NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3078 8.2531 123.5813 51.4411 21.5005 176.7517 3 G 3.8824 8.0428 103.1947 44.4307 0.0000 173.7651 4 K 4.5231 8.5687 125.9046 53.7116 35.2194 174.1325 5 A 4.2013 8.6183 124.1881 52.7306 18.8817 176.9783 6 H 4.8724 8.3054 116.5220 53.3426 31.6817 174.1737 7 R 4.2238 8.5052 124.0652 56.2675 30.5030 176.1135 8 L 4.3532 8.9066 126.9896 55.5371 42.3447 177.4525 9 S 4.4991 9.6541 117.9102 57.5428 64.6396 175.0426 10 A 4.0741 8.7728 122.4683 55.4882 17.6134 180.1100 11 E 3.9125 8.0608 116.6305 59.6134 29.6893 179.1474 12 E 3.9721 8.0083 118.1113 59.4849 29.5440 179.5463 13 R 3.9111 8.3658 118.5369 59.4183 29.9257 178.6633 14 D 4.4707 8.1151 118.6987 56.9560 41.2907 177.7730 15 Q 4.5704 7.5115 118.1681 56.9963 29.4082 180.7000 16 L 4.7926 7.7213 117.5006 56.5882 43.9830 178.3582 17 L 4.0913 7.9587 119.0033 56.9704 41.4867 177.3067 18 P 4.2419 0.0000 0.0000 66.0846 30.5984 178.2439 19 N 4.3563 8.1663 114.2233 56.2392 38.4225 177.3085 20 L 4.4409 7.8086 119.9880 57.6976 41.9013 179.4043 21 R 4.7685 8.6161 119.3173 58.5964 29.7236 178.5796 22 A 4.0662 7.9845 120.1535 54.3932 18.3486 178.5554 23 V 4.2720 7.3397 109.9529 61.3511 32.2050 177.0457 24 G 3.8118 8.1967 109.2539 44.6473 0.0000 174.8425 25 W 4.4373 8.1861 120.3669 56.5904 30.5490 175.2462 26 N 5.1856 8.5133 119.4388 51.4292 42.7489 173.4061 27 E 4.8571 8.6386 120.7763 55.7511 30.5949 176.4277 28 L 4.5986 9.0107 126.5471 54.9812 43.2503 175.7089 29 E 4.2989 8.8383 124.9997 56.4207 30.4396 176.2650 30 G 3.8978 10.0481 113.7744 45.6787 0.0000 172.7982 31 R 4.2932 7.4305 114.5532 55.3443 32.7118 174.4700 32 D 4.5835 8.3729 124.9644 53.2456 40.0228 174.2528 33 A 4.8102 7.8331 125.0558 50.7392 22.9054 174.4772 34 I 5.3151 8.5238 112.9538 59.3651 40.9313 174.6017 35 F 5.8110 9.2105 117.9429 55.9864 42.1056 173.0791 36 K 4.2257 8.6130 118.0604 55.4363 35.7992 173.7459 37 Q 4.6396 8.4004 128.6385 55.1518 30.2435 174.5112 38 F 4.6417 9.0742 124.4116 55.8820 42.6263 174.0026 39 H 5.1593 8.1281 117.6389 54.2212 32.2161 172.5071 40 F 4.8358 9.0479 123.3928 55.9924 42.3767 176.2015 41 K 4.1490 9.0063 120.4517 57.5800 31.6138 173.4545 42 D 4.3616 7.5388 117.5918 50.4476 43.4869 175.4508 43 F 4.5792 7.6707 121.4565 60.8963 39.1491 176.2587 44 N 4.2089 8.2554 115.3878 56.5115 38.2994 177.3250 45 R 3.7209 8.9005 119.1076 59.1227 29.9728 178.6997 46 A 3.1163 7.4588 119.1343 55.2087 18.4147 179.2894 47 F 3.6337 8.1147 117.8864 60.2745 39.5752 177.5104 48 G 3.6400 7.7099 105.9251 47.5287 0.0000 175.9386 49 F 4.1634 7.8249 119.8808 59.1824 39.1562 176.6553 *51 T 4.0428 7.7947 114.7316 63.3160 70.4912 176.3681 52 R 3.8953 7.9490 120.1498 59.4363 30.0073 179.2444 53 V 3.6214 7.7558 117.7208 65.9146 31.3888 177.8456 54 A 3.9473 7.8691 119.9731 55.2035 18.2933 179.4074 55 L 3.8803 7.8876 117.4772 57.9857 41.6681 179.6175 56 Q 3.5816 7.7134 118.8198 58.7221 28.7052 177.8923 57 A 3.8124 7.8002 122.1050 54.8418 18.0562 179.3117 58 E 3.7875 7.6579 117.0524 59.4947 29.8796 178.9318 59 K 4.0052 7.4958 116.6560 59.1015 31.4875 178.6508 60 L 4.1599 7.9961 118.3807 54.2816 41.6324 176.8545 61 D 4.2615 7.9702 116.8101 55.1684 40.0566 172.4825 62 H 4.8567 7.4074 112.2645 53.9812 32.6404 172.0292 63 H 4.6763 8.2932 122.8033 53.0369 31.7755 171.6484 64 P 4.3482 0.0000 0.0000 62.5789 32.8882 175.9240 65 E 4.6812 9.0562 121.5305 54.6527 30.0490 174.8793 66 W 5.8052 8.9712 120.7677 54.4618 31.6646 174.5190 67 F 5.1409 9.6161 123.9321 56.5356 41.7922 173.1226 68 N 5.3031 8.3338 123.8625 51.7749 41.8774 174.0280 69 V 4.0867 8.1836 124.6658 61.5502 34.6854 176.9156 70 Y 3.9321 9.1448 133.0397 58.5709 38.1041 170.5519 71 N 4.7280 9.4692 117.4503 52.4976 39.2235 174.7007 72 K 5.0668 8.1177 119.7268 55.1068 34.9238 175.8230 73 V 4.7930 8.9588 123.4695 61.7616 34.7292 173.3431 74 H 5.2984 9.7294 129.7673 55.0251 31.5542 173.6254 75 I 5.3290 8.8709 126.5963 59.9698 40.3390 174.6609 76 T 5.4582 9.4790 123.1265 61.8524 71.9774 172.8795 77 L 5.0663 8.8523 126.1947 53.0954 44.9371 175.5531 78 S 4.9112 8.3431 114.1835 58.1317 65.6636 175.1561 79 T 4.4892 8.4117 122.9645 62.4445 69.5399 175.2270 80 H 4.0192 9.2206 126.9830 59.4781 30.3848 176.8754 81 E 3.9282 8.2294 117.4590 59.2895 29.2351 177.9683 82 C 4.5280 7.9665 108.7379 56.8649 30.0755 173.0661 83 A 3.6445 7.7498 121.3643 53.0173 16.3002 177.3936 84 G 4.0430 7.1595 107.2473 46.4512 0.0000 173.1177 85 L 5.0704 7.9459 119.0397 54.3152 42.2343 176.7464 86 S 4.7961 8.3824 115.4889 55.5688 66.6501 174.5625 87 E 3.8343 8.9644 119.6787 59.9124 28.9343 179.7314 88 R 3.7702 7.3752 116.2877 59.6840 30.1546 178.7034 89 D 4.3510 7.9325 118.0921 57.3903 40.8014 178.9902 90 I 3.5145 7.5294 119.7598 64.1972 37.2976 177.5828 91 N 4.2120 8.5566 118.1417 56.8121 38.7406 176.5224 92 L 3.9249 8.2851 121.6754 58.0475 42.1717 178.7979 93 A 3.8724 7.9944 120.7002 55.2515 18.2526 179.7460 94 S 4.1189 8.1033 113.6364 61.7936 62.9386 176.7925 95 F 4.0563 8.2343 122.9480 61.2943 39.0642 177.2117 96 I 3.9288 8.2900 119.7343 64.5690 36.6985 178.2868 97 E 4.3226 8.4402 118.6587 59.4712 29.0921 179.0061 98 Q 4.0915 7.9425 118.2032 58.7769 28.5612 179.1017 99 V 3.5872 7.6095 118.8726 65.7976 31.5680 177.6048 100 A 4.3701 8.5054 117.6349 53.6262 18.1705 178.2804 101 V 4.2067 7.4914 116.5438 62.9904 34.2974 176.4606 102 S 4.3740 7.3509 113.9129 56.9770 61.6741 174.2426 *104 T 4.1287 7.5903 121.9603 64.5807 68.5916 174.3405 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 A 8.25 4.31 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 3 G 8.04 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 0.00 0.00 0.00 4 K 8.57 4.52 0.00 1.67 1.77 0.00 1.74 0.00 0.00 1.69 0.00 0.00 2.81 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.33 1.38 7.81 5 A 8.62 4.20 1.20 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 0.00 0.00 6 H 8.31 4.87 0.00 3.06 3.19 0.00 5.91 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 R 8.51 4.22 0.00 1.81 1.84 0.00 3.30 0.00 0.00 3.22 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.80 0.00 8 L 8.91 4.35 0.00 1.52 1.59 0.89 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 9 S 9.65 4.50 0.00 3.84 3.97 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 10 A 8.77 4.07 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 3.91 0.00 2.01 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 2.39 2.39 0.00 12 E 8.01 3.97 0.00 2.16 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 2.33 0.00 13 R 8.37 3.91 0.00 1.81 1.98 0.00 3.31 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 1.87 0.00 14 D 8.12 4.47 0.00 2.90 2.85 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 15 Q 7.51 4.57 0.00 2.16 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 7.72 4.79 0.00 1.58 1.65 0.89 0.94 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 17 L 7.96 4.09 0.00 1.84 1.70 0.91 0.93 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 18 P 0.00 4.24 0.00 2.15 2.13 0.00 3.58 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.20 0.00 19 N 8.17 4.36 0.00 2.72 2.88 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 7.81 4.44 0.00 1.74 1.48 0.56 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 21 R 8.62 4.77 0.00 1.87 1.99 0.00 3.16 0.00 0.00 3.27 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.67 0.00 22 A 7.98 4.07 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 23 V 7.34 4.27 2.14 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 0.77 0.00 0.00 1.25 0.00 0.00 24 G 8.20 3.81 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 0.00 0.00 0.00 25 W 8.19 4.44 0.00 3.29 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 26 N 8.51 5.19 0.00 1.68 2.19 0.00 0.00 6.98 7.28 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 27 E 8.64 4.86 0.00 1.90 1.94 0.00 0.00 0.00 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 2.32 0.00 28 L 9.01 4.60 0.00 1.90 1.86 0.66 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 29 E 8.84 4.30 0.00 2.03 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 2.28 2.33 0.00 30 G 10.05 3.90 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 0.00 0.00 0.00 31 R 7.43 4.29 0.00 1.75 1.80 0.00 3.26 0.00 0.00 3.20 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.56 0.00 32 D 8.37 4.58 0.00 2.77 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 33 A 7.83 4.81 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 34 I 8.52 5.32 2.09 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.36 0.94 0.00 0.00 35 F 9.21 5.81 0.00 3.22 3.31 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 36 K 8.61 4.23 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 2.22 0.00 0.00 0.00 0.00 0.30 0.65 7.81 37 Q 8.40 4.64 0.00 2.11 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.71 6.51 0.00 0.00 0.00 0.00 0.00 2.27 2.17 0.00 38 F 9.07 4.64 0.00 3.10 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 39 H 8.13 5.16 0.00 2.78 3.07 0.00 5.64 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 F 9.05 4.84 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 9.01 4.15 0.00 1.77 1.73 0.00 1.80 0.00 0.00 1.76 0.00 0.00 2.90 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.36 1.00 7.81 42 D 7.54 4.36 0.00 2.79 2.77 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 43 F 7.67 4.58 0.00 2.92 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 44 N 8.26 4.21 0.00 2.96 2.84 0.00 0.00 7.11 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 8.90 3.72 0.00 1.84 1.86 0.00 3.31 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 1.82 1.81 0.00 46 A 7.46 3.12 1.22 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 0.00 0.00 47 F 8.11 3.63 0.00 1.93 2.65 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 48 G 7.71 3.64 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 0.00 0.00 0.00 49 F 7.82 4.16 0.00 2.34 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 *51 T 7.79 4.04 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 1.18 0.00 0.00 52 R 7.95 3.90 0.00 1.94 2.06 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 1.85 0.00 53 V 7.76 3.62 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 0.90 0.00 0.00 0.28 0.00 0.00 54 A 7.87 3.95 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 7.89 3.88 0.00 1.84 1.68 0.91 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 56 Q 7.71 3.58 0.00 0.93 1.34 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 1.76 0.00 57 A 7.80 3.81 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 58 E 7.66 3.79 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 7.50 4.01 0.00 1.74 1.77 0.00 1.60 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.41 1.58 7.81 60 L 8.00 4.16 0.00 1.55 1.60 0.77 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 61 D 7.97 4.26 0.00 2.76 2.70 0.00 0.00 0.00 0.00 0.00 0.00 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 7.41 4.86 0.00 2.95 2.99 0.00 5.94 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 63 H 8.29 4.68 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 4.35 0.00 1.60 1.67 0.00 3.14 0.00 0.00 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.52 0.00 65 E 9.06 4.68 0.00 2.26 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 2.30 2.25 0.00 66 W 8.97 5.81 0.00 3.32 3.26 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 0.00 67 F 9.62 5.14 0.00 3.08 3.05 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 68 N 8.33 5.30 0.00 2.55 2.50 0.00 0.00 6.84 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 8.18 4.09 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 0.58 0.00 0.00 70 Y 9.14 3.93 0.00 3.20 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 71 N 9.47 4.73 0.00 2.96 2.63 0.00 0.00 5.84 7.20 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 72 K 8.12 5.07 0.00 1.81 1.79 0.00 1.70 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.38 1.46 7.81 73 V 8.96 4.79 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 1.31 0.00 0.00 1.09 0.00 0.00 74 H 9.73 5.30 0.00 3.57 3.46 0.00 5.58 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 8.87 5.33 2.30 0.00 0.00 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 1.82 1.05 1.28 0.00 0.00 76 T 9.48 5.46 4.51 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 1.38 0.00 0.00 77 L 8.85 5.07 0.00 1.57 1.69 0.74 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 78 S 8.34 4.91 0.00 3.88 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 8.41 4.49 4.39 0.00 0.00 0.00 0.00 0.00 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 9.22 4.02 0.00 3.18 3.32 0.00 5.71 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 E 8.23 3.93 0.00 1.98 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 2.33 2.37 0.00 82 C 7.97 4.53 0.00 3.02 2.94 0.00 0.00 0.00 0.00 0.00 0.00 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 7.75 3.64 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.16 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 85 L 7.95 5.07 0.00 1.66 1.57 0.94 0.85 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 86 S 8.38 4.80 0.00 4.02 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 87 E 8.96 3.83 0.00 1.94 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 2.38 2.36 0.00 88 R 7.38 3.77 0.00 1.51 1.49 0.00 2.95 0.00 0.00 3.01 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.58 0.00 89 D 7.93 4.35 0.00 2.75 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 90 I 7.53 3.51 1.94 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 1.63 0.93 0.83 0.00 0.00 91 N 8.56 4.21 0.00 2.80 2.88 0.00 0.00 6.89 6.53 0.00 0.00 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 8.29 3.92 0.00 1.79 1.61 0.77 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 93 A 7.99 3.87 0.60 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 0.00 0.00 94 S 8.10 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 8.23 4.06 0.00 3.13 3.16 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 96 I 8.29 3.93 2.45 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.86 1.26 0.00 0.00 97 E 8.44 4.32 0.00 2.29 2.18 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 3.02 2.81 0.00 98 Q 7.94 4.09 0.00 1.96 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.84 0.00 0.00 0.00 0.00 0.00 2.32 2.47 0.00 99 V 7.61 3.59 2.29 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 1.13 0.00 0.00 0.62 0.00 0.00 100 A 8.51 4.37 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.49 4.21 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 0.94 0.00 0.00 1.02 0.00 0.00 102 S 7.35 4.37 0.00 4.06 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 *104 T 7.59 4.13 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 1.21 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.