NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 15 Q 4.4487 8.1876 119.6397 55.8460 30.6899 173.6064 16 N 5.9734 8.1949 119.1024 49.9849 40.4537 171.7208 17 Y 4.8805 9.1912 117.8352 56.0624 43.2293 175.9720 18 L 4.5958 8.7248 121.4460 55.4358 42.8207 175.9615 19 F 5.0121 8.6086 122.1444 56.8432 43.4505 173.3124 20 G 4.3224 5.9058 109.1524 46.1384 0.0000 171.5784 21 C 4.4522 6.9880 114.3764 56.9790 32.9195 171.9374 22 E 5.0180 8.3977 119.1951 54.5071 32.5116 174.5244 23 L 5.0699 8.3396 123.6633 53.1460 46.6637 175.3393 24 K 4.8527 8.6237 119.1495 56.1870 36.0624 178.5204 25 A 3.6925 8.0650 122.5221 53.9903 19.5664 178.4479 26 D 4.7282 7.8462 110.9639 53.7464 42.5343 175.0384 27 K 4.4156 8.2536 121.3736 54.7234 32.9438 175.5643 28 D 4.9341 8.4806 126.1745 54.0101 42.4061 175.1140 29 Y 4.7592 8.9802 120.8436 56.1800 42.4666 174.1214 30 H 5.1541 7.5344 121.5422 54.0630 31.2961 172.7128 31 F 4.8842 9.1342 127.6303 56.7772 40.8259 174.7648 32 K 4.1706 6.7948 121.5023 56.4358 34.2872 173.9878 33 V 4.2908 8.0781 121.3238 61.4718 34.9524 175.7769 34 D 4.6056 7.8472 119.7048 52.1523 39.8164 173.9324 *39 E 4.2210 7.8526 122.4967 57.4552 31.7695 175.4095 40 H 4.8530 8.4722 116.4701 55.4126 32.8082 173.5011 41 Q 4.5989 9.0884 120.9948 54.2637 33.8136 173.5327 42 L 4.3266 8.5836 125.4522 53.5430 43.9300 175.1676 43 S 5.1024 8.5063 122.9262 56.3925 63.6467 172.8892 44 L 4.2453 9.0901 128.7080 56.5376 42.5968 175.5461 45 R 4.4458 9.5829 122.2817 56.5456 31.4518 177.4612 46 T 5.0080 5.7900 113.3314 60.6176 72.9270 175.3886 47 V 4.9451 8.6626 123.0816 61.1841 34.5153 174.5049 48 S 5.5989 9.0529 121.7734 56.6896 66.6319 173.5323 49 L 4.2574 8.6432 123.5517 54.9664 42.2815 177.1687 50 G 3.9061 8.5864 109.5461 45.4861 0.0000 174.8801 51 A 3.8423 8.4910 121.4283 55.4440 19.0309 178.9686 52 G 3.7962 7.9076 101.5770 45.7325 0.0000 173.5613 53 A 4.2392 7.7669 123.7731 51.9004 18.8536 178.2367 54 K 4.2319 7.8476 122.0145 56.1524 33.1907 177.5236 55 D 4.6344 8.4568 121.5998 54.1079 40.1229 174.7160 56 E 4.5982 7.5490 116.9346 54.0142 32.5188 175.2911 57 L 4.3129 8.0446 120.7354 55.9372 43.3371 176.6470 58 H 4.7991 9.0336 120.6407 54.9141 32.2473 172.0734 59 I 4.7250 8.3826 125.5244 59.9913 38.6343 175.0429 60 V 4.7884 8.9647 128.6041 61.2211 33.4959 174.4709 61 E 5.2870 9.5793 124.7102 54.6132 33.6294 174.0671 62 A 5.3267 9.1642 121.5697 50.1138 23.0634 174.6706 63 E 5.3837 9.1369 119.7655 53.4642 32.8940 174.7462 64 A 4.8483 8.1947 126.4472 51.0890 23.1980 174.2359 65 M 4.7410 8.5524 119.7950 55.6544 33.0297 176.1654 66 N 4.8408 8.7665 123.9352 51.7694 39.6779 175.1262 67 Y 4.3074 8.5898 118.2967 61.0595 38.8393 176.6486 68 E 3.9056 8.4417 116.9786 57.2538 29.5980 176.1855 69 G 4.0841 7.9216 107.6281 45.5357 0.0000 174.2657 70 S 4.5678 7.8109 113.8611 57.3435 65.1072 171.0562 71 P 5.3588 0.0000 0.0000 61.4089 32.5412 175.0487 72 I 4.6192 8.6218 117.7206 58.9698 40.7517 174.3440 73 K 5.0106 8.5230 122.8841 55.0932 33.8100 176.0432 74 V 4.5515 8.9132 123.9970 61.4554 35.5348 174.0042 75 T 4.7699 8.5234 123.0599 62.9329 68.8286 174.6761 76 L 4.4969 8.9153 127.1291 57.2490 42.7862 177.0475 77 A 4.5354 7.5476 116.7294 51.3681 22.6152 175.5183 78 T 4.9663 8.6348 116.4445 61.9572 70.7705 173.6701 79 L 4.9178 9.1364 126.6864 52.8022 45.9124 176.2266 80 K 4.5350 8.5515 122.8079 55.6269 34.5755 176.5276 81 M 3.4074 8.8154 128.7459 58.3156 32.3437 176.9463 82 S 4.7260 7.9526 110.0562 57.8893 63.6360 174.1357 83 V 4.2606 8.8209 120.2212 64.5610 33.6469 176.2290 84 Q 4.5274 7.4257 121.5428 53.9221 29.4658 172.3445 85 P 4.6020 0.0000 0.0000 64.0787 32.7299 176.5482 86 T 5.0363 7.5246 116.1698 62.8049 72.5971 172.8640 87 V 4.4403 8.7949 126.5309 61.0227 34.4780 174.0012 88 S 4.9775 8.6342 121.5974 56.7771 63.6526 173.4668 89 L 4.1607 9.2233 127.3168 54.1615 42.3801 177.1530 90 G 3.8037 9.1053 105.3475 46.5155 0.0000 172.5219 91 G 3.9918 7.9022 109.9453 47.0864 0.0000 172.1053 92 F 4.7379 8.4798 121.2571 57.1077 41.0962 175.1496 93 E 5.0588 9.0736 126.6705 55.3608 30.7585 175.9082 94 I 4.5881 8.9098 125.3991 59.6013 40.9506 174.8746 95 T 4.6728 8.5833 123.7466 61.9620 68.7796 173.1640 96 P 4.5931 0.0000 0.0000 62.0817 31.9299 174.1304 97 P 4.8420 0.0000 0.0000 62.9546 32.2949 175.8517 98 V 4.8127 8.8771 120.1146 60.2315 35.3802 173.9726 99 V 4.9298 8.7198 122.0928 61.1759 34.4800 174.0972 100 L 5.3756 8.7089 126.9902 53.1111 44.8902 175.7040 101 R 4.8033 8.7853 118.2098 55.4279 33.4986 173.8052 102 L 4.8306 8.3689 120.1585 53.4825 41.5498 176.6581 103 K 4.1029 8.8684 127.6397 59.5308 32.7672 176.8431 104 C 4.7226 7.8375 110.7505 57.9441 32.0078 171.8856 105 G 3.5137 8.8632 107.5652 43.4827 0.0000 174.6632 106 S 3.9913 10.4977 121.3470 59.5937 62.9298 176.0546 107 G 4.2519 7.8721 107.5246 43.6396 0.0000 170.7593 108 P 5.2695 0.0000 0.0000 62.2207 32.8049 176.2498 109 V 4.2232 7.8845 119.9393 61.9096 34.8221 173.3023 110 H 4.7779 9.6149 126.5079 54.9926 30.2801 174.3199 111 I 4.9963 8.2659 124.3730 59.3884 39.6874 174.9325 112 S 4.8285 8.5927 121.4145 56.7281 66.1626 174.0175 113 G 4.2285 7.7680 105.5769 47.0070 0.0000 171.9394 114 Q 5.0964 8.5370 119.2668 54.5569 33.9448 174.3999 115 H 5.0443 9.4435 122.6353 54.8194 31.3214 172.8171 116 L 5.2257 8.9680 126.8917 53.4846 43.5442 176.0999 117 V 4.4482 8.1521 122.8434 61.7141 34.3495 175.1609 118 A 4.8335 8.1410 127.7659 53.5908 17.6181 176.7097 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 15 Q 8.19 4.45 0.00 2.13 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.78 0.00 0.00 0.00 0.00 0.00 2.34 2.40 0.00 16 N 8.19 5.97 0.00 2.72 2.70 0.00 0.00 6.16 6.66 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 17 Y 9.19 4.88 0.00 3.01 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 18 L 8.72 4.60 0.00 1.62 1.67 0.94 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 19 F 8.61 5.01 0.00 3.11 2.88 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 20 G 5.91 4.32 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 0.00 21 C 6.99 4.45 0.00 1.96 1.51 0.00 0.00 0.00 0.00 0.00 0.00 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 8.40 5.02 0.00 1.86 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 1.95 2.00 0.00 23 L 8.34 5.07 0.00 1.59 1.50 0.93 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 24 K 8.62 4.85 0.00 1.91 1.87 0.00 1.53 0.00 0.00 1.83 0.00 0.00 2.85 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.39 1.44 7.81 25 A 8.07 3.69 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 26 D 7.85 4.73 0.00 2.62 2.62 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 27 K 8.25 4.42 0.00 1.70 1.89 0.00 1.83 0.00 0.00 1.74 0.00 0.00 3.11 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.41 1.42 7.81 28 D 8.48 4.93 0.00 2.59 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 Y 8.98 4.76 0.00 3.09 2.81 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 0.00 0.00 0.00 30 H 7.53 5.15 0.00 2.80 3.07 0.00 5.74 0.00 0.00 0.00 0.00 6.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 F 9.13 4.88 0.00 3.24 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 32 K 6.79 4.17 0.00 1.58 1.57 0.00 1.45 0.00 0.00 1.52 0.00 0.00 2.82 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.02 1.10 7.81 33 V 8.08 4.29 1.86 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 0.73 0.00 0.00 0.50 0.00 0.00 34 D 7.85 4.61 0.00 2.72 2.54 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 0.00 0.00 0.00 0.00 *39 E 7.85 4.22 0.00 1.98 1.97 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 2.32 2.37 0.00 40 H 8.47 4.85 0.00 3.04 3.22 0.00 5.66 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 Q 9.09 4.60 0.00 1.95 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.78 0.00 0.00 0.00 0.00 0.00 2.32 2.47 0.00 42 L 8.58 4.33 0.00 0.65 1.21 -0.88 -0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 43 S 8.51 5.10 0.00 3.93 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 44 L 9.09 4.25 0.00 1.56 1.57 0.71 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 45 R 9.58 4.45 0.00 1.81 1.67 0.00 3.27 0.00 0.00 3.24 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.72 0.00 46 T 5.79 5.01 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 1.22 0.00 0.00 47 V 8.66 4.95 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 0.99 0.00 0.00 0.95 0.00 0.00 48 S 9.05 5.60 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 49 L 8.64 4.26 0.00 1.52 1.56 0.89 0.72 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 50 G 8.59 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 51 A 8.49 3.84 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 52 G 7.91 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 53 A 7.77 4.24 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 54 K 7.85 4.23 0.00 1.62 1.77 0.00 1.72 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.49 1.39 7.81 55 D 8.46 4.63 0.00 2.63 2.64 0.00 0.00 0.00 0.00 0.00 0.00 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 E 7.55 4.60 0.00 2.07 1.93 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 2.28 2.21 0.00 57 L 8.04 4.31 0.00 1.66 1.59 0.93 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 58 H 9.03 4.80 0.00 3.26 3.18 0.00 5.66 0.00 0.00 0.00 0.00 6.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 I 8.38 4.72 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 1.13 0.64 0.93 0.00 0.00 60 V 8.96 4.79 2.10 0.00 0.00 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 0.00 0.00 0.95 0.00 0.00 61 E 9.58 5.29 0.00 2.14 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 2.31 2.24 0.00 62 A 9.16 5.33 1.11 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 0.00 0.00 63 E 9.14 5.38 0.00 2.01 1.77 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 2.29 2.10 0.00 64 A 8.19 4.85 1.22 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 65 M 8.55 4.74 0.00 2.08 2.00 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.90 2.55 0.00 66 N 8.77 4.84 0.00 3.08 3.02 0.00 0.00 6.29 6.89 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 67 Y 8.59 4.31 0.00 2.85 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 68 E 8.44 3.91 0.00 2.10 1.94 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 2.35 2.29 0.00 69 G 7.92 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 70 S 7.81 4.57 0.00 3.92 4.04 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 71 P 0.00 5.36 0.00 2.10 2.10 0.00 3.72 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 1.92 1.95 0.00 72 I 8.62 4.62 1.90 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.76 0.94 0.00 0.00 73 K 8.52 5.01 0.00 1.67 1.91 0.00 1.73 0.00 0.00 1.64 0.00 0.00 2.99 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.48 1.52 7.81 74 V 8.91 4.55 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 1.00 0.00 0.00 0.99 0.00 0.00 75 T 8.52 4.77 4.28 0.00 0.00 0.00 0.00 0.00 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 76 L 8.92 4.50 0.00 1.63 1.77 0.83 0.96 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 77 A 7.55 4.54 1.22 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 78 T 8.63 4.97 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 79 L 9.14 4.92 0.00 1.57 1.67 0.97 0.53 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 80 K 8.55 4.53 0.00 1.76 1.63 0.00 1.68 0.00 0.00 1.58 0.00 0.00 2.82 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.56 7.81 81 M 8.82 3.41 0.00 2.14 2.10 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 2.59 2.64 0.00 82 S 7.95 4.73 0.00 4.00 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 83 V 8.82 4.26 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 0.79 0.00 0.00 0.94 0.00 0.00 84 Q 7.43 4.53 0.00 2.07 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.99 6.75 0.00 0.00 0.00 0.00 0.00 2.33 2.34 0.00 85 P 0.00 4.60 0.00 2.14 2.27 0.00 3.78 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.99 0.00 86 T 7.52 5.04 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 1.24 0.00 0.00 87 V 8.79 4.44 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.98 0.00 0.00 88 S 8.63 4.98 0.00 3.89 3.71 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 89 L 9.22 4.16 0.00 1.70 1.90 1.04 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 90 G 9.11 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 91 G 7.90 3.99 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 0.00 0.00 0.00 92 F 8.48 4.74 0.00 3.12 2.80 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 93 E 9.07 5.06 0.00 1.97 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.36 0.00 94 I 8.91 4.59 1.69 0.00 0.00 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.62 0.84 0.00 0.00 95 T 8.58 4.67 4.28 0.00 0.00 0.00 0.00 0.00 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 96 P 0.00 4.59 0.00 2.19 2.40 0.00 3.97 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.17 0.00 97 P 0.00 4.84 0.00 2.10 2.06 0.00 3.73 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 2.00 1.96 0.00 98 V 8.88 4.81 2.10 0.00 0.00 0.00 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 0.97 0.00 0.00 99 V 8.72 4.93 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 0.97 0.00 0.00 0.94 0.00 0.00 100 L 8.71 5.38 0.00 1.74 1.55 0.99 0.52 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 0.00 101 R 8.79 4.80 0.00 1.92 2.05 0.00 2.90 0.00 0.00 3.27 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.60 0.00 102 L 8.37 4.83 0.00 1.55 1.68 0.94 0.97 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 0.00 103 K 8.87 4.10 0.00 1.77 1.86 0.00 1.99 0.00 0.00 1.76 0.00 0.00 3.00 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.46 1.42 7.81 104 C 7.84 4.72 0.00 2.96 2.94 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 0.00 105 G 8.86 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 10.50 3.99 0.00 4.04 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 0.00 107 G 7.87 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 0.00 108 P 0.00 5.27 0.00 2.01 1.92 0.00 3.81 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 2.09 1.91 0.00 109 V 7.88 4.22 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 0.98 0.00 0.00 0.92 0.00 0.00 110 H 9.61 4.78 0.00 3.21 3.15 0.00 5.62 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 I 8.27 5.00 1.74 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 1.25 0.59 0.93 0.00 0.00 112 S 8.59 4.83 0.00 3.82 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 0.00 113 G 7.77 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 0.00 0.00 0.00 0.00 114 Q 8.54 5.10 0.00 1.98 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.10 6.70 0.00 0.00 0.00 0.00 0.00 2.32 2.33 0.00 115 H 9.44 5.04 0.00 3.39 3.46 0.00 5.57 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 L 8.97 5.23 0.00 1.79 1.61 0.94 0.83 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 0.00 117 V 8.15 4.45 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 0.67 0.00 0.00 1.21 0.00 0.00 118 A 8.14 4.83 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 * Residues marked with a * may have inaccurate shift predictions.