NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 N 4.5918 8.2833 118.2107 52.8258 38.5486 175.6581 *4 I 4.0348 8.8923 117.6425 61.3430 39.5895 177.4221 5 D 4.2362 8.6562 120.1626 57.4803 40.7165 178.9842 6 Q 3.7070 7.5994 116.5895 58.2556 28.6708 177.8294 7 L 4.0376 7.1937 116.9866 55.7627 42.2419 176.4377 8 N 4.0243 7.6074 116.0078 54.3813 37.1209 173.4069 9 I 4.3452 7.3997 118.7135 60.6073 38.6546 175.8758 10 T 4.6808 8.5819 115.0608 59.9892 71.4838 172.9513 11 D 4.5945 8.5870 117.2169 55.1696 38.4776 173.3877 12 F 4.9019 8.3438 120.6432 58.3374 40.2238 174.2546 13 Q 4.6074 8.2494 122.6275 54.9233 32.1332 173.3141 14 V 4.8680 8.2675 121.4374 60.1055 33.8189 174.5152 15 F 5.1835 8.7129 118.0759 56.1758 41.7725 172.8135 16 T 4.9460 8.5753 109.0481 60.3702 71.5169 172.8939 17 D 4.7165 8.6570 121.5709 52.9439 45.5367 175.0910 18 E 4.3869 8.3479 117.4308 56.5320 26.5852 176.3847 *26 K 3.8926 7.7280 119.4929 55.7977 32.7635 173.2422 27 I 4.3864 7.7145 121.0565 59.4236 39.6902 174.0576 28 Y 4.8063 8.4742 124.9938 57.2174 39.5308 174.8181 29 K 5.3303 9.1631 122.4763 54.6749 37.1950 175.1050 30 F 5.1789 8.5796 116.1792 55.2072 41.8857 173.5626 31 S 5.2420 9.0780 113.8833 57.0782 66.1826 172.7324 32 S 5.2059 8.5533 118.8719 58.8967 66.7251 173.1225 33 K 5.5191 8.8755 119.8863 54.2119 35.9193 174.7236 *35 I 4.3768 8.3191 121.9125 62.0239 38.9140 176.1331 36 L 4.5185 9.1059 129.8392 53.4369 43.3012 176.0526 37 S 4.9133 8.5729 116.9743 56.2930 66.4087 173.8358 38 D 4.5984 8.6111 117.8739 55.0412 39.4015 177.8025 39 F 4.0875 8.0018 122.8900 61.7015 39.5682 175.5357 40 H 4.4332 8.5520 115.6545 56.4234 29.0489 175.0347 41 A 4.6791 7.4936 122.9370 51.5712 19.1853 177.0133 42 Q 4.5634 8.6309 119.6569 53.5962 30.7842 174.9997 43 P 4.1628 0.0000 0.0000 65.4000 31.2630 177.4731 44 Q 4.2346 8.3478 114.5211 55.7338 29.2595 176.2698 45 G 3.7400 8.7197 107.8450 44.9810 0.0000 173.2724 46 F 5.1672 8.2597 118.6399 55.4777 41.4336 175.0582 47 L 4.2844 9.0969 123.8931 55.3439 42.6139 176.2666 48 N 4.3336 9.5976 126.4141 53.5234 39.3755 175.7464 49 G 3.7336 9.1771 113.7491 48.1021 0.0000 175.3758 50 G 3.6315 8.6293 107.4735 47.5558 0.0000 175.6951 51 A 4.0978 7.9671 123.0788 55.1729 18.3846 179.9702 52 S 4.1602 8.0425 113.2822 61.4943 62.9983 176.5530 53 L 4.0182 8.2378 121.6649 57.9025 41.3817 179.5092 54 A 3.9946 8.0313 120.5242 54.9376 18.2805 179.0963 55 L 3.8758 8.3314 119.1198 58.4208 42.0518 179.1296 56 A 4.0566 8.1488 120.2901 55.2447 18.4189 179.1688 57 E 3.8762 8.3009 117.7541 59.4887 29.4857 178.9186 58 I 3.5779 7.8257 119.1451 64.5992 37.2933 178.1072 59 T 3.4335 7.6865 109.1855 64.6440 68.7656 175.6988 60 A 3.4549 7.9290 123.8541 54.4014 18.3215 180.1797 61 G 3.5026 7.7667 100.4529 45.5928 0.0000 175.1581 *63 A 4.4164 7.9426 125.7275 52.0086 20.6034 180.1768 64 S 4.5828 8.2448 111.9284 62.0589 62.6575 176.7400 65 N 4.3479 8.2189 118.0130 56.1015 38.3382 177.1134 66 A 4.1715 8.0169 120.8030 54.4346 18.5724 179.3042 67 I 4.1608 7.3332 117.5065 63.2052 38.9854 178.0345 68 G 3.3055 7.9704 110.4664 41.6405 0.0000 170.8170 69 S 4.3753 7.8443 117.8062 56.5392 63.9591 175.0334 70 G 4.2588 7.8321 117.0021 43.9329 0.0000 170.0934 71 Q 3.9533 7.6105 123.9580 58.7087 29.9500 174.9621 72 Y 5.2202 6.5265 112.6308 55.2083 41.8715 174.4862 73 F 5.2730 9.1948 118.8411 56.0324 41.3998 174.9948 74 A 4.9066 9.0306 125.5810 51.3682 19.7301 176.8608 75 F 4.8157 9.0447 120.9053 55.1089 42.8458 174.8302 76 G 3.9455 9.1735 111.2236 47.4476 0.0000 171.7250 77 Q 4.7747 9.5864 126.5159 57.2485 30.6291 175.7172 78 S 4.8724 7.8538 112.1549 56.7304 66.8699 172.4814 79 I 5.1968 8.3293 121.3572 59.7518 41.0297 173.9632 80 N 5.1021 9.3959 124.7677 51.6836 41.8017 172.7792 81 A 5.2013 8.6659 126.7017 50.1564 22.5017 174.5673 82 N 4.8232 9.0001 119.1287 51.7236 41.5538 173.5909 83 H 4.9311 8.6526 121.6964 54.3491 28.8129 175.0165 84 L 4.3614 8.9462 125.0493 56.5201 42.5514 177.8809 85 N 4.9361 7.8344 114.3472 50.4003 42.2627 172.5207 86 P 4.2734 0.0000 0.0000 62.5028 32.2630 175.3384 87 K 4.7469 8.2573 120.8008 54.2757 35.4314 175.2560 88 K 4.2464 8.8498 126.4892 56.7605 32.7335 177.6424 89 C 4.6555 8.6330 126.3133 58.0439 29.2188 172.0922 90 E 4.7253 8.3559 118.6554 55.6510 33.2653 178.7296 91 G 3.8787 8.6260 109.1935 46.6162 0.0000 175.0745 92 F 5.2278 9.4032 119.2879 55.1602 40.9354 173.7264 93 V 4.6904 8.3401 113.4118 59.7587 35.4730 174.2491 94 N 5.3039 9.2465 120.4742 51.8589 40.9812 174.0704 95 A 5.1437 9.0755 124.5842 50.4419 21.8985 175.0497 96 R 4.5608 9.0468 121.7294 54.7611 33.2625 175.5892 97 G 3.6910 7.0752 110.6277 43.8852 0.0000 171.7333 98 L 5.1001 9.0875 124.0242 52.6967 45.3381 175.1852 99 L 3.7226 8.6606 129.4009 54.6167 41.4158 176.2743 100 L 4.2219 8.6231 128.4319 56.6685 42.9563 177.7893 101 K 4.2538 7.5504 119.7866 54.7254 35.2917 175.7060 102 N 4.5737 8.6818 128.2608 52.1156 37.3969 174.0809 103 G 3.8754 8.2999 111.8284 44.1054 0.0000 171.4316 104 K 4.1274 8.3632 119.6657 57.5092 32.6318 177.1743 105 R 4.5723 7.7621 112.9731 56.1255 32.3137 175.0886 106 N 5.4473 7.8601 115.8017 51.8451 43.4300 172.9277 107 H 5.3561 8.8884 119.1449 54.0271 32.1316 173.6506 108 V 4.8146 8.1163 121.4530 61.1191 33.9914 174.0316 109 W 5.2091 9.5434 129.0924 55.1277 31.4866 174.9227 110 E 4.7869 9.3809 126.8933 55.1084 30.6842 174.6109 111 I 4.9863 9.1998 128.2536 59.4309 40.6219 174.5722 112 K 4.7912 9.2098 126.7962 54.7561 34.6105 175.1816 113 I 4.9876 8.8825 127.4055 60.1292 38.8515 175.1191 114 T 5.1605 8.8917 117.1607 59.9006 72.8716 173.6031 115 D 4.5073 8.3964 121.4547 52.0383 41.8671 176.3848 116 E 3.4264 8.4308 117.2261 59.6272 29.3048 177.7778 117 N 4.7023 8.1052 112.5787 52.6984 38.7812 174.6844 118 E 3.8246 8.1947 116.2057 57.4841 27.5582 174.4139 119 T 4.0198 8.3096 117.1925 62.7656 68.8843 173.9520 120 L 4.4261 8.4945 128.8286 55.6194 42.5961 176.1138 121 I 4.1960 9.1641 127.9658 63.5172 38.6230 176.2276 122 S 5.1281 7.8739 116.3836 56.8522 67.6887 172.4436 123 Q 4.7817 8.8920 124.6223 54.4665 31.4697 174.3072 124 I 5.1433 9.0204 126.6895 59.9380 41.6886 174.1598 125 T 5.1095 9.1403 123.6007 61.8047 71.2093 173.3100 126 V 4.7464 9.0665 126.9677 61.1436 34.3124 174.2184 127 V 4.7857 9.0164 128.9553 61.7083 33.1424 174.0059 128 N 5.4552 9.3244 126.2363 51.7135 40.8609 174.3557 129 A 4.2764 9.4445 126.0530 51.7307 20.1432 176.4483 130 L 4.6267 8.6799 123.1701 53.3209 42.6806 176.2144 131 V 4.5363 8.3395 117.6158 58.4776 34.2601 174.2202 132 P 4.9264 0.0000 0.0000 62.4196 31.9593 176.3587 133 Q 4.5001 7.9188 117.9481 55.0385 28.3864 175.0962 134 K 4.2129 7.8144 122.1938 57.2048 32.3172 175.2859 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 N 8.28 4.59 0.00 2.95 2.44 0.00 0.00 6.10 6.81 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 *4 I 8.89 4.03 1.93 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.80 0.82 0.00 0.00 5 D 8.66 4.24 0.00 2.60 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 6 Q 7.60 3.71 0.00 1.53 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.55 7.00 0.00 0.00 0.00 0.00 0.00 2.05 2.20 0.00 7 L 7.19 4.04 0.00 1.96 1.79 1.20 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 8 N 7.61 4.02 0.00 2.80 2.83 0.00 0.00 7.20 7.25 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 9 I 7.40 4.35 1.82 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.68 0.98 0.00 0.00 10 T 8.58 4.68 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 11 D 8.59 4.59 0.00 2.87 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 12 F 8.34 4.90 0.00 3.00 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 13 Q 8.25 4.61 0.00 2.18 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.54 0.00 0.00 0.00 0.00 0.00 2.27 2.48 0.00 14 V 8.27 4.87 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 0.87 0.00 0.00 1.20 0.00 0.00 15 F 8.71 5.18 0.00 3.06 3.14 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 16 T 8.58 4.95 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 0.66 0.00 0.00 17 D 8.66 4.72 0.00 2.76 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 E 8.35 4.39 0.00 2.04 1.90 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 2.34 2.28 0.00 *26 K 7.73 3.89 0.00 1.74 1.76 0.00 1.53 0.00 0.00 1.32 0.00 0.00 2.90 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.40 7.81 27 I 7.71 4.39 1.81 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.63 0.87 0.00 0.00 28 Y 8.47 4.81 0.00 2.75 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 29 K 9.16 5.33 0.00 0.79 1.10 0.00 1.66 0.00 0.00 1.77 0.00 0.00 2.87 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.27 1.28 7.81 30 F 8.58 5.18 0.00 2.69 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 31 S 9.08 5.24 0.00 4.15 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 32 S 8.55 5.21 0.00 4.10 4.30 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 33 K 8.88 5.52 0.00 1.73 1.69 0.00 1.60 0.00 0.00 0.95 0.00 0.00 2.40 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.38 1.17 7.81 *35 I 8.32 4.38 1.91 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 1.38 0.81 0.95 0.00 0.00 36 L 9.11 4.52 0.00 1.59 1.57 1.02 0.68 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 37 S 8.57 4.91 0.00 4.03 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 38 D 8.61 4.60 0.00 2.95 2.99 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 39 F 8.00 4.09 0.00 2.91 3.07 0.00 0.00 0.00 0.00 0.00 0.00 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 8.55 4.43 0.00 3.41 3.39 0.00 5.66 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 41 A 7.49 4.68 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 42 Q 8.63 4.56 0.00 2.28 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.68 0.00 0.00 0.00 0.00 0.00 2.32 2.68 0.00 43 P 0.00 4.16 0.00 2.07 2.18 0.00 3.68 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 2.04 2.12 0.00 44 Q 8.35 4.23 0.00 2.39 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.78 0.00 0.00 0.00 0.00 0.00 2.43 2.45 0.00 45 G 8.72 3.74 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 0.00 0.00 0.00 46 F 8.26 5.17 0.00 3.14 2.99 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 47 L 9.10 4.28 0.00 1.66 1.78 0.99 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 48 N 9.60 4.33 0.00 2.87 2.68 0.00 0.00 6.67 7.80 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 49 G 9.18 3.73 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 0.00 0.00 0.00 50 G 8.63 3.63 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 0.00 0.00 0.00 51 A 7.97 4.10 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 52 S 8.04 4.16 0.00 4.10 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 L 8.24 4.02 0.00 1.95 1.76 1.04 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 54 A 8.03 3.99 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 55 L 8.33 3.88 0.00 1.92 2.02 0.99 0.96 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 56 A 8.15 4.06 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 57 E 8.30 3.88 0.00 2.08 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 2.38 0.00 58 I 7.83 3.58 1.77 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.88 0.74 0.00 0.00 59 T 7.69 3.43 3.53 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 0.00 0.00 0.00 1.18 0.00 0.00 60 A 7.93 3.45 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 61 G 7.77 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.94 4.42 0.70 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 0.00 0.00 64 S 8.24 4.58 0.00 4.31 4.28 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 65 N 8.22 4.35 0.00 2.76 2.89 0.00 0.00 7.04 6.72 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 66 A 8.02 4.17 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.33 4.16 2.09 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.63 0.63 0.00 0.00 68 G 7.97 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 0.00 0.00 0.00 69 S 7.84 4.38 0.00 3.89 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 70 G 7.83 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 0.00 0.00 0.00 0.00 71 Q 7.61 3.95 0.00 1.98 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.91 6.71 0.00 0.00 0.00 0.00 0.00 2.55 2.36 0.00 72 Y 6.53 5.22 0.00 3.07 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 73 F 9.19 5.27 0.00 3.12 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 A 9.03 4.91 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 9.04 4.82 0.00 3.01 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 76 G 9.17 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 77 Q 9.59 4.77 0.00 2.06 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.59 0.00 0.00 0.00 0.00 0.00 2.31 2.30 0.00 78 S 7.85 4.87 0.00 3.89 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 79 I 8.33 5.20 1.91 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.60 0.95 0.00 0.00 80 N 9.40 5.10 0.00 2.80 2.64 0.00 0.00 6.54 9.28 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 81 A 8.67 5.20 1.10 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 0.00 0.00 82 N 9.00 4.82 0.00 2.60 2.70 0.00 0.00 6.76 7.93 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 83 H 8.65 4.93 0.00 3.03 3.21 0.00 5.74 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 L 8.95 4.36 0.00 1.68 1.71 0.92 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 85 N 7.83 4.94 0.00 2.74 2.64 0.00 0.00 6.91 8.02 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 86 P 0.00 4.27 0.00 1.58 1.49 0.00 3.62 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.69 0.00 87 K 8.26 4.75 0.00 1.83 1.69 0.00 1.71 0.00 0.00 1.82 0.00 0.00 2.79 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.41 1.43 7.81 88 K 8.85 4.25 0.00 1.70 1.71 0.00 1.68 0.00 0.00 1.46 0.00 0.00 2.45 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.46 1.37 7.81 89 C 8.63 4.66 0.00 3.12 2.87 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 0.00 0.00 0.00 90 E 8.36 4.73 0.00 2.08 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 2.26 2.28 0.00 91 G 8.63 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 92 F 9.40 5.23 0.00 3.11 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 93 V 8.34 4.69 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 0.81 0.00 0.00 1.01 0.00 0.00 94 N 9.25 5.30 0.00 2.78 2.82 0.00 0.00 6.87 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 95 A 9.08 5.14 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 96 R 9.05 4.56 0.00 1.68 1.71 0.00 3.11 0.00 0.00 3.23 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.58 0.00 97 G 7.08 3.69 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 0.00 0.00 0.00 98 L 9.09 5.10 0.00 1.67 1.49 0.90 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 99 L 8.66 3.72 0.00 1.36 1.22 0.40 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 100 L 8.62 4.22 0.00 1.57 1.65 0.92 0.65 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 0.00 101 K 7.55 4.25 0.00 1.71 1.52 0.00 1.67 0.00 0.00 1.70 0.00 0.00 2.72 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.42 1.37 7.81 102 N 8.68 4.57 0.00 2.63 2.70 0.00 0.00 7.21 7.98 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 0.00 103 G 8.30 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 0.00 104 K 8.36 4.13 0.00 1.70 1.80 0.00 1.72 0.00 0.00 1.75 0.00 0.00 3.04 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.38 1.42 7.81 105 R 7.76 4.57 0.00 1.83 2.05 0.00 2.95 0.00 0.00 3.31 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.57 0.00 106 N 7.86 5.45 0.00 2.56 2.65 0.00 0.00 7.01 8.16 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 0.00 107 H 8.89 5.36 0.00 3.15 2.95 0.00 5.57 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 V 8.12 4.81 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 1.08 0.00 0.00 0.92 0.00 0.00 109 W 9.54 5.21 0.00 3.39 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 E 9.38 4.79 0.00 2.06 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 2.27 2.31 0.00 111 I 9.20 4.99 2.09 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.89 1.01 0.00 0.00 112 K 9.21 4.79 0.00 1.63 1.72 0.00 1.65 0.00 0.00 1.65 0.00 0.00 3.00 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.51 1.39 7.81 113 I 8.88 4.99 1.92 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.94 1.01 0.00 0.00 114 T 8.89 5.16 4.19 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 0.00 0.00 0.00 1.23 0.00 0.00 115 D 8.40 4.51 0.00 2.80 2.82 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 0.00 116 E 8.43 3.43 0.00 1.73 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 1.89 1.47 0.00 117 N 8.11 4.70 0.00 2.67 2.81 0.00 0.00 6.97 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 0.00 118 E 8.19 3.82 0.00 2.15 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 0.00 2.25 2.44 0.00 119 T 8.31 4.02 4.55 0.00 0.00 0.00 0.00 0.00 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 0.00 120 L 8.49 4.43 0.00 1.59 1.60 1.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 121 I 9.16 4.20 1.98 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 1.37 0.86 0.99 0.00 0.00 122 S 7.87 5.13 0.00 3.79 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 0.00 123 Q 8.89 4.78 0.00 2.13 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.77 0.00 0.00 0.00 0.00 0.00 2.26 2.32 0.00 124 I 9.02 5.14 1.94 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.62 0.97 0.00 0.00 125 T 9.14 5.11 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 1.33 0.00 0.00 126 V 9.07 4.75 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 0.90 0.00 0.00 1.08 0.00 0.00 127 V 9.02 4.79 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 0.97 0.00 0.00 0.97 0.00 0.00 128 N 9.32 5.46 0.00 2.81 2.81 0.00 0.00 6.47 7.25 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 0.00 129 A 9.44 4.28 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 0.00 130 L 8.68 4.63 0.00 1.25 1.09 0.58 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 131 V 8.34 4.54 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 1.37 0.00 0.00 132 P 0.00 4.93 0.00 1.96 2.03 0.00 3.68 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.14 0.00 133 Q 7.92 4.50 0.00 1.53 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.76 0.00 0.00 0.00 0.00 0.00 1.68 2.00 0.00 134 K 7.81 4.21 0.00 1.72 1.70 0.00 1.72 0.00 0.00 1.78 0.00 0.00 2.95 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.34 1.47 7.81 * Residues marked with a * may have inaccurate shift predictions.