NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3157 8.2493 123.5799 51.1708 19.9186 176.4871 2 P 4.6211 0.0000 0.0000 61.0362 32.2980 173.8363 3 S 4.8663 9.8014 117.2379 56.8540 67.3708 173.0828 4 Y 5.2514 8.5653 117.1339 56.4890 40.0518 175.6173 5 R 4.9984 9.1457 121.3934 54.4703 35.1843 174.3717 6 V 4.9503 8.3147 119.2469 60.0111 34.5776 175.0315 7 K 4.4970 8.7925 121.8336 54.7199 36.4168 175.5323 8 R 5.2263 8.5576 124.8359 54.1363 30.5577 174.5979 *10 D 4.3859 8.3244 125.3560 53.5993 42.2497 176.0981 11 I 2.8563 8.4419 126.6039 63.4561 38.1316 177.2779 12 A 4.1655 8.2203 122.0854 54.2436 18.2235 177.9971 13 K 4.4614 7.7315 114.7200 55.9842 32.2168 176.6087 14 N 4.9127 7.6795 115.7569 52.8160 37.5613 173.9759 15 D 4.9596 8.7531 117.0337 54.2062 41.6931 175.5466 16 E 4.7435 8.6430 117.0965 54.1370 31.7296 175.9335 17 E 4.4796 8.5957 118.7072 58.3690 30.0527 176.5042 18 C 3.6291 7.3043 110.7604 57.0357 33.5923 173.0643 19 V 4.8129 7.6672 117.6616 59.8741 34.6273 174.4343 20 V 4.6230 8.4920 123.0904 61.3967 32.9710 174.5039 21 N 4.7334 8.9558 127.2994 52.6969 40.5717 174.0711 22 A 4.5389 8.7349 127.9237 51.3810 18.1547 176.3731 23 A 4.7648 8.8941 123.5719 51.2154 21.9229 175.4762 24 N 5.2449 8.4086 116.1520 50.6713 39.6245 174.4393 25 P 5.2423 0.0000 0.0000 64.2977 31.7098 177.8722 26 R 4.0067 8.1675 117.0338 56.2853 30.5315 176.9754 27 G 3.9078 8.0355 105.6599 46.1414 0.0000 173.7084 28 L 4.4678 8.1344 118.7436 52.5023 42.7947 175.2988 29 P 4.1567 0.0000 0.0000 62.6187 32.3416 176.7967 30 G 3.9636 8.1239 111.3943 45.1096 0.0000 170.1441 31 D 4.8786 8.5407 121.6189 53.0674 44.6134 177.1495 32 G 3.7005 8.2997 108.8901 46.7403 0.0000 175.9779 33 V 3.5931 8.6035 119.7948 66.3448 31.3172 177.2410 34 C 4.9575 8.1164 119.0057 61.7587 31.3854 175.1205 35 K 3.9099 7.9174 120.5916 59.6713 31.8252 178.5899 36 A 3.9837 7.8394 120.6946 55.1005 18.2966 179.8229 37 V 4.0026 8.3318 117.0592 66.5463 31.5113 177.6915 38 Y 4.0519 8.4807 118.5906 60.5146 38.5689 177.8610 39 K 3.8776 7.8007 118.7141 58.9891 32.2037 178.8041 40 K 3.6762 7.5079 118.6401 57.3541 33.5929 177.0930 41 W 5.0945 8.3986 117.5925 54.4114 29.6598 174.6832 42 P 4.1593 0.0000 0.0000 65.9405 30.9516 178.2219 43 E 4.1979 8.3596 118.0088 58.8643 29.1953 178.3632 44 S 4.5228 8.3413 112.3556 59.6368 63.3463 175.1256 45 F 4.5906 8.3072 122.1408 55.7419 39.0897 175.2965 46 K 4.0461 7.6284 121.4504 57.1384 31.9926 176.3095 47 N 4.2057 8.7133 126.1357 54.4321 35.6637 175.1546 48 S 4.2369 7.8385 110.4230 58.5472 64.1859 173.6804 49 A 4.2104 7.6568 123.5692 53.1576 18.7227 176.7501 50 T 4.5827 8.0478 115.2516 60.1724 71.6001 171.4496 51 P 4.7349 0.0000 0.0000 61.8578 32.9352 175.9879 52 V 3.7200 8.3504 121.0380 64.9986 31.6411 176.5449 53 G 3.9102 9.3229 113.8127 46.4497 0.0000 172.4838 54 T 4.9200 7.6741 108.5460 59.6167 72.6924 172.4376 55 A 5.2703 8.6602 121.7454 50.2278 22.6723 175.5129 56 K 4.4896 9.0103 120.7648 55.2565 35.9458 175.1021 57 T 4.7131 8.5401 124.1778 62.8375 69.7384 174.3492 58 V 4.3819 8.3195 127.6869 61.7966 35.5852 174.3538 *60 C 4.6322 8.7142 119.2305 59.9962 32.5844 175.9929 61 G 4.0160 8.3993 120.0906 47.2392 0.0000 173.0027 62 T 4.3506 8.9515 113.2283 60.9716 68.9484 173.0393 63 Y 4.3076 7.9852 124.5414 55.8059 39.3452 173.1687 64 P 4.2526 0.0000 0.0000 62.2363 32.8942 175.3974 65 V 4.2219 8.3464 124.7220 61.1410 33.7276 174.4973 66 I 4.3209 8.4899 130.4446 60.1021 38.3546 175.0256 67 H 4.7188 9.0135 126.4390 55.1375 29.5734 174.4496 68 A 4.9855 8.8488 126.3150 49.9848 21.7277 175.3552 69 V 4.5728 8.5051 122.8974 60.9870 32.9251 175.6915 70 G 4.1766 8.8273 116.4148 43.3229 0.0000 170.2179 71 P 4.0455 0.0000 0.0000 62.1217 31.9853 175.8023 72 N 4.4027 8.0826 119.1090 52.3951 38.2869 175.8370 73 F 4.2538 9.1801 126.0979 59.9097 39.3558 178.0782 74 S 3.9728 8.6897 117.4140 60.9127 62.7285 175.6114 75 N 4.6505 8.1539 115.9763 53.3553 39.4531 174.5082 76 Y 4.5624 7.0468 115.0261 55.6477 40.4482 176.3123 77 S 4.4757 8.3711 117.1838 58.0767 65.2399 175.1493 78 E 4.2182 8.8770 122.6575 59.9150 29.4035 179.9424 79 S 4.1758 8.0869 113.5759 61.4717 63.1769 175.9507 80 E 4.0422 8.3507 123.2755 58.8858 29.4432 179.0040 81 G 2.8940 8.7576 106.1503 47.4503 0.0000 175.1451 82 D 4.5649 8.4829 120.4622 57.1582 41.2418 178.3502 83 R 3.8493 7.8438 118.7154 59.5876 29.6070 178.4158 84 E 3.8204 7.8988 118.3807 59.0821 29.1833 179.1489 85 L 3.8998 7.9592 120.2875 58.0926 42.2584 178.9290 86 A 3.9657 7.9998 120.5444 54.9752 18.2390 179.4778 87 A 3.9140 8.1775 119.2088 55.1369 18.4700 179.6488 88 A 3.9470 8.0944 119.3675 55.6765 18.4679 179.5268 89 Y 4.1758 7.7057 115.1280 61.2341 37.8848 178.9021 90 R 4.0153 8.1141 119.0007 59.4920 30.1700 178.9939 91 E 4.0130 8.2890 118.3407 59.0836 29.3093 179.4359 92 V 3.5561 7.9513 118.2498 66.0752 31.5532 177.9576 93 A 4.0059 8.1926 120.4043 54.9276 18.1341 179.5013 94 K 3.8589 8.0993 118.1501 59.7130 32.2375 178.9324 95 E 3.9117 8.2739 118.8262 59.4050 29.1037 179.4090 96 V 3.5212 8.0332 118.5357 66.2589 31.4686 178.1298 97 T 3.7398 8.0637 115.3986 66.7794 68.1526 176.4611 98 R 3.8876 8.0619 119.4350 59.6074 30.1297 178.2115 99 L 4.1652 8.0524 117.7349 55.4082 41.6319 178.2183 100 G 3.8866 7.5708 105.4988 45.7990 0.0000 174.2018 101 V 3.9106 6.9137 112.5505 61.3477 32.0635 176.2398 102 N 4.7826 9.6029 120.1094 55.1087 38.7995 174.9276 103 S 5.2465 7.7303 112.1528 57.3951 66.6298 173.6647 104 V 4.8436 8.6729 119.5470 60.3135 35.0599 173.3407 105 A 5.3706 8.9311 125.9319 50.7978 20.7907 175.8167 106 I 5.0036 9.1885 123.1044 58.7391 41.7263 173.1185 107 P 5.3639 0.0000 0.0000 61.5710 34.0618 175.3396 108 L 4.5607 8.4679 119.7770 53.4316 41.1362 176.8158 109 L 4.1660 8.7617 124.9218 56.0873 41.7397 177.5892 110 S 4.1116 8.9022 116.2428 59.9934 60.3068 173.0639 111 T 4.8326 7.8189 107.4204 61.4914 71.0343 174.7107 112 G 3.9205 7.9077 109.8876 45.8559 0.0000 177.2732 113 V 3.7569 9.0347 119.6432 63.8014 31.9750 176.0888 114 Y 5.1156 7.9960 116.5744 57.9839 38.0159 177.1424 115 S 4.5836 7.9492 116.1608 58.6664 63.3703 175.4494 116 G 4.0630 9.1771 108.4422 46.4061 0.0000 174.6639 117 G 3.9337 8.2054 106.5586 44.8464 0.0000 174.1169 118 K 4.4115 7.3363 120.2140 54.3114 33.8534 175.4912 119 D 4.7808 8.5589 123.5330 54.4266 40.9100 175.8850 120 R 4.5325 8.5716 126.0116 55.6017 31.2595 177.7246 121 L 3.3851 7.9093 120.9386 58.8065 41.6306 179.0598 122 T 3.6418 7.4132 114.5830 66.3975 68.3890 176.2395 123 Q 3.8200 7.8751 120.9706 59.3658 29.0850 178.4344 124 S 4.2546 8.2710 114.2399 61.2404 62.4125 175.6530 125 L 3.4729 7.8666 123.2108 58.1888 41.6823 178.7988 126 N 4.3064 8.0576 116.3749 56.5564 38.5036 177.1728 127 H 4.2252 7.7611 117.4819 58.4965 28.5166 177.5538 128 L 2.9169 6.7351 121.2095 57.7483 41.8923 178.7214 129 F 4.5548 7.6144 116.4420 60.9872 38.9329 177.1940 130 T 4.1405 7.8760 113.7264 66.8405 68.4676 176.3273 131 A 4.2480 7.7074 119.0311 53.1946 17.9236 178.6766 *133 D 4.5566 8.0429 121.5573 55.4024 42.7615 176.6198 134 S 4.5376 7.6905 111.2509 58.2943 63.4317 173.9109 135 T 4.5295 7.4718 110.9437 60.5431 70.5487 174.2016 136 D 4.5135 8.3881 120.2203 54.9405 41.4758 176.8509 137 A 4.4631 7.2188 120.6327 51.2516 19.5445 177.3772 138 D 4.4563 8.9505 122.1417 54.4756 42.2965 175.5783 139 V 4.8207 8.6683 123.3943 60.9830 34.4296 174.2378 140 V 4.8457 9.0111 127.8194 61.2788 34.1697 174.0276 141 I 4.9582 8.8913 129.7459 60.4711 39.0514 174.3645 142 Y 5.1934 9.1572 124.5890 56.4503 40.9990 174.6538 143 C 5.2777 9.1010 117.2419 57.4158 33.5295 174.4365 144 R 4.4705 8.7416 115.7038 55.9261 32.1661 176.3365 145 D 4.7738 7.7374 117.2321 52.3398 43.6133 176.6787 146 K 3.9592 8.6147 126.3530 59.9280 32.2398 179.3549 147 E 4.1013 8.3447 118.1751 59.1456 29.4809 179.2319 148 W 4.1150 8.9982 119.2013 59.6446 29.0348 177.9620 149 E 3.9956 8.6714 119.5431 59.4061 28.9765 179.0990 150 K 3.9771 8.0066 117.9571 59.5287 32.1400 179.5763 151 K 3.9468 8.1918 118.7053 59.3381 31.9222 179.5800 152 I 3.6229 8.1833 120.5722 64.3582 37.0086 178.2975 153 S 4.1219 8.3271 114.2257 61.5849 61.9699 176.1173 154 E 3.9410 8.2508 119.9780 59.3390 29.2542 178.8991 155 A 4.1460 7.8484 119.9136 55.0412 18.5022 179.4470 156 I 3.7971 7.7303 117.3852 64.4081 37.4322 180.8511 157 Q 4.2048 8.1652 120.7389 55.5850 27.8709 178.6472 *159 R 4.1518 8.0090 120.0834 56.2008 32.4298 176.1778 160 T 4.0501 7.4284 111.3213 61.7917 68.8098 174.1567 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 1 A 8.25 4.32 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 2 P 0.00 4.62 0.00 2.05 2.19 0.00 3.68 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 1.93 1.98 0.00 3 S 9.80 4.87 0.00 3.91 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 4 Y 8.57 5.25 0.00 2.90 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 5 R 9.15 5.00 0.00 1.72 1.75 0.00 3.07 0.00 0.00 3.23 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.58 0.00 6 V 8.31 4.95 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 0.76 0.00 0.00 0.97 0.00 0.00 7 K 8.79 4.50 0.00 1.09 1.56 0.00 1.62 0.00 0.00 1.54 0.00 0.00 2.68 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.22 1.05 7.81 8 R 8.56 5.23 0.00 1.93 1.90 0.00 3.31 0.00 0.00 3.85 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.53 0.00 *10 D 8.32 4.39 0.00 2.76 2.59 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.44 2.86 1.85 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 1.20 0.46 0.97 0.00 0.00 12 A 8.22 4.17 1.10 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 0.00 0.00 0.00 0.00 0.00 13 K 7.73 4.46 0.00 1.91 1.84 0.00 1.73 0.00 0.00 1.76 0.00 0.00 2.99 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.35 1.32 7.81 14 N 7.68 4.91 0.00 3.08 2.49 0.00 0.00 6.69 8.21 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 15 D 8.75 4.96 0.00 2.71 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 16 E 8.64 4.74 0.00 2.17 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 2.46 2.39 0.00 17 E 8.60 4.48 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 2.38 2.28 0.00 18 C 7.30 3.63 0.00 2.67 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 19 V 7.67 4.81 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 0.07 0.00 0.00 0.89 0.00 0.00 20 V 8.49 4.62 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 0.75 0.00 0.00 0.92 0.00 0.00 21 N 8.96 4.73 0.00 2.76 2.52 0.00 0.00 6.68 8.01 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 22 A 8.73 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 23 A 8.89 4.76 1.28 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 0.00 0.00 0.00 24 N 8.41 5.24 0.00 3.00 3.05 0.00 0.00 5.68 7.76 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 25 P 0.00 5.24 0.00 2.27 2.38 0.00 4.02 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.00 0.00 26 R 8.17 4.01 0.00 2.00 2.04 0.00 3.47 0.00 0.00 3.24 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.60 0.00 27 G 8.04 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 28 L 8.13 4.47 0.00 1.77 1.55 0.92 0.82 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 29 P 0.00 4.16 0.00 1.46 0.63 0.00 3.34 0.00 0.00 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.58 0.00 30 G 8.12 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 31 D 8.54 4.88 0.00 2.71 2.60 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 32 G 8.30 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 33 V 8.60 3.59 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 1.26 0.00 0.00 0.99 0.00 0.00 34 C 8.12 4.96 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 35 K 7.92 3.91 0.00 1.94 2.01 0.00 1.69 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.45 1.48 7.81 36 A 7.84 3.98 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 37 V 8.33 4.00 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 1.34 0.00 0.00 1.29 0.00 0.00 38 Y 8.48 4.05 0.00 2.30 2.79 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 0.00 0.00 0.00 39 K 7.80 3.88 0.00 1.97 1.70 0.00 1.71 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.38 1.42 7.81 40 K 7.51 3.68 0.00 1.10 0.74 0.00 1.03 0.00 0.00 1.12 0.00 0.00 2.70 0.00 0.00 2.55 0.00 0.00 0.00 0.00 0.30 0.21 7.81 41 W 8.40 5.09 0.00 3.67 3.05 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 0.00 0.00 0.00 42 P 0.00 4.16 0.00 1.99 1.53 0.00 3.69 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 1.77 0.00 43 E 8.36 4.20 0.00 2.20 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.48 0.00 44 S 8.34 4.52 0.00 4.19 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 45 F 8.31 4.59 0.00 3.45 3.31 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 46 K 7.63 4.05 0.00 1.77 1.80 0.00 2.00 0.00 0.00 1.74 0.00 0.00 3.03 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.49 1.46 7.81 47 N 8.71 4.21 0.00 2.88 2.85 0.00 0.00 7.17 7.57 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 48 S 7.84 4.24 0.00 3.23 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 49 A 7.66 4.21 1.28 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 0.00 0.00 0.00 50 T 8.05 4.58 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 1.23 0.00 0.00 51 P 0.00 4.73 0.00 2.11 1.95 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 2.10 2.08 0.00 52 V 8.35 3.72 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 0.59 0.00 0.00 0.99 0.00 0.00 53 G 9.32 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 54 T 7.67 4.92 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 1.23 0.00 0.00 55 A 8.66 5.27 1.15 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 0.00 0.00 56 K 9.01 4.49 0.00 1.74 1.56 0.00 1.59 0.00 0.00 1.60 0.00 0.00 2.82 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.29 1.38 7.81 57 T 8.54 4.71 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 1.14 0.00 0.00 58 V 8.32 4.38 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 0.98 0.00 0.00 0.92 0.00 0.00 *60 C 8.71 4.63 0.00 3.21 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 61 G 8.40 4.02 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 0.00 0.00 0.00 62 T 8.95 4.35 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 63 Y 7.99 4.31 0.00 2.95 3.05 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 0.00 0.00 0.00 64 P 0.00 4.25 0.00 1.80 1.76 0.00 2.94 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.89 0.00 65 V 8.35 4.22 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 74 S 8.69 3.97 0.00 4.01 3.94 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 75 N 8.15 4.65 0.00 2.58 2.54 0.00 0.00 6.89 8.13 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 76 Y 7.05 4.56 0.00 2.61 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 77 S 8.37 4.48 0.00 4.11 4.05 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 0.00 0.00 0.00 78 E 8.88 4.22 0.00 2.08 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.37 0.00 79 S 8.09 4.18 0.00 4.09 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 0.00 80 E 8.35 4.04 0.00 2.22 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 0.00 2.60 2.47 0.00 81 G 8.76 2.89 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 0.00 0.00 0.00 82 D 8.48 4.56 0.00 3.08 2.93 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0.00 0.00 *133 D 8.04 4.56 0.00 2.83 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 0.00 134 S 7.69 4.54 0.00 4.11 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 0.00 135 T 7.47 4.53 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 1.23 0.00 0.00 136 D 8.39 4.51 0.00 2.66 2.72 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 0.00 137 A 7.22 4.46 1.19 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 0.00 0.00 138 D 8.95 4.46 0.00 2.69 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 V 8.67 4.82 1.71 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 1.14 0.00 0.00 0.76 0.00 0.00 140 V 9.01 4.85 2.42 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 0.70 0.00 0.00 1.01 0.00 0.00 141 I 8.89 4.96 1.90 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.75 0.97 0.00 0.00 142 Y 9.16 5.19 0.00 2.97 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 0.00 143 C 9.10 5.28 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 0.00 144 R 8.74 4.47 0.00 1.73 1.95 0.00 3.41 0.00 0.00 3.21 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.51 0.00 145 D 7.74 4.77 0.00 2.47 2.33 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 0.00 146 K 8.61 3.96 0.00 1.87 1.89 0.00 1.73 0.00 0.00 1.83 0.00 0.00 2.94 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.56 1.56 7.81 147 E 8.34 4.10 0.00 2.34 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 2.46 2.41 0.00 148 W 9.00 4.11 0.00 3.51 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 0.00 149 E 8.67 4.00 0.00 2.09 2.20 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 2.34 2.39 0.00 150 K 8.01 3.98 0.00 2.07 1.86 0.00 1.74 0.00 0.00 1.66 0.00 0.00 2.98 0.00 0.00 3.28 0.00 0.00 0.00 0.00 1.48 1.51 7.81 151 K 8.19 3.95 0.00 1.79 1.70 0.00 1.46 0.00 0.00 1.46 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.39 1.54 7.81 152 I 8.18 3.62 1.88 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.80 0.89 0.00 0.00 153 S 8.33 4.12 0.00 3.95 4.02 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 0.00 154 E 8.25 3.94 0.00 2.09 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 2.34 2.53 0.00 155 A 7.85 4.15 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 I 7.73 3.80 2.09 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.90 1.03 0.00 0.00 157 Q 8.17 4.20 0.00 2.18 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.38 0.00 0.00 0.00 0.00 0.00 2.56 2.55 0.00 *159 R 8.01 4.15 0.00 1.60 1.80 0.00 2.21 0.00 0.00 2.43 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.65 0.00 160 T 7.43 4.05 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 1.26 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.