NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 D 4.6049 8.2233 120.1980 53.6512 43.6381 177.0946 8 K 4.0532 7.7440 117.3918 56.7270 32.6928 176.9654 9 T 4.2437 8.0403 107.2627 63.0854 69.6571 174.7441 10 Y 4.2882 7.7528 121.6397 59.8105 39.5083 176.2533 11 E 4.2153 8.0818 120.1107 59.0006 29.6280 178.4550 12 E 4.4923 8.0017 117.6756 56.5558 29.8076 178.5269 *14 V 3.8244 7.7572 118.4523 62.3467 33.5264 177.4777 15 K 4.0010 7.5290 118.7540 59.4618 31.9271 178.6350 16 E 3.8513 7.9812 119.5037 59.6339 29.3086 179.0039 17 V 3.5851 7.8712 117.6101 65.4809 31.3925 176.9286 18 E 4.2781 7.6133 115.1448 57.8184 30.3782 178.2999 19 R 3.9311 8.1311 119.2697 59.0591 29.9443 179.0408 20 L 3.9764 7.8685 118.8422 57.5927 41.3794 179.1969 21 K 4.1549 7.7234 117.0578 58.2403 32.5316 178.6031 22 L 3.9128 7.8680 123.0311 58.1628 42.2734 178.1996 23 E 4.0945 8.3895 117.0106 58.7617 29.7455 178.5057 24 N 4.3221 8.4949 118.3637 55.9870 38.6669 177.2142 25 K 4.1010 7.6610 119.7057 59.2455 32.0905 179.5274 26 T 3.9491 7.5827 116.4940 66.5135 68.3924 176.8985 27 L 4.0382 8.5697 121.4338 57.6599 41.3921 179.6986 28 K 4.0402 7.9101 117.7587 59.4946 32.2215 179.0878 29 Q 4.0808 8.0408 118.0459 58.7150 28.4545 178.5229 30 K 3.8336 7.6466 118.7922 59.9626 32.5110 178.9609 31 V 3.7889 7.8349 117.9428 65.8831 31.0793 177.7617 32 K 4.6240 7.8058 115.6661 56.3462 33.4268 177.7896 33 S 4.6858 8.8173 111.7869 56.3546 63.1295 172.9109 34 S 4.4844 8.0616 116.1100 58.5495 64.0308 175.2088 *42 S 4.2354 7.5767 117.1402 58.0481 63.6727 173.9711 43 I 3.8256 8.2477 125.5438 61.4656 37.5037 175.8110 44 L 4.4939 8.2381 124.2255 54.1420 43.0634 176.4566 45 T 4.6908 7.9205 110.3014 59.2902 72.9939 174.9361 46 A 3.9311 8.4645 122.8442 55.3699 18.2878 179.8918 47 A 3.9151 7.8940 118.6286 55.1739 18.4927 179.6344 48 K 3.8636 8.0842 118.1770 60.0863 32.2662 178.3759 49 R 3.8838 8.8115 119.5258 58.7510 29.9014 177.6598 50 E 3.8820 8.9890 119.0152 59.7058 29.4895 179.7013 51 S 4.0572 8.3686 112.9597 61.4399 62.5339 176.2321 52 I 3.8047 8.0549 122.8899 64.3547 36.8677 178.6213 53 I 3.6850 8.1650 121.0627 64.4651 36.6291 178.7533 54 V 3.9173 7.7801 118.5850 65.3101 31.0810 177.9579 55 S 4.1581 7.6750 111.8629 61.4473 62.3115 176.1765 56 S 4.1528 8.0487 117.8913 61.6092 62.4778 176.8345 57 S 4.1151 8.6160 118.2815 61.7645 62.6710 177.0209 58 R 4.0042 7.8236 119.6001 58.5247 29.8167 179.0768 59 A 3.9434 7.6599 121.0308 55.2316 18.4731 179.4545 60 L 4.0499 8.2261 117.7687 57.8751 41.4357 180.0879 61 G 3.6180 8.2630 104.8872 47.8520 0.0000 175.0991 62 A 4.1498 7.5537 121.8113 54.7832 18.6813 179.5965 63 V 3.7184 7.7520 116.0611 65.8973 31.5864 179.2258 64 A 3.9810 8.0431 118.7220 52.5590 17.9697 179.1111 *66 R 4.1817 7.9364 122.5089 57.9289 32.0767 177.5401 67 K 4.1481 8.2000 117.1963 59.2506 32.0352 179.0461 68 I 3.6614 8.2779 120.5579 64.8140 37.1301 177.8270 69 E 3.9375 8.3441 118.8241 59.2469 29.1565 178.7719 70 A 3.9797 8.1580 121.0590 55.0346 18.2095 179.5242 71 K 4.1305 7.9700 115.3688 58.1602 32.1565 179.3390 72 V 3.7341 7.5419 119.3997 65.6285 31.9561 177.7455 73 R 3.9740 7.8991 118.3491 59.4615 29.5308 178.4109 74 S 4.2189 7.6961 112.0648 61.2035 62.2881 175.8656 75 R 4.1520 7.7975 119.2969 58.2042 29.7499 178.5227 76 A 4.1212 8.7161 120.8732 54.5102 18.1362 179.3225 77 A 3.9576 7.4337 117.5189 54.7775 18.3763 179.4441 78 K 3.9914 7.4942 116.5929 58.7928 32.6195 177.4042 79 A 4.4533 6.8701 120.0495 52.0966 19.0734 177.0429 80 V 4.3196 9.3575 116.7014 62.0131 34.9047 175.8779 81 T 4.5668 7.7306 109.5679 59.5442 72.4107 174.9035 82 E 3.9452 8.5088 119.5054 59.9077 29.3880 179.7242 83 Q 4.0511 7.9924 117.4119 58.7018 28.8055 178.3469 84 E 3.9302 7.7508 119.4053 59.2863 29.5212 179.0604 85 L 3.9167 7.8080 120.1975 58.4824 41.9298 179.1443 86 T 3.8461 7.7227 114.3375 66.6292 68.5667 176.2747 87 S 4.2190 8.4790 115.3945 61.2997 62.1570 175.9495 88 L 3.9984 8.5123 123.4958 58.0765 41.6191 178.1229 89 L 4.5541 7.9066 115.9338 55.2762 41.4881 178.2661 90 Q 4.2440 7.7550 122.8626 58.5407 29.1625 177.1690 91 S 4.5936 7.5058 114.3114 56.5039 63.2870 174.0559 92 L 4.0159 8.1831 122.6976 56.8594 42.3416 175.9408 93 T 4.6998 8.3417 121.2845 61.7079 71.7511 173.2252 94 L 4.8646 8.3608 124.3054 52.7541 45.4704 175.6570 95 R 4.6080 8.4477 120.5898 54.4435 32.2407 175.2654 96 V 4.3849 8.2148 123.5427 61.0852 34.5725 173.9396 97 D 4.8667 8.7387 126.2025 52.7853 42.0813 175.9169 98 V 4.6817 7.9687 116.8021 60.0617 36.0145 176.9322 99 S 4.2925 7.7466 121.0560 58.4186 67.9526 174.3181 *101 E 4.1324 9.0984 118.2747 56.4498 29.6098 175.0186 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 7 D 8.22 4.60 0.00 2.69 2.69 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 8 K 7.74 4.05 0.00 1.90 1.84 0.00 1.75 0.00 0.00 1.87 0.00 0.00 3.06 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.49 1.51 7.81 9 T 8.04 4.24 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 1.24 0.00 0.00 10 Y 7.75 4.29 0.00 3.01 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 11 E 8.08 4.22 0.00 2.46 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 0.00 2.35 2.40 0.00 12 E 8.00 4.49 0.00 2.27 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 2.30 2.33 0.00 *14 V 7.76 3.82 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 0.90 0.00 0.00 0.67 0.00 0.00 15 K 7.53 4.00 0.00 1.78 1.82 0.00 1.73 0.00 0.00 1.56 0.00 0.00 2.94 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.61 7.81 16 E 7.98 3.85 0.00 2.18 1.91 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 2.28 2.35 0.00 17 V 7.87 3.59 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 1.00 0.00 0.00 0.86 0.00 0.00 18 E 7.61 4.28 0.00 2.30 2.15 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 2.23 2.37 0.00 19 R 8.13 3.93 0.00 1.85 2.02 0.00 3.11 0.00 0.00 3.16 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.85 0.00 20 L 7.87 3.98 0.00 1.92 1.69 0.93 0.81 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 21 K 7.72 4.15 0.00 1.95 2.04 0.00 1.29 0.00 0.00 1.56 0.00 0.00 2.87 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.63 1.43 7.81 22 L 7.87 3.91 0.00 2.15 1.82 0.91 0.68 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 23 E 8.39 4.09 0.00 2.23 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 2.28 2.34 0.00 24 N 8.49 4.32 0.00 2.82 2.90 0.00 0.00 6.85 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 25 K 7.66 4.10 0.00 1.88 1.84 0.00 1.72 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.65 7.81 26 T 7.58 3.95 4.40 0.00 0.00 0.00 0.00 0.00 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 27 L 8.57 4.04 0.00 1.84 1.71 0.95 1.04 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 28 K 7.91 4.04 0.00 1.88 1.87 0.00 1.70 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.47 1.75 7.81 29 Q 8.04 4.08 0.00 2.26 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.69 0.00 0.00 0.00 0.00 0.00 2.38 2.71 0.00 30 K 7.65 3.83 0.00 1.82 1.90 0.00 1.71 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.49 1.58 7.81 31 V 7.83 3.79 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 1.10 0.00 0.00 0.99 0.00 0.00 32 K 7.81 4.62 0.00 1.93 1.81 0.00 1.70 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.47 1.58 7.81 33 S 8.82 4.69 0.00 3.92 3.75 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 0.00 0.00 0.00 34 S 8.06 4.48 0.00 3.95 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 *42 S 7.58 4.24 0.00 3.88 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 43 I 8.25 3.83 1.87 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 1.41 0.34 0.91 0.00 0.00 44 L 8.24 4.49 0.00 1.61 1.58 0.92 0.81 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 45 T 7.92 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 1.21 0.00 0.00 46 A 8.46 3.93 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 47 A 7.89 3.92 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 48 K 8.08 3.86 0.00 1.89 1.93 0.00 1.53 0.00 0.00 1.57 0.00 0.00 2.98 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.49 7.81 49 R 8.81 3.88 0.00 2.01 1.99 0.00 3.19 0.00 0.00 3.09 7.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 50 E 8.99 3.88 0.00 2.21 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 2.32 2.41 0.00 51 S 8.37 4.06 0.00 3.97 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 52 I 8.05 3.80 1.91 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 1.82 0.65 0.91 0.00 0.00 53 I 8.16 3.68 1.97 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 1.41 0.40 0.91 0.00 0.00 54 V 7.78 3.92 2.15 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 0.99 0.00 0.00 0.97 0.00 0.00 55 S 7.67 4.16 0.00 4.09 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 0.00 56 S 8.05 4.15 0.00 3.92 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 57 S 8.62 4.12 0.00 3.86 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 58 R 7.82 4.00 0.00 2.06 1.98 0.00 3.18 0.00 0.00 3.17 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.84 0.00 59 A 7.66 3.94 1.36 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 0.00 0.00 0.00 60 L 8.23 4.05 0.00 1.84 1.75 0.92 1.16 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 61 G 8.26 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 62 A 7.55 4.15 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 63 V 7.75 3.72 2.21 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 1.00 0.00 0.00 0.93 0.00 0.00 64 A 8.04 3.98 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 *66 R 7.94 4.18 0.00 1.95 2.22 0.00 3.24 0.00 0.00 3.22 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.66 0.00 67 K 8.20 4.15 0.00 1.97 1.83 0.00 1.75 0.00 0.00 1.65 0.00 0.00 2.99 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.46 1.61 7.81 68 I 8.28 3.66 1.87 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 1.41 0.88 0.91 0.00 0.00 69 E 8.34 3.94 0.00 2.03 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 2.38 2.39 0.00 70 A 8.16 3.98 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 71 K 7.97 4.13 0.00 1.81 1.86 0.00 1.66 0.00 0.00 1.74 0.00 0.00 2.88 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.53 1.49 7.81 72 V 7.54 3.73 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 1.00 0.00 0.00 0.95 0.00 0.00 73 R 7.90 3.97 0.00 1.93 1.92 0.00 3.14 0.00 0.00 3.09 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 74 S 7.70 4.22 0.00 3.88 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 75 R 7.80 4.15 0.00 1.96 1.95 0.00 3.17 0.00 0.00 3.17 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.90 0.00 76 A 8.72 4.12 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 77 A 7.43 3.96 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 K 7.49 3.99 0.00 1.78 2.01 0.00 1.69 0.00 0.00 1.71 0.00 0.00 3.12 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.45 1.50 7.81 79 A 6.87 4.45 1.24 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 0.00 0.00 0.00 80 V 9.36 4.32 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 0.84 0.00 0.00 0.93 0.00 0.00 81 T 7.73 4.57 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 82 E 8.51 3.95 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 2.40 2.41 0.00 83 Q 7.99 4.05 0.00 2.09 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.91 0.00 0.00 0.00 0.00 0.00 2.45 2.44 0.00 84 E 7.75 3.93 0.00 2.05 1.99 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 2.33 2.31 0.00 85 L 7.81 3.92 0.00 1.89 1.66 0.92 0.87 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 86 T 7.72 3.85 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 1.21 0.00 0.00 87 S 8.48 4.22 0.00 3.92 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 88 L 8.51 4.00 0.00 1.86 1.85 0.96 0.77 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 89 L 7.91 4.55 0.00 1.71 1.67 0.92 0.83 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 90 Q 7.76 4.24 0.00 1.99 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 7.39 0.00 0.00 0.00 0.00 0.00 2.37 2.36 0.00 91 S 7.51 4.59 0.00 3.86 3.85 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 92 L 8.18 4.02 0.00 1.77 1.63 0.92 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 93 T 8.34 4.70 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 94 L 8.36 4.86 0.00 1.57 1.52 0.92 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 95 R 8.45 4.61 0.00 1.72 1.77 0.00 3.18 0.00 0.00 3.15 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.56 0.00 96 V 8.21 4.38 2.08 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 0.90 0.00 0.00 0.93 0.00 0.00 97 D 8.74 4.87 0.00 2.67 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 98 V 7.97 4.68 2.08 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 0.75 0.00 0.00 0.93 0.00 0.00 99 S 7.75 4.29 0.00 3.78 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 *101 E 9.10 4.13 0.00 2.02 1.89 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 2.21 2.31 0.00 * Residues marked with a * may have inaccurate shift predictions.