.3963 59 F 4.3625 8.4812 120.6621 61.5754 39.4844 177.5372 60 R 3.8120 8.3747 117.8882 59.0385 29.6975 178.7585 61 E 3.8707 8.2609 119.3386 58.9497 29.6900 178.5706 62 W 4.0002 8.4447 128.8804 60.2342 30.5850 177.7662 63 L 2.9192 7.7398 120.3724 57.4852 41.4280 178.6373 64 K 3.8897 7.7550 119.5138 59.8704 31.9122 178.4447 65 D 4.2037 7.8817 117.7139 57.3868 40.6998 178.4676 66 T 3.9717 6.9995 115.4433 65.0275 68.6442 175.4366 67 C 4.5530 7.3172 111.6373 56.8016 30.7669 173.8233 68 G 3.7646 8.2569 107.1851 46.5809 0.0000 174.5152 69 A 4.1608 7.8156 121.3101 51.6745 19.1389 178.6373 70 N 4.7229 9.4294 119.5304 51.2915 40.7339 176.0587 71 A 3.9390 8.3776 120.9684 55.4845 18.2067 179.6497 72 K 3.9211 8.0055 117.3882 59.7242 32.3737 178.9068 73 Q 3.9927 9.0674 118.9347 59.0324 28.6000 178.9519 74 S 4.2082 8.3626 115.5584 61.2681 63.0238 176.5289 75 R 4.0184 8.1563 122.4311 59.4021 29.8443 178.2677 76 D 4.3988 8.4482 118.9922 57.4934 40.8340 178.3729 77 C 4.4074 8.2235 120.6406 61.7513 31.5541 175.3108 78 F 4.2728 8.8275 122.6324 61.4223 39.0793 177.2815 79 G 3.6234 8.5062 105.4337 47.8071 0.0000 175.0273 80 C 4.0622 8.0239 120.8554 62.5090 31.6668 175.8313 81 L 3.8175 7.5571 120.3935 57.3227 40.9147 179.5586 82 R 3.8346 7.5955 119.0740 59.5535 30.0860 178.4834 83 E 3.9473 8.1917 118.3590 59.0469 29.3259 179.1703 84 W 4.1535 8.3564 128.4554 60.7413 30.7201 177.8825 85 C 4.3749 8.5705 116.6854 63.0914 27.4118 175.7728 86 D 4.2650 8.1512 119.2075 57.1156 40.3980 178.2316 87 A 3.7602 7.2876 120.0193 53.2105 18.8891 177.8437 88 F 4.4801 7.3475 112.2698 56.4927 41.0210 174.8781 89 L 4.2456 7.8571 127.9419 55.1073 41.8243 175.8808 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 T 8.16 4.30 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 1.22 0.00 0.00 3 T 7.60 4.12 4.13 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 1.04 0.00 0.00 4 S 8.39 4.45 0.00 4.10 4.05 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 5 Q 8.63 4.02 0.00 2.21 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.92 0.00 0.00 0.00 0.00 0.00 2.46 2.56 0.00 6 K 8.11 3.98 0.00 1.87 1.88 0.00 1.73 0.00 0.00 1.87 0.00 0.00 3.08 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.57 1.53 7.81 7 H 8.22 4.17 0.00 3.31 3.58 0.00 5.79 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 8 R 8.15 4.02 0.00 2.11 2.03 0.00 3.23 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.95 0.00 9 D 8.31 4.45 0.00 2.72 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 10 F 8.29 4.24 0.00 3.16 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 V 8.15 4.17 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 0.92 0.00 0.00 0.96 0.00 0.00 12 A 7.72 4.44 1.42 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 0.00 0.00 13 E 7.24 4.33 0.00 1.89 1.82 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 2.26 2.20 0.00 14 P 0.00 4.46 0.00 1.92 1.92 0.00 3.43 0.00 0.00 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.44 0.00 *16 G 7.99 4.04 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 0.00 0.00 0.00 17 E 8.91 4.64 0.00 2.00 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 2.31 2.30 0.00 18 K 7.98 3.98 0.00 1.90 1.86 0.00 1.54 0.00 0.00 1.98 0.00 0.00 2.93 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.57 1.44 7.81 19 P 0.00 4.83 0.00 2.22 2.19 0.00 3.75 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.97 0.00 20 V 8.35 3.66 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 0.74 0.00 0.00 0.97 0.00 0.00 21 G 7.96 3.76 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 S 7.94 4.35 0.00 4.16 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 23 L 7.63 3.42 0.00 1.69 1.34 0.83 -0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 24 A 8.12 4.25 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 25 G 8.80 3.99 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 0.00 0.00 0.00 0.00 0.00 0.00 26 I 7.27 4.12 2.02 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.89 0.91 0.00 0.00 27 G 7.86 3.92 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 0.00 0.00 0.00 0.00 0.00 0.00 28 E 8.69 3.98 0.00 2.10 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 2.40 1.95 0.00 29 V 7.66 3.54 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 1.04 0.00 0.00 0.91 0.00 0.00 30 L 7.90 4.04 0.00 1.68 1.62 0.89 0.82 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 31 G 8.42 3.66 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 0.00 0.00 0.00 32 K 8.29 4.06 0.00 1.98 1.94 0.00 1.76 0.00 0.00 1.65 0.00 0.00 2.89 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.44 1.36 7.81 33 K 7.59 3.97 0.00 1.80 1.78 0.00 1.84 0.00 0.00 1.63 0.00 0.00 2.99 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.44 1.59 7.81 34 L 8.12 4.14 0.00 1.86 1.96 0.89 0.75 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 35 E 8.45 4.14 0.00 2.13 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 2.36 2.68 0.00 36 E 8.15 4.02 0.00 2.09 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 2.35 2.70 0.00 37 R 7.83 4.49 0.00 2.25 2.24 0.00 3.36 0.00 0.00 3.28 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.78 0.00 38 G 8.50 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 0.00 0.00 0.00 39 F 7.83 4.33 0.00 3.27 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 40 D 7.98 4.74 0.00 2.74 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 41 K 7.30 4.50 0.00 0.79 1.08 0.00 1.89 0.00 0.00 1.75 0.00 0.00 2.89 0.00 0.00 3.40 0.00 0.00 0.00 0.00 1.21 1.13 7.81 42 A 8.84 4.02 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 43 Y 7.72 4.06 0.00 3.15 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 44 V 7.24 3.71 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 0.89 0.00 0.00 0.62 0.00 0.00 45 V 7.81 3.79 2.31 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 1.40 0.00 0.00 1.18 0.00 0.00 46 L 8.35 3.95 0.00 1.63 1.76 0.98 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 47 G 8.38 3.79 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 0.00 0.00 0.00 48 Q 7.92 3.79 0.00 1.87 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.70 0.00 0.00 0.00 0.00 0.00 1.16 1.39 0.00 49 F 8.38 4.07 0.00 2.53 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 50 L 8.16 3.93 0.00 1.90 1.70 1.03 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 51 V 7.89 3.60 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 0.81 0.00 0.00 0.97 0.00 0.00 52 L 7.72 4.46 0.00 1.91 1.66 1.01 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 53 K 8.65 3.78 0.00 1.79 1.80 0.00 1.83 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.34 1.34 7.81 54 K 7.85 2.48 0.00 1.63 1.47 0.00 1.65 0.00 0.00 1.66 0.00 0.00 3.05 0.00 0.00 2.90 0.00 0.00 0.00 0.00 0.71 1.04 7.81 55 D 7.84 4.46 0.00 2.80 2.63 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 56 E 8.82 3.15 0.00 1.43 1.66 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 1.94 1.47 0.00 57 D 7.95 4.31 0.00 2.85 2.69 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.76 4.08 0.00 1.72 1.79 0.94 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 59 F 8.48 4.36 0.00 3.44 3.43 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 60 R 8.37 3.81 0.00 1.91 1.93 0.00 3.01 0.00 0.00 2.92 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.80 0.00 61 E 8.26 3.87 0.00 2.15 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 2.29 2.30 0.00 62 W 8.44 4.00 0.00 3.44 3.30 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 63 L 7.74 2.92 0.00 1.48 1.49 0.66 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 64 K 7.76 3.89 0.00 1.75 1.83 0.00 1.63 0.00 0.00 1.58 0.00 0.00 2.88 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.33 1.40 7.81 65 D 7.88 4.20 0.00 2.57 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 7.00 3.97 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 0.72 0.00 0.00 67 C 7.32 4.55 0.00 2.84 2.69 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.26 3.76 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 A 7.82 4.16 1.13 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 0.00 0.00 70 N 9.43 4.72 0.00 2.93 2.95 0.00 0.00 6.95 7.91 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 71 A 8.38 3.94 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 72 K 8.01 3.92 0.00 1.88 1.94 0.00 1.63 0.00 0.00 1.83 0.00 0.00 3.06 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.51 1.60 7.81 73 Q 9.07 3.99 0.00 2.19 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.58 0.00 0.00 0.00 0.00 0.00 2.36 2.55 0.00 74 S 8.36 4.21 0.00 4.01 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 75 R 8.16 4.02 0.00 2.05 2.22 0.00 3.31 0.00 0.00 3.26 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.87 0.00 76 D 8.45 4.40 0.00 2.96 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 77 C 8.22 4.41 0.00 3.23 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 78 F 8.83 4.27 0.00 3.62 3.47 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.51 3.62 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 0.00 0.00 0.00 80 C 8.02 4.06 0.00 3.15 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 81 L 7.56 3.82 0.00 0.48 0.28 0.41 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 82 R 7.60 3.83 0.00 1.20 1.74 0.00 3.17 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.69 0.00 83 E 8.19 3.95 0.00 2.29 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 2.34 2.34 0.00 84 W 8.36 4.15 0.00 3.73 3.43 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 85 C 8.57 4.37 0.00 3.39 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 86 D 8.15 4.26 0.00 2.72 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 87 A 7.29 3.76 0.33 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 88 F 7.35 4.48 0.00 1.51 2.37 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 89 L 7.86 4.25 0.00 1.76 1.80 1.07 1.06 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 * Residues marked with a * may have inaccurate shift predictions.