NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 12 V 3.9129 8.0544 120.3918 62.8705 31.4642 172.9403 13 S 4.1312 8.2467 118.9131 56.0637 62.2678 168.2099 14 V 4.0568 8.3665 128.4361 61.5528 33.2824 174.0545 15 E 4.6695 8.4502 127.1559 54.1632 31.9178 175.6156 16 S 4.3457 8.2460 121.8277 58.7487 64.4986 173.2960 17 S 5.4070 8.2112 116.8118 56.8863 66.2385 173.2315 18 W 5.6568 9.4469 121.1077 55.3004 33.7670 174.4431 19 R 5.4130 9.3187 120.7350 54.7538 33.7697 174.2285 20 Y 5.5894 8.5452 118.3567 55.6548 42.0533 173.8055 21 I 4.9286 8.5525 122.0398 59.8376 39.2578 175.9732 22 D 4.8564 8.9356 127.6845 52.3234 41.1648 176.9971 23 T 4.0353 8.3457 108.0522 64.2057 68.9092 175.1026 24 Q 4.1757 8.3562 119.8980 55.9208 28.9746 176.7017 25 G 3.8841 7.9894 106.6303 44.9768 0.0000 173.6487 26 Q 4.1134 7.9266 121.4408 55.9287 30.5340 174.4728 27 I 4.6556 8.0995 126.3871 60.2696 38.7001 174.5905 28 H 4.5671 9.1332 124.8937 54.4642 31.5692 173.4754 29 G 2.7701 8.1070 107.1704 43.0154 0.0000 171.1446 30 P 4.4819 0.0000 0.0000 62.6055 31.9790 175.6676 31 F 5.4802 9.1036 121.7960 55.6377 42.1342 175.3960 32 T 4.6644 8.8037 112.1879 62.1248 69.1279 174.1737 33 T 4.0556 8.7212 120.4206 66.6756 69.1033 174.9692 34 Q 4.0797 8.0773 122.9985 56.5081 27.3269 176.1339 *37 S 4.3359 7.9029 117.4213 58.3306 64.9589 175.4102 38 Q 3.9425 7.9125 119.0212 58.9495 28.4003 179.2580 39 W 4.2520 7.6607 119.2907 59.6001 29.0809 177.7610 40 Y 3.8594 7.8793 119.0082 60.9344 38.1467 178.0335 41 I 3.9999 8.0925 119.6448 64.2199 37.2734 177.7216 42 G 3.9593 7.8852 103.6145 44.2287 0.0000 174.2243 43 G 3.6616 7.9521 108.4763 46.2813 0.0000 174.6469 44 Y 4.0696 7.6405 116.1826 58.7112 38.0187 175.5153 45 F 5.0569 7.6594 119.0098 55.2796 40.8290 175.3443 46 A 4.2639 8.4959 129.1454 51.5841 19.1722 178.2510 47 S 4.2713 8.7582 115.8126 61.3540 63.0859 176.4505 48 T 4.2024 7.7919 109.3710 62.8251 69.4212 174.4475 49 L 3.9980 7.8036 126.2136 55.6602 43.2198 176.0050 50 Q 4.9674 8.8620 125.9581 55.8227 30.0387 175.1284 51 I 5.4646 9.4584 117.3040 59.5054 41.8090 174.3304 52 S 4.8903 9.1413 116.5355 57.0347 66.1785 172.6134 53 R 3.8315 8.3526 127.5937 54.5451 31.0703 175.2287 54 L 4.1676 7.8389 127.7860 53.8103 42.0295 179.2358 55 G 4.0602 9.0359 115.8961 45.1317 0.0000 174.4513 56 S 4.2183 7.5749 113.0442 60.3815 64.0320 174.5229 57 T 4.6693 7.2327 108.9601 58.8482 71.6603 171.6163 58 P 4.4211 0.0000 0.0000 62.9687 31.9251 175.7473 59 E 4.6872 8.1318 117.1770 55.5272 32.0827 175.2214 60 T 4.2919 8.1817 109.2652 62.1899 69.7169 175.5594 61 L 3.8334 7.8868 124.0123 55.9630 42.8084 176.1172 62 G 3.7336 8.5793 105.4597 46.6030 0.0000 173.4355 63 I 4.4328 8.7028 109.6919 59.4907 39.4890 175.4266 64 N 4.2541 8.3819 118.9914 55.4642 38.7894 174.4587 65 D 4.3376 9.0123 121.4342 54.8876 38.9460 173.0459 66 I 4.5069 7.1936 112.3334 59.3403 40.6978 174.4135 67 F 5.3666 8.6781 122.1925 56.1100 40.1075 175.2471 68 I 4.9381 8.6162 117.4177 58.8076 41.3303 175.2587 69 T 4.5399 8.9464 113.6350 61.5420 69.5829 174.9112 70 L 3.8517 8.6227 125.8523 58.8280 42.0261 179.3339 71 G 3.8579 8.6798 104.9391 48.0750 0.0000 175.2177 72 E 4.2207 8.2554 121.4625 58.6724 29.3966 179.3356 73 L 4.1544 7.8873 116.4736 56.6541 41.9436 178.4524 *75 T 4.3216 7.8039 115.6547 63.3483 70.6994 176.3087 76 K 3.9903 8.4282 120.8685 59.4790 31.8089 179.1796 77 L 3.9883 7.7662 117.6861 57.9415 41.9007 179.3025 78 E 4.1532 8.1333 117.6279 59.6075 29.3845 179.5161 79 K 4.0441 8.3454 117.2581 59.5246 32.0975 178.3768 80 Y 4.0113 7.9636 119.3336 58.3029 39.6022 175.3618 81 D 4.3794 8.2722 117.4403 55.0403 39.9542 174.0304 82 T 4.1327 8.0355 114.9583 63.6701 69.7317 175.2352 83 D 4.5853 8.7526 126.0404 52.9616 41.4181 175.9735 84 P 4.2235 0.0000 0.0000 65.7899 31.1580 179.0141 85 F 4.2258 7.9234 117.3489 60.8478 39.0725 177.5076 86 T 3.9942 9.0408 115.6458 66.9830 68.2683 176.5148 87 T 3.8900 8.0478 117.5962 66.8135 68.4790 176.0673 88 F 4.2026 8.3801 122.0682 61.6834 39.2179 176.9019 89 D 4.2820 8.1891 116.9060 57.3703 40.6896 178.7043 90 K 4.1213 8.5044 118.4680 58.5722 32.1192 178.5193 91 L 4.3290 7.8589 117.8117 55.6069 42.6840 177.0189 92 H 4.5488 7.8701 113.8672 55.6839 30.7986 174.7809 93 V 3.5527 7.2537 119.4781 62.6095 31.6718 175.1262 94 Q 4.5448 8.2528 126.1822 54.0773 30.6118 175.2660 95 T 4.1649 8.0675 110.8533 61.3124 69.7485 174.5448 96 T 4.0758 8.2403 110.5534 62.0177 68.9408 174.3454 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 12 V 8.05 3.91 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 0.94 0.00 0.00 0.92 0.00 0.00 13 S 8.25 4.13 0.00 3.95 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 14 V 8.37 4.06 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 0.79 0.00 0.00 0.97 0.00 0.00 15 E 8.45 4.67 0.00 1.94 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 2.26 2.35 0.00 16 S 8.25 4.35 0.00 3.89 3.13 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 17 S 8.21 5.41 0.00 3.65 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 18 W 9.45 5.66 0.00 3.41 3.21 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 19 R 9.32 5.41 0.00 1.82 1.97 0.00 3.19 0.00 0.00 3.30 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.51 0.00 20 Y 8.55 5.59 0.00 3.14 3.02 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 0.00 21 I 8.55 4.93 1.74 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.15 0.79 0.00 0.00 22 D 8.94 4.86 0.00 2.99 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 23 T 8.35 4.04 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 1.22 0.00 0.00 24 Q 8.36 4.18 0.00 2.19 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.65 0.00 0.00 0.00 0.00 0.00 2.38 2.46 0.00 25 G 7.99 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 26 Q 7.93 4.11 0.00 2.14 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.84 6.85 0.00 0.00 0.00 0.00 0.00 2.27 2.33 0.00 27 I 8.10 4.66 1.80 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 1.21 0.62 0.94 0.00 0.00 28 H 9.13 4.57 0.00 1.79 3.13 0.00 5.60 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 29 G 8.11 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 0.00 0.00 0.00 30 P 0.00 4.48 0.00 2.00 1.95 0.00 3.49 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.02 0.00 31 F 9.10 5.48 0.00 3.33 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 32 T 8.80 4.66 4.53 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 1.29 0.00 0.00 33 T 8.72 4.06 4.39 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 1.30 0.00 0.00 34 Q 8.08 4.08 0.00 2.35 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.39 0.00 0.00 0.00 0.00 0.00 2.31 2.28 0.00 *37 S 7.90 4.34 0.00 3.90 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 38 Q 7.91 3.94 0.00 1.73 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.59 0.00 0.00 0.00 0.00 0.00 2.28 2.44 0.00 39 W 7.66 4.25 0.00 2.95 2.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.88 3.86 0.00 3.14 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 I 8.09 4.00 2.11 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 1.53 0.86 0.92 0.00 0.00 42 G 7.89 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 43 G 7.95 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 0.00 0.00 0.00 44 Y 7.64 4.07 0.00 2.61 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 45 F 7.66 5.06 0.00 3.01 2.83 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.50 4.26 1.27 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 0.00 0.00 0.00 47 S 8.76 4.27 0.00 4.06 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 0.00 48 T 7.79 4.20 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 49 L 7.80 4.00 0.00 1.76 1.67 0.91 -0.03 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 50 Q 8.86 4.97 0.00 2.08 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.52 0.00 0.00 0.00 0.00 0.00 2.52 2.39 0.00 51 I 9.46 5.46 2.06 0.00 0.00 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 1.12 1.01 0.87 0.00 0.00 52 S 9.14 4.89 0.00 2.72 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 53 R 8.35 3.83 0.00 1.01 1.35 0.00 3.15 0.00 0.00 2.93 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 54 L 7.84 4.17 0.00 1.38 1.45 0.84 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 55 G 9.04 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 56 S 7.57 4.22 0.00 3.92 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 57 T 7.23 4.67 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 1.17 0.00 0.00 58 P 0.00 4.42 0.00 2.04 2.00 0.00 3.65 0.00 0.00 3.67 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 59 E 8.13 4.69 0.00 1.92 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 2.18 2.28 0.00 60 T 8.18 4.29 4.31 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 1.24 0.00 0.00 61 L 7.89 3.83 0.00 1.43 1.82 0.81 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 62 G 8.58 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 63 I 8.70 4.43 1.87 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 1.27 0.63 0.93 0.00 0.00 64 N 8.38 4.25 0.00 2.69 2.74 0.00 0.00 7.11 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 65 D 9.01 4.34 0.00 2.75 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 66 I 7.19 4.51 1.88 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 1.35 0.90 0.92 0.00 0.00 67 F 8.68 5.37 0.00 3.00 3.06 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 68 I 8.62 4.94 2.08 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.04 0.97 0.00 0.00 69 T 8.95 4.54 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 1.32 0.00 0.00 70 L 8.62 3.85 0.00 1.66 1.88 0.94 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 71 G 8.68 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 0.00 0.00 0.00 72 E 8.26 4.22 0.00 2.27 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 0.00 2.36 2.35 0.00 73 L 7.89 4.15 0.00 1.83 1.87 1.04 0.67 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 *75 T 7.80 4.32 4.39 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 1.24 0.00 0.00 76 K 8.43 3.99 0.00 2.08 1.91 0.00 1.75 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.51 1.68 7.81 77 L 7.77 3.99 0.00 1.64 1.76 0.90 0.78 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 78 E 8.13 4.15 0.00 2.18 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 2.43 2.43 0.00 79 K 8.35 4.04 0.00 1.87 1.93 0.00 1.74 0.00 0.00 1.65 0.00 0.00 2.99 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.51 1.58 7.81 80 Y 7.96 4.01 0.00 3.13 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 81 D 8.27 4.38 0.00 2.82 2.61 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 82 T 8.04 4.13 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 1.32 0.00 0.00 83 D 8.75 4.59 0.00 3.08 2.93 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 84 P 0.00 4.22 0.00 1.79 2.15 0.00 3.66 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 1.18 1.75 0.00 85 F 7.92 4.23 0.00 3.33 3.19 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 0.00 86 T 9.04 3.99 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 1.28 0.00 0.00 87 T 8.05 3.89 4.45 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 1.27 0.00 0.00 88 F 8.38 4.20 0.00 3.22 3.35 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 89 D 8.19 4.28 0.00 2.91 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 90 K 8.50 4.12 0.00 1.68 1.85 0.00 1.70 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.73 1.64 7.81 91 L 7.86 4.33 0.00 1.52 1.44 0.91 0.84 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 92 H 7.87 4.55 0.00 2.35 3.08 0.00 5.66 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 V 7.25 3.55 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 0.78 0.00 0.00 0.73 0.00 0.00 94 Q 8.25 4.54 0.00 2.06 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.79 0.00 0.00 0.00 0.00 0.00 2.25 2.44 0.00 95 T 8.07 4.16 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 1.20 0.00 0.00 96 T 8.24 4.08 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 1.22 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.