NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -1 N 5.2303 8.6604 118.5998 53.7893 40.8780 173.7481 0 A 4.7356 8.1539 123.6727 51.2439 19.9188 174.2676 2 K 4.6608 9.1903 114.4470 55.3876 37.5539 174.7805 3 V 4.3807 9.0387 125.1652 63.3180 31.0084 175.6789 4 T 4.4532 8.9880 119.2649 62.4055 69.8657 174.4103 5 D 4.7685 7.6751 121.2070 53.1232 44.9351 173.7901 6 V 4.8332 8.3344 123.7822 61.2291 34.7577 174.4040 7 R 4.7280 9.1971 126.9844 54.3141 32.7515 174.6367 8 L 5.2111 8.5140 124.9448 53.2548 45.7483 175.2043 9 R 4.5972 8.9257 125.7352 54.2748 32.6907 174.7248 10 K 4.7358 8.8085 126.0863 56.5262 33.0527 176.4158 11 I 4.6488 8.5744 124.8675 59.4464 39.7239 175.0682 12 Q 4.4611 8.2922 124.4730 54.9775 29.8504 174.6423 13 T 4.1402 7.7304 115.2979 61.6207 69.8878 172.3299 14 D 4.4470 8.8101 123.8354 56.2452 41.1182 177.1895 15 G 3.8414 8.3773 108.4696 45.5244 0.0000 174.4742 16 R 4.2121 8.0176 118.5845 54.9047 27.7493 177.7370 *18 K 4.3846 7.9897 119.3420 55.9659 35.4750 176.1279 19 A 4.9304 7.5188 118.1350 50.9774 23.2441 174.7785 20 L 5.0264 8.5664 122.5678 53.3980 44.7312 175.5502 21 V 4.9477 8.8795 125.0157 61.3279 35.4871 173.9863 22 S 5.3742 9.3870 123.5353 56.6567 65.9889 173.1438 23 I 4.9955 8.8149 117.0520 59.3993 41.1361 174.2702 24 T 5.0314 8.7813 119.7321 61.8644 71.8597 172.8751 25 L 4.9853 9.2558 126.2120 53.8882 43.9610 176.6964 26 D 4.4375 9.7997 124.4734 55.7214 39.1049 173.6163 27 E 3.8837 8.3397 112.5564 57.1379 27.8126 175.8057 28 A 4.6956 8.4268 120.1395 51.9152 22.2537 177.1985 29 F 4.7713 8.0470 117.4098 56.5340 42.9841 173.4820 30 V 4.7969 7.5819 125.0201 61.0841 33.9417 174.5150 31 I 4.5506 8.6039 127.4156 59.9289 40.3796 174.6650 32 H 5.0174 8.7103 123.0997 53.6859 31.6500 173.8305 33 D 4.4801 8.7041 115.8357 55.4105 38.1286 174.2787 34 L 4.5685 7.6557 118.5503 55.1684 43.2684 176.5269 35 R 4.9284 8.5756 119.2154 54.5601 34.6481 174.5605 36 V 4.0864 8.5714 124.5541 62.2544 32.8736 174.6754 37 I 4.4793 8.0801 128.7678 59.1613 40.4462 174.6082 38 E 4.3048 9.0363 128.7338 55.7350 29.7442 176.4376 39 G 4.2363 8.7728 117.3328 43.7437 0.0000 172.9324 40 N 4.3273 8.7242 117.0482 56.0075 38.9241 175.4958 41 S 4.5546 8.0208 111.5917 57.8998 63.4478 172.2040 42 G 3.8353 7.6358 107.2267 43.3396 0.0000 173.4781 43 L 4.7724 8.1843 119.3472 54.9150 42.4320 176.7152 44 F 4.9123 8.7396 116.5700 55.9604 42.2374 172.7890 45 V 4.4998 9.2377 119.5650 61.4524 32.5194 174.8382 46 A 4.8021 8.6674 134.3819 50.5465 22.1771 173.2028 *48 P 4.8963 0.0000 0.0000 63.3431 33.2211 176.0268 49 S 4.9743 8.6631 117.3828 56.5633 65.0474 172.5003 50 K 4.5797 9.1287 130.2361 54.5842 33.6189 175.6499 51 R 4.0238 8.7574 128.6210 56.6902 30.9800 175.9338 52 T 4.5422 8.4639 116.7284 59.6840 71.0214 173.7910 53 P 4.4406 0.0000 0.0000 64.2303 31.4364 176.1814 54 D 4.6996 7.9685 117.7827 54.1412 41.3626 176.3538 55 G 3.7725 8.0469 103.7718 44.9256 0.0000 173.4369 56 E 4.7633 7.7193 120.1514 54.4734 32.8311 174.5862 57 F 5.1986 8.6102 116.8160 56.3646 43.3275 174.7928 58 R 4.7186 9.0366 120.4628 54.4436 33.3159 174.5287 59 D 5.0569 8.8829 124.3815 54.3676 40.8618 176.6091 60 I 4.2022 8.8862 125.3290 63.2438 38.0246 176.5243 61 A 4.7309 7.7978 122.9324 51.2167 21.9938 174.8645 62 H 4.9194 8.4075 117.9693 53.2873 33.0099 171.8684 63 P 4.4844 0.0000 0.0000 63.0392 31.7374 176.1131 64 I 4.5271 8.2477 112.0082 60.3482 38.1461 174.2922 65 N 5.0624 7.7055 116.6440 51.3363 40.5277 174.3434 66 S 4.2045 8.6571 113.1070 61.7000 62.8980 176.3348 67 D 4.5242 7.7543 115.4669 55.3300 40.3638 178.0010 *69 R 4.2141 8.1129 121.2076 56.4926 31.8492 177.4366 70 Q 4.0091 8.3321 118.6094 58.9514 28.8562 177.6575 71 E 3.9408 8.4098 120.5922 59.2595 29.6756 178.8695 72 I 3.7060 7.7043 119.2354 64.4655 37.0427 178.1851 73 Q 3.9798 7.6964 116.9302 59.1234 28.6890 178.3426 74 D 4.5181 8.3255 118.3671 57.5061 40.7050 178.5662 75 A 4.2092 8.3674 121.5557 54.9768 18.2400 179.3877 76 V 3.7462 7.6358 114.8948 63.4960 31.3338 177.6972 *78 K 4.2058 7.9590 119.5869 56.0001 33.8532 178.0008 79 V 3.7938 7.5394 116.9531 65.9850 31.3699 177.0754 80 Y 3.9874 8.3760 119.7638 61.1521 38.3919 178.1874 81 D 4.5053 7.6366 117.6036 56.7279 41.0310 177.7728 82 E 4.2228 7.7190 117.2512 56.4855 30.0075 176.3515 83 T 4.3915 6.8549 116.6974 61.5329 69.9657 174.5481 84 D 4.4631 8.6128 124.7134 54.7728 40.7735 176.2897 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 -1 N 8.66 5.23 0.00 2.70 2.80 0.00 0.00 6.76 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 0 A 8.15 4.74 1.17 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 2 K 9.19 4.66 0.00 1.88 1.66 0.00 1.56 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.35 1.40 7.81 3 V 9.04 4.38 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 0.84 0.00 0.00 0.95 0.00 0.00 4 T 8.99 4.45 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 1.30 0.00 0.00 5 D 7.68 4.77 0.00 2.78 2.48 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.33 4.83 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 0.90 0.00 0.00 0.95 0.00 0.00 7 R 9.20 4.73 0.00 1.72 1.80 0.00 3.29 0.00 0.00 3.21 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00 8 L 8.51 5.21 0.00 1.62 1.49 1.08 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 9 R 8.93 4.60 0.00 1.88 1.73 0.00 3.14 0.00 0.00 3.16 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.56 0.00 10 K 8.81 4.74 0.00 1.64 1.70 0.00 1.73 0.00 0.00 1.54 0.00 0.00 2.13 0.00 0.00 2.36 0.00 0.00 0.00 0.00 1.35 1.30 7.81 11 I 8.57 4.65 1.88 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 1.29 0.61 0.91 0.00 0.00 12 Q 8.29 4.46 0.00 2.14 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.91 0.00 0.00 0.00 0.00 0.00 2.24 2.32 0.00 13 T 7.73 4.14 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 14 D 8.81 4.45 0.00 2.71 2.71 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 15 G 8.38 3.84 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 0.00 0.00 0.00 16 R 8.02 4.21 0.00 1.74 1.97 0.00 3.16 0.00 0.00 3.61 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.64 0.00 *18 K 7.99 4.38 0.00 1.62 2.05 0.00 1.78 0.00 0.00 1.84 0.00 0.00 2.81 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.56 1.36 7.81 19 A 7.52 4.93 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 20 L 8.57 5.03 0.00 1.78 1.52 1.04 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 21 V 8.88 4.95 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 0.94 0.00 0.00 0.95 0.00 0.00 22 S 9.39 5.37 0.00 3.76 3.68 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 23 I 8.81 5.00 1.89 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 1.24 0.82 0.92 0.00 0.00 24 T 8.78 5.03 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 1.28 0.00 0.00 25 L 9.26 4.99 0.00 1.66 1.62 0.97 1.07 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 26 D 9.80 4.44 0.00 2.74 2.71 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 27 E 8.34 3.88 0.00 2.14 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 2.26 2.25 0.00 28 A 8.43 4.70 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 29 F 8.05 4.77 0.00 3.03 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 V 7.58 4.80 1.81 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 0.61 0.00 0.00 0.83 0.00 0.00 31 I 8.60 4.55 1.90 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.76 0.95 0.00 0.00 32 H 8.71 5.02 0.00 3.03 3.19 0.00 5.88 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 D 8.70 4.48 0.00 2.90 2.78 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.66 4.57 0.00 1.80 1.57 0.97 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 35 R 8.58 4.93 0.00 1.60 1.65 0.00 3.04 0.00 0.00 3.06 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.69 0.00 36 V 8.57 4.09 1.87 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 0.23 0.00 0.00 0.80 0.00 0.00 37 I 8.08 4.48 0.56 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.44 0.71 0.00 0.00 38 E 9.04 4.30 0.00 1.91 1.86 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 2.32 2.26 0.00 39 G 8.77 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 0.00 0.00 0.00 0.00 40 N 8.72 4.33 0.00 2.68 2.86 0.00 0.00 6.82 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 41 S 8.02 4.55 0.00 3.85 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 42 G 7.64 3.84 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 0.00 0.00 0.00 43 L 8.18 4.77 0.00 1.44 1.35 0.62 0.61 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 44 F 8.74 4.91 0.00 3.15 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 45 V 9.24 4.50 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 0.90 0.00 0.00 46 A 8.67 4.80 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 *48 P 0.00 4.90 0.00 2.19 2.46 0.00 3.78 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.94 0.00 49 S 8.66 4.97 0.00 3.87 3.78 0.00 0.00 0.00 0.00 0.00 0.00 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 K 9.13 4.58 0.00 1.90 1.70 0.00 1.71 0.00 0.00 1.59 0.00 0.00 2.80 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.37 1.39 7.81 51 R 8.76 4.02 0.00 1.82 1.72 0.00 3.26 0.00 0.00 3.20 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.95 0.00 52 T 8.46 4.54 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 1.14 0.00 0.00 53 P 0.00 4.44 0.00 2.17 2.18 0.00 3.67 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.92 0.00 54 D 7.97 4.70 0.00 2.58 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 55 G 8.05 3.77 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 0.00 0.00 0.00 0.00 0.00 0.00 56 E 7.72 4.76 0.00 1.86 1.91 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 2.22 2.21 0.00 57 F 8.61 5.20 0.00 2.92 2.97 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 58 R 9.04 4.72 0.00 1.71 1.83 0.00 3.31 0.00 0.00 3.21 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.72 0.00 59 D 8.88 5.06 0.00 2.66 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 60 I 8.89 4.20 1.92 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.79 0.96 0.00 0.00 61 A 7.80 4.73 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 62 H 8.41 4.92 0.00 3.11 3.16 0.00 5.71 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 P 0.00 4.48 0.00 2.19 2.07 0.00 3.78 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.99 0.00 64 I 8.25 4.53 1.87 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 1.46 0.73 0.92 0.00 0.00 65 N 7.71 5.06 0.00 2.76 2.77 0.00 0.00 6.11 7.64 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 66 S 8.66 4.20 0.00 3.87 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 67 D 7.75 4.52 0.00 3.08 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 *69 R 8.11 4.21 0.00 1.96 2.15 0.00 3.18 0.00 0.00 3.27 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.65 0.00 70 Q 8.33 4.01 0.00 2.28 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.58 0.00 0.00 0.00 0.00 0.00 2.36 2.61 0.00 71 E 8.41 3.94 0.00 2.16 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 2.32 2.41 0.00 72 I 7.70 3.71 1.89 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 1.66 0.41 0.93 0.00 0.00 73 Q 7.70 3.98 0.00 2.22 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.93 0.00 0.00 0.00 0.00 0.00 2.65 2.59 0.00 74 D 8.33 4.52 0.00 2.68 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 75 A 8.37 4.21 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 76 V 7.64 3.75 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.97 0.00 0.00 *78 K 7.96 4.21 0.00 1.98 2.07 0.00 1.79 0.00 0.00 1.76 0.00 0.00 2.84 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.54 1.46 7.81 79 V 7.54 3.79 2.24 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 0.95 0.00 0.00 1.02 0.00 0.00 80 Y 8.38 3.99 0.00 3.04 2.98 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 0.00 0.00 0.00 81 D 7.64 4.51 0.00 2.78 2.76 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 82 E 7.72 4.22 0.00 2.04 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 2.33 2.46 0.00 83 T 6.85 4.39 4.11 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 1.08 0.00 0.00 84 D 8.61 4.46 0.00 2.61 2.54 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 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.