NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 11 D 4.5749 8.3644 120.1917 54.1398 42.1920 175.3005 12 S 4.0973 8.7783 121.2637 59.9180 62.9645 172.4161 13 N 4.8875 8.6889 119.2803 53.3901 39.4139 174.8306 14 T 4.4957 7.6727 114.6111 61.6128 70.4428 174.7080 15 K 4.2149 8.6849 126.9713 55.7385 32.9575 177.9417 16 G 4.0667 8.4199 110.6297 42.7697 0.0000 174.0500 17 W 4.9766 8.8527 129.0223 61.1565 30.3855 177.9808 18 S 3.8305 8.1097 114.0908 61.5062 62.3487 176.1886 19 E 3.9224 8.0940 121.5442 59.0451 29.2067 178.8273 20 V 3.5683 7.8366 117.6849 65.9490 31.9749 177.6241 21 L 3.8250 7.6734 118.9371 57.6799 41.2873 179.3383 22 K 4.2924 7.7402 121.3007 58.8735 31.8705 178.5124 23 G 3.7398 8.0517 103.9001 46.1960 0.0000 174.8031 24 S 4.4564 7.8694 115.7673 58.2982 63.8151 173.8717 25 E 4.2469 7.2170 123.2960 56.8013 30.6811 175.6589 26 C 4.8809 8.7371 123.4596 57.0392 45.3861 172.4501 27 K 4.5429 8.6607 124.4042 55.2955 36.1220 172.8786 28 P 4.8801 0.0000 0.0000 62.7708 31.8456 176.3419 29 R 4.8390 9.5977 124.0734 53.4160 34.3238 172.9496 30 P 4.9425 0.0000 0.0000 62.7550 32.3392 175.5859 31 I 4.6811 8.6655 116.6744 58.9454 41.3459 174.3058 32 V 4.3907 8.3555 124.5599 62.4558 32.4165 175.1440 33 V 4.4541 8.7415 127.9129 60.2519 34.4895 173.1049 34 P 4.7300 0.0000 0.0000 62.3133 32.2391 177.5114 35 V 3.7736 8.8376 123.5540 66.0304 31.6436 178.4108 36 S 4.3036 8.2307 112.9189 60.7262 62.9784 174.4694 37 E 4.6300 7.9463 119.5464 56.1762 29.4648 176.0097 38 T 4.4541 8.1486 109.8684 63.1382 70.6431 174.7250 39 H 4.7258 7.8544 122.2379 53.3129 27.8455 172.7749 40 P 4.7210 0.0000 0.0000 62.2735 31.3345 176.9242 41 E 4.4797 8.0126 115.7565 56.6359 30.6550 176.3187 42 L 4.8868 7.8250 119.0293 54.9487 42.9922 178.2894 43 T 4.1370 8.0480 116.4745 65.8757 68.4479 175.9628 44 S 4.5535 7.9641 115.6150 59.0410 62.7340 173.4744 45 Q 4.3743 7.6996 120.5173 54.2568 31.9452 174.2598 46 R 4.5286 8.0766 122.2791 54.7277 32.1738 175.6577 47 F 5.1649 8.4282 118.7280 55.7272 43.0041 173.6463 48 N 5.0436 9.2128 122.2178 51.2392 40.2939 172.2027 49 P 4.9275 0.0000 0.0000 61.7482 33.1318 175.3824 50 P 4.5092 0.0000 0.0000 63.5870 31.6529 174.8950 51 C 5.1685 7.3058 112.6500 57.8218 33.0072 173.3065 52 V 4.4684 8.5971 111.6155 59.8680 36.0314 174.8655 53 T 4.7635 8.2792 119.3529 62.8045 69.3802 174.2926 54 L 4.9076 8.4559 126.2211 52.8639 45.4290 175.7611 55 M 4.6734 8.4444 122.4227 55.4450 32.9804 175.7680 56 R 4.7469 9.0391 122.0658 54.3423 35.2402 173.9407 57 C 4.8903 9.1446 119.5329 57.4529 41.7204 173.2032 58 G 3.7790 9.0118 108.9140 45.8245 0.0000 170.0787 59 G 4.3698 9.1318 103.9689 44.7907 0.0000 172.6484 60 C 4.8285 8.2910 112.4772 56.5566 32.4974 173.1190 61 C 4.6987 8.4114 118.8382 55.7218 41.2730 174.4121 62 N 4.0761 8.6792 120.1053 55.7850 39.0504 174.6425 63 D 4.8791 7.6275 117.8737 51.7537 43.7229 176.0779 64 E 4.0741 8.9598 124.6761 58.9299 29.9139 177.8433 65 S 4.3676 8.6864 113.5850 59.1579 63.6297 173.3591 66 L 5.2564 7.6803 121.1190 53.2266 43.9901 175.4305 67 E 4.6836 9.0006 121.7652 54.4720 33.3974 174.0756 68 C 4.9581 8.8738 126.2850 56.3070 45.1322 172.7606 69 V 4.8193 8.7323 120.1213 58.5078 35.4918 173.4683 70 P 4.9002 0.0000 0.0000 63.1621 31.5665 176.0515 71 T 4.5157 8.7402 112.7164 61.5511 70.4599 173.9153 72 E 4.7508 7.9058 123.2018 54.6360 33.3394 173.6391 73 E 5.2408 8.7502 124.5689 54.9181 33.6245 175.1145 74 V 4.6281 8.7682 115.7492 59.6058 36.5501 174.4966 75 N 5.1567 8.7315 119.9012 53.1147 39.6895 174.8236 76 V 4.5096 8.9570 122.0860 61.5074 34.8425 174.2785 77 T 5.1487 8.6229 123.5858 62.4530 70.6494 173.8994 78 M 4.9289 9.0251 123.7940 53.6245 36.6603 174.3625 79 E 4.7145 8.8408 122.3261 56.3124 30.7181 176.1710 80 L 4.8865 9.0218 123.1462 52.9263 46.8133 175.4942 81 L 4.0733 9.0137 123.1849 55.1572 42.2764 176.8745 82 G 3.6747 9.0339 115.1274 47.4476 0.0000 177.5407 *90 G 4.0617 7.4989 105.0174 45.3368 0.0000 173.0689 91 M 4.8600 8.8479 125.8313 55.4917 32.9322 174.9656 92 Q 4.7536 9.3535 124.4197 54.1615 33.0700 174.4697 93 R 4.8777 8.5938 121.8332 55.2287 31.3068 175.7431 94 L 4.6128 8.8381 124.1421 52.7972 44.9346 175.3925 95 S 5.1656 8.2422 116.6126 56.8217 64.4343 172.9621 96 F 4.9628 9.1562 123.5287 55.8570 43.7652 173.4556 97 V 4.7270 8.5203 120.4377 61.6782 32.7491 174.8260 98 E 4.9656 9.4323 127.0849 54.9707 33.0898 174.4009 99 H 5.2982 8.7651 119.5288 54.7730 29.6123 175.2892 100 K 4.5291 8.9859 122.2402 56.5268 33.6067 176.2977 101 K 4.6790 7.6737 120.1750 55.4077 35.6576 174.9625 102 C 5.5850 8.5177 121.4861 55.8083 44.7822 172.5175 103 D 4.7563 8.7652 118.0640 53.3827 44.8838 173.6863 104 C 5.0530 8.7974 122.3221 56.8791 40.3139 173.1428 105 R 4.8687 8.8101 123.1587 53.1691 33.5183 173.6867 106 P 4.6445 0.0000 0.0000 63.3051 31.9553 176.4418 107 R 4.1493 8.4837 123.0798 56.1393 30.7155 176.4639 108 F 4.6343 8.9020 125.8797 58.3327 40.2499 175.2476 109 T 3.8117 8.3476 123.1642 63.5958 68.8644 173.7642 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 11 D 8.36 4.57 0.00 2.64 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 12 S 8.78 4.10 0.00 3.96 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 13 N 8.69 4.89 0.00 2.75 2.80 0.00 0.00 6.78 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 14 T 7.67 4.50 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 1.23 0.00 0.00 15 K 8.68 4.21 0.00 1.76 1.79 0.00 1.64 0.00 0.00 1.72 0.00 0.00 3.11 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.44 1.85 7.81 16 G 8.42 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 0.00 0.00 0.00 17 W 8.85 4.98 0.00 3.30 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 18 S 8.11 3.83 0.00 3.88 3.82 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 19 E 8.09 3.92 0.00 2.03 2.05 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 2.36 2.35 0.00 20 V 7.84 3.57 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 1.01 0.00 0.00 1.08 0.00 0.00 21 L 7.67 3.82 0.00 1.42 1.36 0.01 0.22 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 22 K 7.74 4.29 0.00 1.76 1.89 0.00 1.63 0.00 0.00 1.71 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.40 1.53 7.81 23 G 8.05 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 24 S 7.87 4.46 0.00 4.05 4.20 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 25 E 7.22 4.25 0.00 1.88 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 2.28 2.46 0.00 26 C 8.74 4.88 0.00 2.98 3.01 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 27 K 8.66 4.54 0.00 1.82 1.83 0.00 1.35 0.00 0.00 1.79 0.00 0.00 2.79 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.49 1.37 7.81 28 P 0.00 4.88 0.00 1.96 2.24 0.00 3.61 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 2.13 2.13 0.00 29 R 9.60 4.84 0.00 1.60 1.75 0.00 3.12 0.00 0.00 3.21 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.66 0.00 30 P 0.00 4.94 0.00 2.04 2.03 0.00 3.69 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.94 0.00 31 I 8.67 4.68 1.85 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 1.07 0.74 0.94 0.00 0.00 32 V 8.36 4.39 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 0.74 0.00 0.00 0.90 0.00 0.00 33 V 8.74 4.45 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 1.03 0.00 0.00 0.88 0.00 0.00 34 P 0.00 4.73 0.00 2.26 1.99 0.00 3.67 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.08 0.00 35 V 8.84 3.77 2.24 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 0.89 0.00 0.00 0.99 0.00 0.00 36 S 8.23 4.30 0.00 4.08 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 37 E 7.95 4.63 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 2.29 2.30 0.00 38 T 8.15 4.45 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 1.45 0.00 0.00 39 H 7.85 4.73 0.00 3.23 3.51 0.00 5.81 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 P 0.00 4.72 0.00 2.05 2.10 0.00 3.71 0.00 0.00 4.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.04 0.00 41 E 8.01 4.48 0.00 2.08 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 2.25 2.27 0.00 42 L 7.83 4.89 0.00 1.85 1.82 1.05 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 43 T 8.05 4.14 4.27 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 1.24 0.00 0.00 44 S 7.96 4.55 0.00 3.85 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 45 Q 7.70 4.37 0.00 1.82 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.65 6.69 0.00 0.00 0.00 0.00 0.00 1.60 2.04 0.00 46 R 8.08 4.53 0.00 1.73 1.78 0.00 3.16 0.00 0.00 3.20 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.55 0.00 47 F 8.43 5.16 0.00 3.00 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 48 N 9.21 5.04 0.00 2.78 2.74 0.00 0.00 6.85 8.49 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 49 P 0.00 4.93 0.00 2.30 2.17 0.00 3.78 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.96 0.00 50 P 0.00 4.51 0.00 2.29 2.38 0.00 3.91 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.94 0.00 51 C 7.31 5.17 0.00 3.16 2.92 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 52 V 8.60 4.47 1.69 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 0.47 0.00 0.00 0.23 0.00 0.00 53 T 8.28 4.76 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 1.15 0.00 0.00 54 L 8.46 4.91 0.00 1.47 1.43 0.91 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 55 M 8.44 4.67 0.00 1.95 1.98 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.63 0.00 56 R 9.04 4.75 0.00 1.59 1.66 0.00 3.17 0.00 0.00 2.71 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.66 0.00 57 C 9.14 4.89 0.00 2.93 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 58 G 9.01 3.78 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 0.00 0.00 0.00 59 G 9.13 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 0.00 0.00 0.00 0.00 60 C 8.29 4.83 0.00 3.04 2.86 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 61 C 8.41 4.70 0.00 3.01 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 62 N 8.68 4.08 0.00 2.68 2.85 0.00 0.00 6.71 8.47 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 63 D 7.63 4.88 0.00 2.58 2.45 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 64 E 8.96 4.07 0.00 2.12 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 0.00 2.28 2.25 0.00 65 S 8.69 4.37 0.00 4.04 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 0.00 66 L 7.68 5.26 0.00 1.64 1.62 0.93 0.60 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 67 E 9.00 4.68 0.00 2.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.24 0.00 68 C 8.87 4.96 0.00 3.03 3.01 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 69 V 8.73 4.82 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 0.75 0.00 0.00 0.96 0.00 0.00 70 P 0.00 4.90 0.00 1.81 1.46 0.00 3.67 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 1.85 1.69 0.00 71 T 8.74 4.52 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 1.24 0.00 0.00 72 E 7.91 4.75 0.00 1.99 1.74 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 2.26 2.31 0.00 73 E 8.75 5.24 0.00 1.82 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.26 0.00 74 V 8.77 4.63 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 0.71 0.00 0.00 0.95 0.00 0.00 75 N 8.73 5.16 0.00 2.62 2.75 0.00 0.00 6.65 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 76 V 8.96 4.51 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 1.10 0.00 0.00 1.04 0.00 0.00 77 T 8.62 5.15 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 1.21 0.00 0.00 78 M 9.03 4.93 0.00 1.93 2.08 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.53 0.00 79 E 8.84 4.71 0.00 1.87 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 2.32 2.35 0.00 80 L 9.02 4.89 0.00 1.43 1.52 0.96 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 81 L 9.01 4.07 0.00 1.91 1.65 0.95 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 82 G 9.03 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 *90 G 7.50 4.06 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 0.00 0.00 0.00 0.00 0.00 0.00 91 M 8.85 4.86 0.00 2.05 2.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.65 0.00 92 Q 9.35 4.75 0.00 2.08 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.65 0.00 0.00 0.00 0.00 0.00 2.33 2.58 0.00 93 R 8.59 4.88 0.00 1.67 1.85 0.00 3.15 0.00 0.00 3.23 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.65 0.00 94 L 8.84 4.61 0.00 1.22 0.78 0.10 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 95 S 8.24 5.17 0.00 3.79 3.60 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 96 F 9.16 4.96 0.00 2.92 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 97 V 8.52 4.73 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 0.85 0.00 0.00 1.00 0.00 0.00 98 E 9.43 4.97 0.00 1.90 1.81 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 2.25 2.27 0.00 99 H 8.77 5.30 0.00 3.01 3.20 0.00 5.64 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 K 8.99 4.53 0.00 1.61 1.83 0.00 1.72 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.39 1.36 7.81 101 K 7.67 4.68 0.00 1.78 1.57 0.00 1.65 0.00 0.00 1.81 0.00 0.00 2.82 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.40 1.46 7.81 102 C 8.52 5.58 0.00 2.83 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 0.00 103 D 8.77 4.76 0.00 2.75 2.43 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 0.00 104 C 8.80 5.05 0.00 2.90 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 0.00 105 R 8.81 4.87 0.00 1.69 1.78 0.00 3.31 0.00 0.00 3.16 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.70 0.00 106 P 0.00 4.64 0.00 1.96 2.04 0.00 3.69 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 2.05 2.17 0.00 107 R 8.48 4.15 0.00 1.74 1.90 0.00 3.17 0.00 0.00 3.16 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.79 0.00 108 F 8.90 4.63 0.00 2.86 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 0.00 109 T 8.35 3.81 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 1.10 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.