NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 A 4.1979 8.2493 123.5724 52.1410 19.7351 180.1005 1 D 4.2833 8.5502 121.5028 53.7582 40.6189 173.7409 2 A 4.1230 7.7361 121.2943 51.7942 20.4611 177.9964 3 V 4.3207 8.4858 119.3500 61.1372 33.9315 174.6151 4 V 4.8396 8.4385 127.2648 61.6365 33.7037 174.0335 5 T 4.8526 9.0674 125.0598 61.9423 71.0351 173.4647 6 Q 5.2196 8.5907 123.6422 53.7227 32.7278 175.3033 7 E 4.0236 8.6635 120.2491 57.0319 30.5476 177.9439 *9 S 4.6439 8.6560 117.4104 58.1283 65.2124 173.5332 10 A 5.2635 7.8612 117.9948 50.3080 22.2282 174.8983 11 L 4.8315 8.7722 118.6058 53.5986 46.6639 175.5623 12 T 5.0644 8.3394 117.0709 62.6286 72.5928 173.1823 13 T 4.6950 9.2375 118.8560 61.4886 71.2773 171.9932 14 S 5.0730 8.3907 113.5904 55.8703 66.8199 171.7469 15 P 4.3854 0.0000 0.0000 64.6490 31.4219 177.1022 16 G 3.9388 9.1496 110.6518 45.6026 0.0000 173.4136 17 E 4.3475 7.9591 119.5447 56.1392 31.4661 175.3854 18 T 5.1912 8.2366 116.7821 61.9696 71.2033 174.4821 19 V 4.5255 8.3575 123.4219 60.3351 35.5477 174.2708 20 T 4.8388 8.3085 117.9104 61.9113 71.3879 173.1825 21 L 4.6304 8.9032 127.7814 53.6245 43.4250 176.3337 22 T 5.3392 8.4566 113.3812 60.3331 72.1572 173.0975 23 C 5.0005 9.1625 121.5452 55.4649 45.4798 172.4465 24 R 5.0705 9.2646 127.6222 54.7718 32.2858 174.4973 25 S 5.3945 8.4717 119.3474 56.4340 64.2051 174.0634 26 S 4.5019 8.9362 121.7066 60.1901 63.1884 174.8888 27 T 4.1821 7.9991 111.1426 62.2763 69.5645 174.6886 *29 G 4.4907 7.8109 109.0504 45.4502 0.0000 171.9904 30 A 4.3068 8.5314 120.7708 52.5180 18.8522 178.4931 31 V 4.0212 8.2103 120.9728 63.2678 32.9753 174.7996 32 T 4.8205 8.8423 119.4360 60.5181 71.2269 174.4719 33 T 3.7027 8.3773 111.6219 64.1608 68.9255 176.1476 *38 S 4.0646 7.8845 116.2470 58.0195 64.7045 173.8448 39 N 4.9256 7.6199 116.5395 52.7471 39.0867 174.5485 40 Y 3.6417 6.9878 115.5407 57.9359 36.1751 171.9151 41 A 4.2515 7.7615 120.1544 53.0117 19.5945 178.2589 42 S 4.9899 8.8133 116.4960 56.6482 68.0653 173.1954 43 W 5.5149 9.7725 121.8446 55.2398 32.9852 174.8198 44 V 4.9650 9.3669 117.2552 59.6169 35.6251 174.1588 45 Q 4.4556 9.0507 125.7794 54.2904 31.1620 173.6004 46 E 4.2326 8.8327 128.2129 54.3953 31.6722 175.1355 47 K 4.7188 8.3481 126.5878 53.6600 35.1117 174.4183 48 P 4.2549 0.0000 0.0000 64.5753 31.6629 176.0503 49 D 4.5514 8.5894 118.3728 54.3384 39.1953 173.5598 50 H 3.9577 7.8534 110.9872 56.2383 26.4845 174.6904 51 L 4.3374 7.5779 121.5951 54.7677 42.5552 175.1771 52 F 5.1436 8.8600 125.3628 56.4397 41.0180 175.8085 53 T 4.6941 8.5675 118.1907 62.0288 73.0829 173.3942 54 G 4.0773 8.7682 112.9291 46.2596 0.0000 172.0782 55 L 4.6246 9.3892 121.9726 55.5457 44.1567 176.1938 56 I 5.1251 7.8838 118.5843 59.4303 41.2795 174.3313 57 G 4.2547 8.8894 112.7428 44.4646 0.0000 172.7120 58 G 4.0500 8.2450 112.2613 47.1133 0.0000 174.4579 *67 T 4.6572 7.6692 115.9788 62.1220 70.5076 177.6907 68 N 5.2240 7.8428 117.6125 52.7716 37.6119 173.0442 69 N 5.0992 8.1034 115.4072 52.6228 41.7401 174.5069 70 R 4.6825 8.6623 122.6848 55.3415 31.6549 176.0252 71 A 4.2155 9.4017 126.6501 52.1623 19.2051 174.6657 72 P 4.0356 0.0000 0.0000 63.4520 31.9781 176.4819 73 G 3.9551 9.0575 111.9742 44.9180 0.0000 173.2371 74 V 3.9014 7.2149 119.7225 61.1353 32.2801 173.9239 75 P 4.2665 0.0000 0.0000 63.1124 31.5708 176.9575 76 A 4.2679 8.7011 125.3138 54.0330 18.6325 178.2390 77 R 4.0468 7.8691 112.4122 57.7707 30.8261 176.1467 78 F 5.1932 8.0400 120.1387 56.5515 39.8630 175.3965 79 S 4.8616 9.2286 117.9369 56.7699 66.8626 173.0243 80 G 4.5933 8.2453 106.3081 45.4311 0.0000 171.6700 81 S 4.7697 8.5317 114.4036 58.0653 67.1364 174.0910 82 L 5.2880 8.6578 119.2587 53.2581 43.6473 176.5672 83 I 4.3090 9.1682 123.8583 60.7449 41.4127 176.2370 84 G 3.7999 8.2101 110.9697 46.5876 0.0000 174.0809 *87 D 4.6869 7.5094 121.1685 53.9475 44.0987 175.8658 88 K 5.1755 8.8799 118.3069 54.4876 37.0424 174.9700 89 A 5.1305 8.7509 122.9902 51.1710 21.0245 176.3806 90 A 5.3280 9.5324 121.9035 50.2114 23.2673 174.7279 91 L 4.6688 8.5354 123.8159 53.2767 44.5604 175.2328 92 T 4.8930 8.9799 122.5908 61.7387 72.3818 172.9894 93 I 4.3625 8.3974 127.1082 60.0384 39.0531 175.3052 94 T 3.8625 8.4328 126.1068 63.4375 67.7728 175.1563 95 G 3.6156 7.8166 114.0564 44.5232 0.0000 170.8291 96 A 4.0198 8.4545 124.4437 52.8001 19.8238 176.8344 97 Q 4.8932 8.2423 116.2133 53.9791 32.9583 176.9647 98 T 3.9362 8.5461 109.8114 64.7519 69.0128 175.6580 99 E 4.1000 8.1494 119.6059 58.9031 29.8767 177.9770 100 D 4.7441 7.8320 116.2438 55.1753 40.5328 175.4599 101 E 4.4512 7.9447 121.6263 56.5243 30.0618 175.4805 102 A 4.3658 8.2773 126.7415 52.0527 24.1592 173.8839 103 I 4.7546 7.8706 118.1518 60.3015 39.3196 174.9717 104 Y 5.0041 9.0006 124.6595 56.2691 40.4059 174.6021 105 F 5.4311 9.4627 123.4463 55.9592 41.9519 173.9590 106 C 4.7699 9.0987 122.1431 54.7496 41.3465 172.1594 107 A 4.9799 8.4017 124.9147 50.4306 21.9955 175.2318 108 L 5.2030 8.8578 122.5511 52.8262 45.2741 175.1962 109 W 4.3877 8.5648 131.6721 55.3547 32.6815 175.2345 110 Y 4.2943 7.3579 124.9397 56.4260 37.5513 175.1149 111 S 4.0507 7.0927 122.5166 59.0340 62.9060 171.9839 *135 N 4.8055 8.2212 113.3823 51.8168 38.5649 172.9324 136 H 4.3486 5.2900 111.2107 55.3604 31.0885 172.5726 137 W 5.4526 9.0164 119.2845 55.3769 31.5442 175.8558 138 V 4.5356 8.8532 122.2162 61.3337 34.0370 174.4334 139 F 5.0988 9.1109 126.7900 56.7356 40.0909 176.0226 140 G 4.0863 9.2659 111.0515 45.4268 0.0000 174.1624 141 G 3.9144 8.8541 108.1428 46.4415 0.0000 175.0381 142 G 3.5469 9.4303 106.3956 45.8178 0.0000 173.1689 143 T 4.9440 8.3839 117.0330 60.1273 72.0786 173.1465 144 K 4.4355 9.0941 129.6294 55.8850 33.5266 175.0717 145 L 5.1776 9.2064 130.5223 53.7756 44.2537 174.8281 146 T 4.6940 8.8169 123.2612 61.9570 71.0472 173.7176 147 V 4.5131 9.0907 127.5916 60.6020 31.9517 175.4275 148 L 4.2615 8.7275 126.3340 54.7055 41.0530 177.0332 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 0 A 8.25 4.20 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1 D 8.55 4.28 0.00 2.71 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 2 A 7.74 4.12 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.49 4.32 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 0.95 0.00 0.00 0.92 0.00 0.00 4 V 8.44 4.84 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 1.02 0.00 0.00 1.14 0.00 0.00 5 T 9.07 4.85 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 6 Q 8.59 5.22 0.00 1.97 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.74 6.99 0.00 0.00 0.00 0.00 0.00 2.50 2.42 0.00 7 E 8.66 4.02 0.00 2.11 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 2.43 2.43 0.00 *9 S 8.66 4.64 0.00 3.82 3.96 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 10 A 7.86 5.26 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 11 L 8.77 4.83 0.00 1.59 1.45 0.92 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 12 T 8.34 5.06 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 1.25 0.00 0.00 13 T 9.24 4.69 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 1.20 0.00 0.00 14 S 8.39 5.07 0.00 3.85 3.86 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 0.00 0.00 0.00 15 P 0.00 4.39 0.00 2.04 2.04 0.00 3.69 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.10 0.00 16 G 9.15 3.94 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 0.00 0.00 0.00 17 E 7.96 4.35 0.00 2.00 1.85 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 2.38 2.40 0.00 18 T 8.24 5.19 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 1.17 0.00 0.00 19 V 8.36 4.53 1.98 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 0.55 0.00 0.00 0.83 0.00 0.00 20 T 8.31 4.84 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 1.17 0.00 0.00 21 L 8.90 4.63 0.00 0.97 1.56 0.26 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 22 T 8.46 5.34 4.36 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 1.27 0.00 0.00 23 C 9.16 5.00 0.00 3.05 3.11 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 0.00 24 R 9.26 5.07 0.00 1.99 1.92 0.00 3.18 0.00 0.00 3.14 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.64 0.00 25 S 8.47 5.39 0.00 4.00 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 26 S 8.94 4.50 0.00 3.93 4.09 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 0.00 0.00 0.00 0.00 27 T 8.00 4.18 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 1.18 0.00 0.00 *29 G 7.81 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.53 4.31 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 V 8.21 4.02 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 0.73 0.00 0.00 1.01 0.00 0.00 32 T 8.84 4.82 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 1.18 0.00 0.00 33 T 8.38 3.70 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 1.14 0.00 0.00 *38 S 7.88 4.06 0.00 3.86 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 39 N 7.62 4.93 0.00 2.90 2.67 0.00 0.00 7.50 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 40 Y 6.99 3.64 0.00 3.02 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 41 A 7.76 4.25 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 42 S 8.81 4.99 0.00 3.49 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 43 W 9.77 5.51 0.00 3.24 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 44 V 9.37 4.97 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 0.86 0.00 0.00 1.25 0.00 0.00 45 Q 9.05 4.46 0.00 1.58 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.77 0.00 0.00 0.00 0.00 0.00 1.96 1.65 0.00 46 E 8.83 4.23 0.00 1.52 1.61 0.00 0.00 0.00 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 1.47 0.00 47 K 8.35 4.72 0.00 1.60 1.61 0.00 1.67 0.00 0.00 1.60 0.00 0.00 2.88 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.31 1.27 7.81 48 P 0.00 4.25 0.00 1.99 1.97 0.00 3.66 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.05 0.00 49 D 8.59 4.55 0.00 2.77 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 50 H 7.85 3.96 0.00 3.39 3.60 0.00 5.94 0.00 0.00 0.00 0.00 7.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 L 7.58 4.34 0.00 1.78 1.48 0.94 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 52 F 8.86 5.14 0.00 2.89 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 53 T 8.57 4.69 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 1.17 0.00 0.00 54 G 8.77 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 55 L 9.39 4.62 0.00 1.63 1.37 0.85 0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 56 I 7.88 5.13 2.21 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.32 1.18 0.00 0.00 57 G 8.89 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 0.00 0.00 0.00 0.00 58 G 8.25 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 *67 T 7.67 4.66 4.42 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 1.26 0.00 0.00 68 N 7.84 5.22 0.00 2.70 3.04 0.00 0.00 5.83 8.04 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 69 N 8.10 5.10 0.00 2.92 2.77 0.00 0.00 7.08 7.54 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 70 R 8.66 4.68 0.00 1.74 1.91 0.00 3.55 0.00 0.00 3.59 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.71 0.00 71 A 9.40 4.22 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 72 P 0.00 4.04 0.00 2.22 2.04 0.00 3.74 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.03 0.00 73 G 9.06 3.96 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 0.00 0.00 0.00 74 V 7.21 3.90 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 0.80 0.00 0.00 0.96 0.00 0.00 75 P 0.00 4.27 0.00 2.52 2.09 0.00 3.85 0.00 0.00 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.21 0.00 76 A 8.70 4.27 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 77 R 7.87 4.05 0.00 1.77 2.05 0.00 2.61 0.00 0.00 3.16 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.81 0.00 78 F 8.04 5.19 0.00 3.13 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 79 S 9.23 4.86 0.00 3.83 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 80 G 8.25 4.59 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 0.00 0.00 0.00 81 S 8.53 4.77 0.00 3.88 3.98 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 82 L 8.66 5.29 0.00 1.54 1.63 0.91 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 83 I 9.17 4.31 1.90 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 1.20 1.31 0.92 0.00 0.00 84 G 8.21 3.80 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 0.00 0.00 0.00 *87 D 7.51 4.69 0.00 2.91 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 88 K 8.88 5.18 0.00 1.77 1.87 0.00 1.72 0.00 0.00 1.70 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.40 1.57 7.81 89 A 8.75 5.13 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 90 A 9.53 5.33 1.21 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 0.00 0.00 91 L 8.54 4.67 0.00 0.27 0.13 0.79 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 92 T 8.98 4.89 4.16 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 1.19 0.00 0.00 93 I 8.40 4.36 1.64 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 0.91 0.99 0.56 0.00 0.00 94 T 8.43 3.86 4.15 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 1.15 0.00 0.00 95 G 7.82 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 96 A 8.45 4.02 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 97 Q 8.24 4.89 0.00 2.14 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.73 6.74 0.00 0.00 0.00 0.00 0.00 2.21 2.19 0.00 98 T 8.55 3.94 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 99 E 8.15 4.10 0.00 2.17 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 0.00 2.42 2.33 0.00 100 D 7.83 4.74 0.00 2.90 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 0.00 101 E 7.94 4.45 0.00 2.01 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 2.59 0.00 102 A 8.28 4.37 1.08 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 0.00 103 I 7.87 4.75 1.66 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.53 0.44 0.00 0.00 104 Y 9.00 5.00 0.00 3.01 3.17 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 0.00 105 F 9.46 5.43 0.00 3.10 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 0.00 106 C 9.10 4.77 0.00 1.44 2.53 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 0.00 107 A 8.40 4.98 0.35 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 0.00 108 L 8.86 5.20 0.00 1.66 1.09 0.89 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 109 W 8.56 4.39 0.00 1.78 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 0.00 110 Y 7.36 4.29 0.00 2.33 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 S 7.09 4.05 0.00 3.93 3.80 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 *135 N 8.22 4.81 0.00 2.83 2.88 0.00 0.00 6.26 7.90 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 0.00 136 H 5.29 4.35 0.00 3.10 3.19 0.00 5.43 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 W 9.02 5.45 0.00 3.17 2.91 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 0.00 0.00 0.00 138 V 8.85 4.54 2.36 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 1.13 0.00 0.00 1.00 0.00 0.00 139 F 9.11 5.10 0.00 2.98 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 0.00 140 G 9.27 4.09 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 G 8.85 3.91 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 0.00 0.00 0.00 0.00 0.00 0.00 142 G 9.43 3.55 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 0.00 0.00 0.00 143 T 8.38 4.94 4.37 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 1.24 0.00 0.00 144 K 9.09 4.44 0.00 1.87 1.69 0.00 1.70 0.00 0.00 1.56 0.00 0.00 2.90 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.43 1.44 7.81 145 L 9.21 5.18 0.00 1.72 1.80 0.80 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 146 T 8.82 4.69 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 1.28 0.00 0.00 147 V 9.09 4.51 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 0.76 0.00 0.00 0.96 0.00 0.00 148 L 8.73 4.26 0.00 1.67 1.56 0.92 0.92 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 * Residues marked with a * may have inaccurate shift predictions.