NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 T 4.2540 8.1749 117.3742 63.0820 69.7539 173.8769 3 D 4.3304 8.6102 125.5065 52.8661 39.1901 173.1285 4 Q 4.4046 8.5853 122.4021 53.7475 31.6855 175.1165 5 A 4.3324 8.6655 126.7467 51.2362 19.1507 176.1381 6 T 4.6383 8.2492 113.4530 59.0564 71.3480 172.2151 7 P 4.4324 0.0000 0.0000 62.8434 33.0363 174.9035 8 N 5.2190 8.7466 120.2570 50.9958 39.7216 173.7200 9 L 4.7157 7.5679 123.6354 51.9404 45.0234 173.8323 10 P 3.8568 0.0000 0.0000 62.1432 32.4789 175.4081 11 S 4.6106 8.6416 117.5173 56.8759 65.2687 174.6883 12 R 3.9085 8.6278 126.0024 58.7572 30.3740 176.0579 13 D 4.8434 7.6825 116.7029 52.4419 42.6782 176.8323 14 F 4.6309 8.6231 124.0727 59.5550 39.9235 177.5635 15 D 4.3604 8.5191 121.0636 57.2752 40.9163 178.3916 16 S 4.1153 8.3505 115.5163 62.1624 62.7834 177.0866 17 T 3.7947 7.6865 117.6517 66.3019 67.9892 176.4819 18 A 4.0006 7.4588 122.7553 55.3704 18.2805 179.5379 19 A 4.0798 7.9332 117.5926 55.0610 18.3551 179.3864 20 F 3.9364 7.7781 118.2999 61.7787 39.6976 176.5940 21 Y 3.8579 7.8992 116.2950 60.6187 37.7020 177.5788 22 E 4.1277 8.2686 121.7861 59.7810 29.6309 179.4209 23 R 3.9085 7.9073 116.4938 59.3166 30.2973 177.8888 24 L 4.0359 7.5679 114.3974 55.1201 40.8975 177.2118 25 G 3.7196 8.3786 107.2038 46.3560 0.0000 173.6705 26 F 4.8957 8.3296 119.5936 55.2835 39.0668 175.3532 27 G 3.7659 8.6884 114.7064 46.2742 0.0000 172.1006 28 I 4.6687 8.4158 126.0965 60.9929 35.4062 175.7085 29 V 4.0192 8.4729 120.3394 62.9116 32.7648 176.3273 30 F 4.9127 8.1280 121.4773 56.3633 42.9648 174.1545 31 R 5.0914 7.8903 124.7291 55.1806 33.7018 173.5490 32 D 4.9577 8.4026 125.1897 53.6788 39.4615 177.7420 33 A 4.3325 8.9260 117.9850 54.0921 19.5118 178.5011 34 G 4.1291 9.1750 103.5041 47.7123 0.0000 174.1090 35 W 5.6327 9.4011 129.9277 55.7728 34.4153 174.7301 36 M 4.6610 8.1057 125.5035 54.3259 34.7069 173.7056 37 I 4.5440 8.7968 128.9000 60.1978 38.9446 175.0513 38 L 5.0455 8.6802 128.3480 53.0249 44.0707 175.6967 39 Q 4.8326 8.9984 125.2306 53.4448 32.3317 174.0318 40 R 4.4296 7.6778 128.4709 55.9223 29.5690 178.5221 41 G 3.7735 9.0123 118.2819 45.7842 0.0000 171.9052 42 D 4.9426 8.9306 115.7432 54.0024 43.0677 177.4583 43 L 4.2431 7.5034 118.8958 54.4063 39.6997 177.1418 44 M 4.6543 7.5559 118.1328 54.7060 32.5103 175.3699 45 L 4.0307 8.9638 126.2035 53.4466 42.6167 175.3774 46 E 4.7345 8.2039 126.5211 54.5926 28.7569 174.3759 47 F 4.4548 8.6054 122.3201 56.9180 40.6127 174.3568 48 F 5.5525 8.7861 118.8701 55.4123 40.3304 175.3335 49 A 4.3937 8.8347 123.4662 52.6091 17.9246 176.5112 50 H 4.8130 8.7245 122.5783 54.4472 29.5470 171.8963 51 P 4.3020 0.0000 0.0000 64.9518 32.1626 178.4111 52 G 3.9190 7.8817 109.2883 43.8878 0.0000 172.3808 53 L 4.5440 7.3209 119.7158 53.0872 44.8564 174.7801 54 D 4.6412 8.5249 125.4344 52.5481 42.0945 174.4191 55 P 4.2873 0.0000 0.0000 64.8790 31.6873 178.8048 56 L 3.8984 8.0990 116.9958 57.7350 41.7449 178.1916 57 A 4.2227 8.1045 120.0089 52.5357 18.5719 177.9435 58 S 4.7042 7.7602 116.7728 57.7910 62.0271 173.6656 59 W 4.3271 8.5751 127.6824 58.1299 29.3893 176.9735 60 F 4.6486 7.7928 119.5442 57.5725 39.2816 174.6399 61 S 5.1631 8.6379 115.7072 57.9122 65.5600 173.9266 62 C 4.7868 8.2369 115.9601 57.0626 33.3721 172.9803 63 C 4.8723 8.5003 119.1119 58.5117 28.4494 173.8908 64 L 4.1437 8.4663 125.6457 54.3403 41.7517 176.7121 65 R 4.3759 8.4063 124.1429 55.2506 30.5082 175.9313 66 L 4.6518 8.6936 125.1287 53.1256 43.5682 178.1935 67 D 4.2890 8.8914 122.5998 56.2628 41.0231 176.0926 68 D 4.8691 7.8374 119.0739 51.9048 42.5188 175.9220 69 L 3.8837 9.1504 129.4451 58.2652 42.5204 179.0796 70 A 4.2471 8.2246 119.7761 54.7944 18.2025 179.0298 71 E 3.9025 8.0887 118.0260 59.5843 29.7723 178.6182 72 F 4.0236 8.4817 120.1697 61.7093 39.0831 176.3312 73 Y 3.9646 8.1467 117.7932 60.3598 38.6462 177.4242 74 R 3.9987 8.6542 119.6946 59.5924 30.2925 178.6063 75 Q 3.9079 8.0353 119.9747 58.7987 28.9444 177.7817 76 C 3.8147 7.8116 117.6548 63.0486 27.9930 176.5764 77 K 3.9504 7.2816 118.1497 58.8359 31.9017 179.5325 78 S 4.2068 7.8075 114.5165 61.6319 62.9468 176.8861 79 V 3.9204 7.5030 114.6604 60.9122 32.5689 176.5864 80 G 4.2204 7.3913 108.3582 45.9773 0.0000 171.6045 81 I 4.5355 7.3314 121.7018 59.6954 41.2123 175.0509 82 Q 4.1358 8.6267 124.2613 55.9165 30.1513 174.9709 83 E 4.4438 8.6947 124.3149 55.2125 29.5682 174.9362 84 T 4.5627 7.9984 120.5196 60.6048 70.2128 173.3456 85 S 4.2836 9.0002 122.7441 61.0654 63.6733 174.6470 86 S 4.3590 7.6108 116.8401 56.9163 63.3397 174.0985 87 G 4.0047 9.8147 109.7989 45.2396 0.0000 172.3088 88 Y 5.0190 7.2107 115.9537 54.5647 40.7121 173.2018 89 P 4.9015 0.0000 0.0000 63.1561 32.7715 175.0897 90 R 5.0949 9.0882 117.0924 55.3162 33.3799 173.4353 91 I 5.1523 8.5762 112.6788 59.5942 40.7937 174.2465 92 H 5.1618 9.3756 122.2987 53.9370 31.9816 173.9823 93 A 4.0462 8.3408 121.6067 50.6372 20.2331 175.9370 94 P 4.6605 0.0000 0.0000 63.0613 29.1146 175.9590 95 E 4.6876 8.6600 123.5868 54.2690 32.8172 174.7186 96 L 4.7705 8.2652 121.4808 54.3620 42.6007 176.5009 97 Q 4.5969 8.1167 124.0434 54.6151 32.7575 176.7006 *98 E 4.4681 8.5269 116.8003 54.1516 28.4290 176.3515 99 W 5.3733 6.8991 118.3812 57.2094 34.9609 175.5647 100 G 3.7652 6.0059 114.2196 44.7388 0.0000 174.4163 101 G 3.4621 5.3800 105.3968 44.3313 0.0000 174.6626 102 T 4.8423 8.4857 114.7558 60.7131 71.7364 171.2573 103 M 5.3865 9.0345 126.3980 54.2508 36.0392 174.4846 104 A 5.0188 9.0563 127.6846 50.2664 21.9154 175.6779 105 A 4.9355 8.6559 119.2898 50.3889 22.2018 175.3203 106 L 4.7680 8.8738 125.4457 55.1751 43.8877 175.7561 107 V 5.1681 9.0575 126.2119 60.3107 33.9457 175.2421 108 D 4.2771 8.5414 128.2379 51.4062 41.0452 174.9883 109 P 4.2330 0.0000 0.0000 65.8105 31.5155 177.0060 110 D 4.4615 8.0903 116.6871 54.0885 40.6179 177.3886 111 G 3.7610 7.3943 105.4165 46.4928 0.0000 174.0071 112 T 4.4249 7.8606 117.1799 62.3610 69.3423 174.3373 113 L 4.6744 8.6690 130.8634 54.4108 41.4880 173.8323 114 L 4.7056 8.9856 122.6137 53.5868 43.0148 176.3713 115 R 4.3294 8.6455 125.3045 55.4506 31.0310 176.5334 116 L 4.3115 8.9660 126.6197 54.1073 41.5823 175.8375 117 I 4.5545 8.3401 125.1640 60.1171 38.9942 175.0083 118 Q 4.4363 8.5736 128.0946 55.9328 29.3048 175.6640 119 N 4.5641 8.7649 124.4674 53.1625 39.5369 175.9251 120 E 4.4894 8.3799 122.5617 54.8456 28.5754 177.0439 121 L 4.0249 7.8061 121.8340 57.5558 42.6438 179.9991 122 L 4.0117 8.3847 116.9184 56.9707 41.8641 178.2121 123 A 4.2791 8.1031 119.7845 54.6286 19.1678 178.9105 124 G 3.7048 8.3191 103.7475 48.0437 0.0000 174.3851 125 I 4.1264 7.3334 119.4369 62.7864 38.2115 175.8856 126 S 4.3468 7.7674 118.2432 58.5341 63.2174 173.9074 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 T 8.17 4.25 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 3 D 8.61 4.33 0.00 2.72 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 4 Q 8.59 4.40 0.00 2.10 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 7.23 0.00 0.00 0.00 0.00 0.00 2.31 2.31 0.00 5 A 8.67 4.33 1.26 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 6 T 8.25 4.64 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 1.22 0.00 0.00 7 P 0.00 4.43 0.00 2.03 2.17 0.00 3.77 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 1.94 1.93 0.00 8 N 8.75 5.22 0.00 2.79 3.02 0.00 0.00 7.25 8.08 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 9 L 7.57 4.72 0.00 0.46 1.25 0.59 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 10 P 0.00 3.86 0.00 1.50 1.12 0.00 3.36 0.00 0.00 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.44 0.00 11 S 8.64 4.61 0.00 3.49 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 12 R 8.63 3.91 0.00 1.82 1.91 0.00 3.14 0.00 0.00 3.29 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.61 0.00 13 D 7.68 4.84 0.00 2.70 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 14 F 8.62 4.63 0.00 3.01 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 15 D 8.52 4.36 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 16 S 8.35 4.12 0.00 3.84 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 17 T 7.69 3.79 3.92 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 0.00 0.00 0.48 0.00 0.00 18 A 7.46 4.00 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 19 A 7.93 4.08 1.37 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 0.00 0.00 20 F 7.78 3.94 0.00 2.84 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 21 Y 7.90 3.86 0.00 2.73 2.07 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 22 E 8.27 4.13 0.00 2.05 2.12 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 2.34 2.42 0.00 23 R 7.91 3.91 0.00 1.68 1.89 0.00 3.16 0.00 0.00 3.15 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.59 0.00 24 L 7.57 4.04 0.00 1.99 1.53 0.65 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 25 G 8.38 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 0.00 0.00 0.00 26 F 8.33 4.90 0.00 3.12 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 27 G 8.69 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 28 I 8.42 4.67 1.89 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.62 0.90 0.00 0.00 29 V 8.47 4.02 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 0.70 0.00 0.00 1.11 0.00 0.00 30 F 8.13 4.91 0.00 3.19 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 31 R 7.89 5.09 0.00 1.68 1.66 0.00 3.23 0.00 0.00 3.29 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.64 0.00 32 D 8.40 4.96 0.00 2.90 2.38 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 33 A 8.93 4.33 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 34 G 9.17 4.13 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 0.00 35 W 9.40 5.63 0.00 3.56 3.37 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 36 M 8.11 4.66 0.00 0.98 0.57 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.22 0.00 37 I 8.80 4.54 2.02 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 1.31 1.51 0.97 0.00 0.00 38 L 8.68 5.05 0.00 1.65 1.70 0.88 0.47 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 39 Q 9.00 4.83 0.00 2.16 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.65 6.86 0.00 0.00 0.00 0.00 0.00 2.34 2.12 0.00 40 R 7.68 4.43 0.00 0.81 1.00 0.00 3.07 0.00 0.00 3.26 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.38 0.00 41 G 9.01 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 42 D 8.93 4.94 0.00 2.62 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 43 L 7.50 4.24 0.00 1.49 1.69 0.89 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 44 M 7.56 4.65 0.00 2.03 2.02 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.59 0.00 45 L 8.96 4.03 0.00 1.49 1.03 0.13 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 46 E 8.20 4.73 0.00 1.73 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 2.24 2.39 0.00 47 F 8.61 4.45 0.00 2.66 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 48 F 8.79 5.55 0.00 3.35 3.34 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 49 A 8.83 4.39 0.98 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 0.00 0.00 50 H 8.72 4.81 0.00 3.02 2.99 0.00 5.76 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 P 0.00 4.30 0.00 2.21 2.13 0.00 3.84 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.95 0.00 52 G 7.88 3.92 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 0.00 0.00 0.00 0.00 0.00 0.00 53 L 7.32 4.54 0.00 1.20 1.37 0.67 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 54 D 8.52 4.64 0.00 2.66 2.56 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.29 0.00 0.90 1.29 0.00 3.79 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.85 0.00 56 L 8.10 3.90 0.00 1.83 1.72 0.99 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 57 A 8.10 4.22 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 58 S 7.76 4.70 0.00 4.03 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 59 W 8.58 4.33 0.00 2.90 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 60 F 7.79 4.65 0.00 2.88 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 61 S 8.64 5.16 0.00 3.99 3.87 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 62 C 8.24 4.79 0.00 3.07 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 63 C 8.50 4.87 0.00 2.81 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 64 L 8.47 4.14 0.00 1.41 1.48 1.04 1.05 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 65 R 8.41 4.38 0.00 1.65 2.03 0.00 3.11 0.00 0.00 3.16 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.57 0.00 66 L 8.69 4.65 0.00 1.59 1.59 0.72 1.10 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 67 D 8.89 4.29 0.00 2.68 2.74 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 68 D 7.84 4.87 0.00 2.75 2.56 0.00 0.00 0.00 0.00 0.00 0.00 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 L 9.15 3.88 0.00 1.82 1.83 0.98 0.89 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 70 A 8.22 4.25 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 71 E 8.09 3.90 0.00 2.13 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 2.35 2.42 0.00 72 F 8.48 4.02 0.00 3.18 3.09 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 73 Y 8.15 3.96 0.00 3.29 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 74 R 8.65 4.00 0.00 2.19 2.01 0.00 3.28 0.00 0.00 3.36 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.76 0.00 75 Q 8.04 3.91 0.00 2.17 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.70 0.00 0.00 0.00 0.00 0.00 2.19 2.16 0.00 76 C 7.81 3.81 0.00 2.72 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 77 K 7.28 3.95 0.00 1.59 1.79 0.00 1.72 0.00 0.00 1.73 0.00 0.00 3.10 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.28 1.02 7.81 78 S 7.81 4.21 0.00 4.02 4.07 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 79 V 7.50 3.92 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 0.76 0.00 0.00 0.80 0.00 0.00 80 G 7.39 4.22 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 0.00 81 I 7.33 4.54 1.77 0.00 0.00 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.39 1.07 0.00 0.00 82 Q 8.63 4.14 0.00 2.11 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.99 0.00 0.00 0.00 0.00 0.00 2.51 2.35 0.00 83 E 8.69 4.44 0.00 1.99 1.95 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 2.31 2.25 0.00 84 T 8.00 4.56 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 1.29 0.00 0.00 85 S 9.00 4.28 0.00 4.07 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 86 S 7.61 4.36 0.00 3.86 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 87 G 9.81 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 0.00 0.00 0.00 88 Y 7.21 5.02 0.00 2.98 2.84 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 89 P 0.00 4.90 0.00 2.16 1.73 0.00 3.71 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.91 0.00 90 R 9.09 5.09 0.00 1.96 2.06 0.00 2.94 0.00 0.00 3.40 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.67 0.00 91 I 8.58 5.15 1.99 0.00 0.00 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 1.40 0.92 0.97 0.00 0.00 92 H 9.38 5.16 0.00 3.24 3.30 0.00 5.80 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 A 8.34 4.05 1.18 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 94 P 0.00 4.66 0.00 1.81 1.95 0.00 3.16 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.76 0.00 95 E 8.66 4.69 0.00 1.87 1.82 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 2.22 2.35 0.00 96 L 8.27 4.77 0.00 1.47 1.50 0.87 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 97 Q 8.12 4.60 0.00 1.51 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 7.59 0.00 0.00 0.00 0.00 0.00 2.46 2.65 0.00 *98 E 8.53 4.47 0.00 1.99 1.78 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 2.23 1.86 0.00 99 W 6.90 5.37 0.00 3.43 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 0.00 100 G 6.01 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 0.00 101 G 5.38 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 T 8.49 4.84 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 1.19 0.00 0.00 103 M 9.03 5.39 0.00 2.29 2.18 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.58 0.00 104 A 9.06 5.02 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 0.00 105 A 8.66 4.94 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 0.00 106 L 8.87 4.77 0.00 2.07 1.89 1.24 1.17 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 0.00 107 V 9.06 5.17 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 1.29 0.00 0.00 1.00 0.00 0.00 108 D 8.54 4.28 0.00 2.20 2.84 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 0.00 109 P 0.00 4.23 0.00 1.84 2.04 0.00 2.89 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.55 0.00 110 D 8.09 4.46 0.00 2.85 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 0.00 111 G 7.39 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 0.00 0.00 0.00 112 T 7.86 4.42 4.43 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 1.36 0.00 0.00 113 L 8.67 4.67 0.00 1.83 1.61 0.97 0.55 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 0.00 114 L 8.99 4.71 0.00 1.89 1.73 1.15 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 115 R 8.65 4.33 0.00 1.80 1.89 0.00 3.11 0.00 0.00 3.19 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.64 0.00 116 L 8.97 4.31 0.00 1.62 1.54 1.16 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 117 I 8.34 4.55 1.80 0.00 0.00 0.46 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 0.69 0.90 0.00 0.00 118 Q 8.57 4.44 0.00 2.15 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.74 7.11 0.00 0.00 0.00 0.00 0.00 2.40 2.45 0.00 119 N 8.76 4.56 0.00 2.79 2.77 0.00 0.00 7.38 7.87 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 0.00 120 E 8.38 4.49 0.00 2.14 1.96 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 2.53 2.59 0.00 121 L 7.81 4.02 0.00 1.69 1.74 0.94 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 122 L 8.38 4.01 0.00 1.64 1.75 0.91 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 123 A 8.10 4.28 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 0.00 124 G 8.32 3.70 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 0.00 125 I 7.33 4.13 2.01 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.65 0.92 0.00 0.00 126 S 7.77 4.35 0.00 4.00 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 * Residues marked with a * may have inaccurate shift predictions.