NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -1 T 4.3526 8.1749 110.9368 61.9258 69.8865 172.7792 1 C 4.4010 8.9574 121.6523 57.7626 42.3985 173.2147 2 Y 4.0017 8.0640 122.8669 56.2302 37.6175 175.5949 3 E 4.2180 8.0919 125.2309 56.2445 28.8078 177.7826 4 G 4.0801 8.2950 113.3414 44.4330 0.0000 172.7227 5 N 4.6136 8.0222 118.2224 51.0448 40.6620 170.6010 6 G 3.6659 7.9995 113.6583 44.8918 0.0000 172.2163 7 H 4.3043 7.1569 123.4626 56.2956 29.1213 175.3999 8 F 4.6528 7.1507 115.6128 56.1554 38.6912 177.0748 9 Y 3.8558 7.7559 123.6238 59.2506 36.2618 175.0520 10 R 3.4249 7.3164 114.0364 56.9750 27.1861 176.3716 11 G 4.1819 7.9800 118.3928 44.3698 0.0000 172.7463 12 K 3.7231 7.4588 120.4199 54.1997 31.7072 174.4109 13 A 4.6077 7.4900 122.7297 50.5239 22.0366 177.0842 14 S 5.2653 9.1034 119.6260 57.0942 63.9494 174.4033 15 T 4.8074 7.8524 111.3261 61.8050 70.9223 172.8540 16 D 4.8648 8.9999 127.2740 51.3121 41.7254 177.5250 17 T 3.8320 8.6146 110.1645 65.4604 68.3289 174.8819 18 M 4.2411 8.4126 120.0306 54.8329 31.7542 176.4504 19 G 4.0499 8.1592 104.3931 46.5727 0.0000 173.8322 20 R 4.4890 7.4400 116.5250 53.0560 31.3852 174.3890 21 P 5.2775 0.0000 0.0000 62.7942 31.8978 176.4664 22 C 4.8677 8.7087 123.7892 56.0811 42.4083 172.0330 23 L 4.6973 7.6002 123.3041 52.8306 43.7791 173.3867 24 P 4.6691 0.0000 0.0000 62.9289 31.2651 177.0844 25 W 3.9087 9.2668 124.3028 59.1483 30.0770 177.9285 26 N 4.8504 8.2192 113.9706 52.8450 36.9848 175.1997 27 S 4.1766 7.5745 114.2660 58.2719 63.6080 175.1655 28 A 3.8396 8.3946 124.5747 55.2188 18.2659 179.7574 *30 T 4.4056 7.8956 111.4482 63.6896 70.6398 176.5270 31 V 3.2665 7.7900 120.9234 65.4513 31.6402 177.6240 32 L 4.0569 7.8883 121.0937 57.8495 42.0018 178.0980 33 Q 4.1258 7.4164 114.9646 58.6318 29.6097 178.0217 34 Q 4.3181 7.9229 120.3307 55.9123 28.5357 176.0153 35 T 4.2251 8.4663 109.6249 63.6749 70.1178 173.8635 36 Y 4.8723 7.5048 118.4285 56.3178 38.9387 173.7412 37 H 5.0977 7.9392 119.3246 54.1409 31.9881 174.0173 *39 A 4.4591 8.3447 120.4631 52.2951 20.2392 177.6527 40 H 4.2502 8.1231 114.6121 58.9738 30.1844 175.8605 41 R 4.2240 8.1655 118.8695 55.5471 29.1618 176.8101 42 S 4.1176 9.0050 120.7888 61.9368 62.6747 176.6191 43 D 4.3978 8.1749 120.9015 56.0565 39.2996 177.9930 44 A 4.0341 8.1534 122.4515 55.3599 18.4421 179.6691 44A L 4.5915 7.8206 117.9126 57.5444 41.6303 179.1020 44B Q 4.1691 7.6245 116.6073 57.7753 29.0968 176.6732 44C L 4.5285 8.5437 120.0184 54.6473 42.7820 177.3546 45 G 4.9289 6.6032 119.7705 46.3126 0.0000 171.9884 46 L 4.5147 7.1391 121.3359 53.6678 43.6622 177.0421 47 G 4.0297 8.3845 105.6251 45.5301 0.0000 173.7861 48 K 3.8445 8.3222 112.3345 57.0866 30.5266 176.0104 48A H 4.8103 7.3894 114.1733 55.3451 30.8690 173.5412 49 N 5.6099 7.9419 111.1803 51.5252 38.2723 173.3112 50 Y 5.3958 8.2189 114.1926 56.4040 43.1246 175.4407 51 C 5.1641 9.0473 116.8042 56.1899 41.5070 172.8962 52 R 4.2097 7.9323 125.3107 55.1200 32.9037 174.6958 53 N 4.5930 7.8707 112.9045 53.1361 38.8747 175.5304 54 P 4.1034 0.0000 0.0000 64.2344 31.2182 176.0046 55 D 4.4680 8.6908 114.6786 52.4417 43.9936 174.4095 56 N 4.9942 7.6181 129.4199 53.7535 40.9053 175.2903 57 R 4.0691 7.4805 118.6385 55.2684 31.4190 177.0009 58 R 3.8877 8.5199 122.4497 58.6810 30.4092 176.6585 56 R 4.5942 7.4481 131.2199 56.6535 32.9053 176.3903 57 P 4.1491 0.0000 0.0000 62.5684 32.6190 178.0009 58 W 4.2077 8.5399 123.2497 60.1810 29.1092 176.4585 63 C 5.0238 8.7227 116.6801 56.5805 45.5335 172.1337 64 Y 5.1478 8.2491 119.3913 56.7637 40.3018 175.3970 65 V 4.4968 8.6522 121.5465 60.8808 34.3748 174.5352 66 Q 4.2519 8.7833 127.5593 56.3745 29.4495 176.9632 66A V 4.0347 8.4135 124.5032 61.3404 33.1008 175.2140 67 G 3.9338 9.2093 118.9238 46.7005 0.0000 171.1950 68 L 3.5941 7.8421 110.4269 55.8124 41.1060 174.4872 69 K 4.5157 7.4182 117.1627 53.4009 33.5793 171.4197 70 P 4.8799 0.0000 0.0000 62.1621 32.2222 175.4303 71 L 4.9097 8.7064 124.8576 52.7346 45.2475 176.1853 72 V 4.9981 8.4570 123.8750 62.3492 32.7515 175.2747 73 Q 4.6107 8.5493 125.4025 54.2061 33.1082 174.4436 74 E 4.5387 8.9777 123.1087 56.7092 31.0222 176.5250 75 C 4.9574 8.6110 121.1649 55.4141 45.2485 172.7234 76 M 4.4321 8.3996 121.7471 56.0995 32.2387 177.4969 77 V 4.0961 7.5238 113.6582 61.1499 33.6569 176.0724 78 H 4.6144 8.7473 114.5829 56.3897 27.4174 176.1663 79 D 4.6416 7.9824 118.1089 53.9383 40.7065 176.8046 80 C 3.8842 8.0521 117.5489 57.7945 36.9865 173.0412 81 A 4.3452 7.6708 130.2217 51.2659 18.1141 177.7038 82 D 4.5288 7.7401 125.4510 54.5531 40.8853 177.2801 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 T 8.17 4.35 4.21 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 1.20 0.00 0.00 1 C 8.96 4.40 0.00 3.16 3.12 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 0.00 0.00 0.00 0.00 2 Y 8.06 4.00 0.00 3.13 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 3 E 8.09 4.22 0.00 1.81 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 0.00 2.25 2.28 0.00 4 G 8.30 4.08 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 0.00 0.00 0.00 5 N 8.02 4.61 0.00 2.57 3.01 0.00 0.00 7.26 7.68 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 6 G 8.00 3.67 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 0.00 0.00 0.00 7 H 7.16 4.30 0.00 3.21 3.41 0.00 5.52 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 F 7.15 4.65 0.00 3.10 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 9 Y 7.76 3.86 0.00 2.86 3.02 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 0.00 0.00 0.00 10 R 7.32 3.42 0.00 1.92 2.22 0.00 3.32 0.00 0.00 3.18 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.47 0.00 11 G 7.98 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 K 7.46 3.72 0.00 1.51 1.45 0.00 0.71 0.00 0.00 1.09 0.00 0.00 2.78 0.00 0.00 2.75 0.00 0.00 0.00 0.00 0.75 1.12 7.81 13 A 7.49 4.61 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 14 S 9.10 5.27 0.00 4.15 4.41 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 15 T 7.85 4.81 4.29 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 1.26 0.00 0.00 16 D 9.00 4.86 0.00 3.29 2.93 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 17 T 8.61 3.83 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 1.28 0.00 0.00 18 M 8.41 4.24 0.00 2.13 2.08 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.50 0.00 19 G 8.16 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 0.00 0.00 0.00 20 R 7.44 4.49 0.00 2.10 1.98 0.00 3.16 0.00 0.00 3.24 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.56 0.00 21 P 0.00 5.28 0.00 2.18 2.15 0.00 3.38 0.00 0.00 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.93 0.00 22 C 8.71 4.87 0.00 3.12 3.18 0.00 0.00 0.00 0.00 0.00 0.00 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 7.60 4.70 0.00 1.61 1.61 0.81 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 24 P 0.00 4.67 0.00 1.82 2.06 0.00 3.54 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.91 0.00 25 W 9.27 3.91 0.00 3.21 3.36 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 26 N 8.22 4.85 0.00 2.87 2.99 0.00 0.00 6.05 7.67 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 27 S 7.57 4.18 0.00 3.85 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 28 A 8.39 3.84 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 *30 T 7.90 4.41 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 1.15 0.00 0.00 31 V 7.79 3.27 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 0.71 0.00 0.00 0.29 0.00 0.00 32 L 7.89 4.06 0.00 1.55 1.68 0.66 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 33 Q 7.42 4.13 0.00 2.18 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.54 0.00 0.00 0.00 0.00 0.00 2.37 2.24 0.00 34 Q 7.92 4.32 0.00 1.83 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.73 0.00 0.00 0.00 0.00 0.00 2.09 2.34 0.00 35 T 8.47 4.23 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 0.69 0.00 0.00 36 Y 7.50 4.87 0.00 3.84 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 37 H 7.94 5.10 0.00 3.41 3.63 0.00 5.68 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *39 A 8.34 4.46 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 40 H 8.12 4.25 0.00 3.08 3.42 0.00 5.77 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 41 R 8.17 4.22 0.00 2.24 2.18 0.00 3.12 0.00 0.00 3.60 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.10 0.00 42 S 9.00 4.12 0.00 3.90 4.02 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 0.00 0.00 0.00 43 D 8.17 4.40 0.00 2.92 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 44 A 8.15 4.03 1.48 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 0.00 0.00 44A L 7.82 4.59 0.00 1.85 1.83 1.08 0.95 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 44B Q 7.62 4.17 0.00 2.23 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.85 0.00 0.00 0.00 0.00 0.00 2.40 2.38 0.00 44C L 8.54 4.53 0.00 1.66 1.86 0.94 1.40 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 45 G 6.60 4.93 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 46 L 7.14 4.51 0.00 1.57 1.21 0.52 -0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 47 G 8.38 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 0.00 0.00 0.00 48 K 8.32 3.84 0.00 1.91 2.07 0.00 1.79 0.00 0.00 1.80 0.00 0.00 2.88 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.41 1.45 7.81 48A H 7.39 4.81 0.00 3.78 3.70 0.00 5.40 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 N 7.94 5.61 0.00 1.67 2.32 0.00 0.00 7.22 7.40 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 50 Y 8.22 5.40 0.00 3.00 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 C 9.05 5.16 0.00 3.07 3.20 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 0.00 0.00 0.00 0.00 52 R 7.93 4.21 0.00 1.17 1.52 0.00 3.41 0.00 0.00 3.14 7.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.03 0.00 53 N 7.87 4.59 0.00 2.74 2.71 0.00 0.00 7.01 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 54 P 0.00 4.10 0.00 1.98 1.98 0.00 2.20 0.00 0.00 2.40 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 55 D 8.69 4.47 0.00 2.31 2.33 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 56 N 7.62 4.99 0.00 2.83 2.89 0.00 0.00 7.21 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 57 R 7.48 4.07 0.00 1.57 1.89 0.00 2.42 0.00 0.00 3.07 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.42 0.00 58 R 8.52 3.89 0.00 1.90 1.96 0.00 3.21 0.00 0.00 3.35 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.68 0.00 56 R 7.45 4.59 0.00 1.86 1.90 0.00 2.21 0.00 0.00 2.25 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.30 0.00 57 P 0.00 4.15 0.00 2.00 2.07 0.00 2.85 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.81 0.00 58 W 8.54 4.21 0.00 3.33 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 63 C 8.72 5.02 0.00 3.28 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 64 Y 8.25 5.15 0.00 2.78 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 65 V 8.65 4.50 2.27 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 1.01 0.00 0.00 1.06 0.00 0.00 66 Q 8.78 4.25 0.00 1.93 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.56 6.74 0.00 0.00 0.00 0.00 0.00 2.31 2.23 0.00 66A V 8.41 4.03 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 0.94 0.00 0.00 0.98 0.00 0.00 67 G 9.21 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 68 L 7.84 3.59 0.00 1.75 1.73 0.90 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 69 K 7.42 4.52 0.00 1.99 1.61 0.00 1.69 0.00 0.00 1.66 0.00 0.00 2.89 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.34 1.41 7.81 70 P 0.00 4.88 0.00 2.15 1.94 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 2.05 0.00 71 L 8.71 4.91 0.00 1.62 1.73 0.95 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 72 V 8.46 5.00 1.93 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 0.83 0.00 0.00 0.50 0.00 0.00 73 Q 8.55 4.61 0.00 2.19 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.76 0.00 0.00 0.00 0.00 0.00 2.37 2.46 0.00 74 E 8.98 4.54 0.00 1.95 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 2.44 2.33 0.00 75 C 8.61 4.96 0.00 3.28 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 76 M 8.40 4.43 0.00 2.05 2.06 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.57 0.00 77 V 7.52 4.10 2.40 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 0.82 0.00 0.00 1.12 0.00 0.00 78 H 8.75 4.61 0.00 2.90 2.95 0.00 5.61 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 D 7.98 4.64 0.00 2.84 2.89 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 80 C 8.05 3.88 0.00 3.18 3.28 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 81 A 7.67 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 82 D 7.74 4.53 0.00 2.68 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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.