NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 Q 4.3877 8.3449 118.9488 55.5478 29.5775 175.0418 3 H 4.2626 8.0825 116.0781 57.4154 30.5566 174.0243 4 L 5.1867 9.1886 122.1958 53.9868 42.9987 175.3083 5 V 4.7812 8.9704 125.7050 61.0904 33.3993 174.5383 6 L 5.1656 8.6416 129.2394 54.2277 42.5818 176.2736 7 I 4.6734 9.4454 116.4748 59.3004 41.8778 174.6834 8 G 2.7554 8.0317 107.2690 43.7478 0.0000 172.7109 9 F 4.9613 7.5233 119.2594 55.7832 40.7906 175.4354 10 M 4.2489 7.6306 124.2175 57.0570 32.2485 176.3113 11 G 4.0764 9.1457 114.1663 45.3860 0.0000 173.8281 12 S 4.3728 8.0199 113.2577 58.6624 63.7541 174.9026 13 G 4.0801 8.2467 110.3140 45.9614 0.0000 176.1214 14 K 3.9477 8.4332 119.9586 59.4922 32.1523 179.0829 15 S 4.0962 8.0154 114.7585 61.5742 62.9007 176.9187 16 S 4.0428 7.9694 117.3355 61.5081 62.6994 175.8838 17 L 3.8766 7.8738 122.8522 58.4156 41.7200 178.7879 18 A 3.9603 8.6971 120.7578 55.4022 18.2777 179.4436 19 Q 3.9047 8.0616 117.8542 59.0920 29.0934 177.8571 20 E 3.8619 8.0451 120.0634 59.3900 29.7380 178.7633 21 L 4.0399 8.6384 119.4330 57.6561 41.6791 179.5865 22 G 3.7208 8.0979 105.5384 47.9545 0.0000 175.2836 23 L 3.9221 7.8523 121.6742 57.5995 41.5198 179.5410 24 A 4.0545 8.1962 119.4719 54.4428 18.3280 178.6101 25 L 4.3983 7.3790 114.2367 54.1576 43.8204 177.7592 26 K 4.0860 7.1710 116.0277 57.4734 31.3687 173.5034 27 L 4.8767 7.8146 124.1815 53.2392 45.2508 177.6323 28 E 4.1758 8.6017 121.1367 56.4873 30.9492 175.7944 29 V 4.9596 8.3675 122.9151 61.3828 33.4362 174.6537 30 L 4.8469 9.3148 127.9019 53.0689 45.1801 175.3035 31 D 5.1363 8.3731 120.2420 52.1619 43.5931 176.0036 32 T 3.8925 9.4193 119.0986 65.1787 68.5094 176.0780 33 D 4.5437 8.2225 121.0780 57.4416 40.9911 178.3708 34 M 4.0843 8.5058 119.2177 58.5709 31.9054 178.9630 35 I 3.7734 7.9243 119.9835 64.1676 37.1340 178.6852 36 I 3.5376 7.7789 120.7972 64.4148 36.9456 178.2341 37 S 4.2437 8.6666 115.9039 60.6098 61.9222 175.7521 38 E 4.0943 7.9596 118.7555 58.5233 29.8027 178.6615 39 R 3.9856 7.7804 118.9377 59.0083 30.1901 178.5685 40 V 3.7207 7.8502 117.2776 63.2535 31.5303 176.5597 41 G 3.9067 8.3059 105.9861 46.0747 0.0000 173.0792 42 L 4.8410 7.4863 117.5645 51.3551 45.8312 176.4911 43 S 4.3761 8.7205 116.7095 58.3666 64.9485 175.8586 44 V 3.6646 8.2252 121.5173 65.9010 31.2015 177.5958 45 R 3.7652 7.7425 118.0959 60.0825 29.8201 178.3041 46 E 4.1803 8.4237 117.7696 59.1577 29.4324 179.3839 47 I 3.7889 8.2078 120.5491 64.5577 37.1478 178.0322 48 F 3.9300 8.5016 118.3123 60.7815 38.5386 177.7381 49 E 4.0143 8.4352 116.6710 59.5125 29.4477 178.5878 50 E 4.2928 8.6970 117.5251 57.5355 30.0299 176.6645 51 L 4.5977 8.5663 116.3250 53.2433 44.4769 177.6665 52 G 4.0245 7.8448 104.4839 45.7925 0.0000 174.1525 53 E 3.0160 8.4430 120.9973 58.9835 29.6922 179.1369 54 D 4.3980 7.8985 118.3887 57.2360 40.8347 178.3903 55 N 4.0333 7.8802 116.7844 55.8512 38.6038 176.7505 56 F 4.3271 7.8883 121.9682 61.7810 39.3727 177.5856 57 R 4.0282 8.2991 117.6994 59.1973 29.7688 178.8311 58 M 3.9146 7.8395 118.2757 58.4523 32.2365 178.0486 59 F 4.4117 7.6543 118.0133 60.7335 38.9620 177.5293 60 E 3.7449 8.3810 118.2088 59.1531 29.0537 179.0023 61 K 3.6392 7.7874 118.4795 59.7689 32.4526 178.0625 62 N 4.4447 8.0682 116.3506 56.2686 38.4763 177.1542 63 L 3.9413 7.9770 121.6602 58.1775 42.0108 178.8176 64 I 3.6695 7.9462 119.9880 64.8240 36.8439 178.0864 65 D 4.3694 7.6523 117.8573 56.6876 40.7966 178.2611 66 E 4.0767 7.8752 119.6664 59.2802 29.8247 178.1903 67 L 3.8749 8.4357 119.2534 58.0178 41.4346 179.5448 68 K 4.2132 7.6655 117.1005 58.2957 32.0984 178.2268 69 T 4.3561 7.8181 108.7172 61.0370 69.8099 175.1449 70 L 4.2081 7.0472 122.6381 54.8202 42.4095 177.1191 71 K 4.2058 8.6292 121.6189 59.7013 33.4250 177.5346 72 T 4.2551 7.6529 116.1286 61.4936 69.2548 172.8567 73 P 4.5774 0.0000 0.0000 63.3096 32.1631 175.3535 74 H 5.1267 9.1100 118.8070 54.0464 33.8723 172.2158 75 V 4.5620 8.8338 121.1353 62.2023 33.1034 174.7977 76 I 5.0676 8.8884 128.8775 59.6721 40.1127 175.3369 77 S 4.9747 9.0810 122.7832 57.6224 65.4561 173.0042 78 T 4.9188 8.2457 114.0309 59.9710 70.4577 173.7895 79 G 3.9542 8.9235 116.7587 45.3013 0.0000 174.4761 80 G 3.9605 8.8472 109.5443 48.1553 0.0000 174.7408 81 G 4.1208 8.0600 106.4584 45.0508 0.0000 175.0885 82 I 3.9367 8.0544 122.5287 63.3281 38.0616 178.1852 83 V 3.8520 7.6754 111.8581 63.4478 31.7222 176.9696 84 M 4.0760 7.7398 118.7738 57.0580 31.8889 175.6888 85 H 4.8221 7.6063 117.3674 53.6646 30.0646 175.6093 86 E 3.9202 8.7961 125.6551 58.7195 29.7488 177.4484 87 N 4.5287 7.9844 113.5620 52.7477 38.3239 175.3175 88 L 3.9841 7.7668 122.4661 58.1089 42.2736 177.1071 89 K 4.1566 7.3157 119.7091 57.4433 31.0113 176.7780 90 G 3.9994 9.0860 115.0054 45.1129 0.0000 174.6768 91 L 4.0469 8.1979 121.7238 56.9013 42.0327 176.6963 92 G 4.0354 6.5006 100.7577 46.5689 0.0000 172.0072 93 T 4.4297 8.0722 117.1883 63.0485 69.7941 174.7756 94 T 5.6945 8.0618 115.9524 59.4633 72.3217 173.4406 95 F 5.2409 8.5667 120.6875 56.0575 43.0428 173.1791 96 Y 4.9720 9.3543 127.0448 57.2098 39.7700 174.5975 97 L 4.4819 9.4132 128.8459 53.7814 41.6470 175.4522 98 K 3.9397 8.3667 126.0285 55.0386 33.4517 174.9629 99 M 5.2271 8.5660 126.0007 54.0320 36.0477 173.4230 100 D 5.2816 8.3005 121.3716 51.1958 42.2147 177.1314 101 F 3.1860 8.4908 121.7746 61.1088 38.7306 177.1351 102 E 3.7357 7.9189 117.9777 59.2578 28.3562 178.0372 103 T 3.9344 7.7445 109.4302 64.9282 68.5992 175.4512 104 L 3.8988 7.6076 123.3923 57.8051 41.7521 178.6864 105 I 3.3581 6.6165 117.5911 64.4825 37.1083 177.8739 106 K 4.0338 7.0558 116.2627 59.7360 32.3959 179.2988 107 R 4.0284 7.8789 117.6260 58.5991 30.8359 177.2538 108 L 4.4950 7.6142 120.8044 54.2916 41.0724 178.1877 109 N 4.5403 7.9188 116.9074 52.2021 38.2908 176.1619 110 Q 2.8055 8.2195 120.9968 56.7121 28.4582 174.4134 *113 R 4.3083 7.9629 114.5024 56.4337 31.7982 177.3375 114 E 4.3308 7.9553 114.3116 56.0140 29.5601 176.4544 115 K 3.9877 8.2702 121.3618 55.3580 31.4475 175.6641 116 R 2.6366 6.6665 124.9718 52.5615 31.4633 175.0733 117 P 4.3298 0.0000 0.0000 65.5842 31.6409 178.4679 118 L 4.0656 7.8485 118.9009 58.3484 40.5489 178.6348 119 L 4.1753 7.3935 116.8475 56.3823 41.5624 177.1420 120 N 4.5762 7.9164 114.9927 52.7891 37.8011 174.8536 121 N 4.8015 8.1395 119.1667 52.1346 40.3069 174.7985 122 L 3.7757 8.5091 129.3100 58.2812 41.9403 179.5425 123 T 4.1864 7.8925 115.1557 66.2221 68.5099 176.9000 124 Q 4.0212 8.0592 119.6384 58.5594 28.9235 177.7727 125 A 4.2469 8.9341 123.1269 55.4268 18.4320 179.5860 126 K 2.7539 8.4322 118.1358 59.1960 32.0838 178.5618 127 E 3.8808 7.9905 119.2058 59.0480 29.4441 178.3647 128 L 3.9976 8.5070 120.7205 58.2603 42.2407 178.3860 129 F 3.8919 8.9178 120.7725 61.4671 38.9607 176.9509 130 E 3.9048 8.4245 116.7290 59.4622 29.9549 179.1542 131 K 4.0437 8.4824 119.9040 59.3917 32.2330 179.0063 132 R 3.4619 8.9316 119.5596 58.3241 29.8977 178.5359 133 Q 3.8800 7.8050 118.2593 59.2851 28.7660 179.5143 134 A 3.9430 7.8219 120.6529 55.1439 18.4393 179.5015 135 L 3.7832 7.0901 116.2355 57.8986 41.4838 179.2319 136 Y 3.9270 7.6092 116.9002 61.1114 37.4467 178.5723 137 E 4.0193 7.7790 117.8346 59.4301 29.6575 179.1645 138 K 4.0534 7.8761 118.4774 59.2076 32.3994 177.8407 139 N 4.7478 7.8931 113.5413 52.4793 38.8382 174.9646 140 A 4.1951 7.4780 124.7435 51.5733 18.4388 177.6415 141 S 3.8755 8.2192 120.3523 61.9060 63.4342 175.2691 142 F 4.7303 7.9454 115.7035 56.1551 43.6560 173.5300 143 I 4.9571 8.4330 121.9177 59.6309 39.9650 174.9774 144 I 4.6156 8.5728 127.0693 59.2390 40.5267 174.2661 145 D 4.6284 9.1326 127.0698 54.2506 41.5920 175.1319 146 A 4.6393 8.8327 128.1805 51.3123 19.4155 179.0092 147 R 3.7802 8.5624 118.2206 59.2269 30.7696 178.0040 148 G 3.8749 7.1149 106.0306 44.9898 0.0000 172.8601 149 G 3.9147 8.3021 106.8826 43.6726 0.0000 173.4198 150 L 3.9397 8.3828 120.1928 58.4250 41.9161 178.9994 151 N 4.2479 8.1480 115.8168 56.5243 37.9649 176.7135 152 N 4.1382 8.0421 117.7535 56.4528 38.8016 177.1402 153 S 4.1243 8.0949 116.9434 61.2338 62.8414 176.1697 154 L 3.8612 8.4796 123.4260 57.9895 41.6969 178.5923 155 K 3.7638 8.5065 120.2401 60.0211 31.8025 178.4366 156 Q 3.7922 7.4455 115.4881 58.6525 28.9481 178.1028 157 V 3.5719 7.9461 119.7116 66.3828 31.0261 178.0427 158 L 3.8937 8.0453 118.4886 57.9537 41.2354 179.6346 159 Q 3.8104 7.2990 116.9557 58.4739 28.5277 177.5567 160 F 4.3042 6.7424 115.5944 56.9733 38.8214 175.5532 161 I 3.6834 8.6199 128.6999 61.8582 37.5731 173.4568 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 2 Q 8.34 4.39 0.00 2.08 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.63 6.85 0.00 0.00 0.00 0.00 0.00 2.22 2.44 0.00 3 H 8.08 4.26 0.00 3.26 3.46 0.00 5.60 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 L 9.19 5.19 0.00 1.73 1.87 0.97 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 5 V 8.97 4.78 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 1.14 0.00 0.00 1.02 0.00 0.00 6 L 8.64 5.17 0.00 1.68 1.68 1.01 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 7 I 9.45 4.67 2.02 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.05 1.02 0.00 0.00 8 G 8.03 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 0.00 0.00 0.00 9 F 7.52 4.96 0.00 3.28 3.10 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 10 M 7.63 4.25 0.00 1.95 1.71 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 2.50 2.50 0.00 11 G 9.15 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 12 S 8.02 4.37 0.00 4.14 4.10 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 13 G 8.25 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 14 K 8.43 3.95 0.00 1.85 1.92 0.00 1.74 0.00 0.00 1.85 0.00 0.00 3.17 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.58 1.58 7.81 15 S 8.02 4.10 0.00 3.87 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 16 S 7.97 4.04 0.00 3.86 3.90 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 0.00 0.00 0.00 17 L 7.87 3.88 0.00 1.95 1.69 0.88 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 18 A 8.70 3.96 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 19 Q 8.06 3.90 0.00 2.16 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.74 0.00 0.00 0.00 0.00 0.00 2.35 2.36 0.00 20 E 8.05 3.86 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 2.29 2.37 0.00 21 L 8.64 4.04 0.00 1.81 1.68 0.79 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 22 G 8.10 3.72 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 0.00 0.00 0.00 23 L 7.85 3.92 0.00 1.85 1.73 0.91 0.93 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 24 A 8.20 4.05 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.38 4.40 0.00 1.71 1.68 0.91 0.85 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 26 K 7.17 4.09 0.00 1.95 2.12 0.00 1.54 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.37 1.40 7.81 27 L 7.81 4.88 0.00 1.54 1.59 0.96 0.94 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 28 E 8.60 4.18 0.00 1.78 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 2.41 2.30 0.00 29 V 8.37 4.96 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 0.84 0.00 0.00 1.02 0.00 0.00 30 L 9.31 4.85 0.00 1.57 1.52 0.77 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 31 D 8.37 5.14 0.00 2.77 2.51 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 32 T 9.42 3.89 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 1.22 0.00 0.00 33 D 8.22 4.54 0.00 2.95 2.85 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 34 M 8.51 4.08 0.00 2.13 2.36 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.72 0.00 35 I 7.92 3.77 1.86 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 1.51 0.68 0.87 0.00 0.00 36 I 7.78 3.54 1.97 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.73 0.79 0.00 0.00 37 S 8.67 4.24 0.00 3.97 4.09 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 0.00 0.00 0.00 38 E 7.96 4.09 0.00 2.15 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 2.26 2.50 0.00 39 R 7.78 3.99 0.00 1.62 1.87 0.00 3.17 0.00 0.00 3.06 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.56 0.00 40 V 7.85 3.72 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 0.82 0.00 0.00 0.25 0.00 0.00 41 G 8.31 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 42 L 7.49 4.84 0.00 1.70 1.54 0.97 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 43 S 8.72 4.38 0.00 4.26 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 44 V 8.23 3.66 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 0.57 0.00 0.00 1.00 0.00 0.00 45 R 7.74 3.77 0.00 2.07 1.92 0.00 3.46 0.00 0.00 3.13 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.82 0.00 46 E 8.42 4.18 0.00 2.21 2.02 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 2.35 2.37 0.00 47 I 8.21 3.79 2.22 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.89 1.27 0.00 0.00 48 F 8.50 3.93 0.00 3.17 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 49 E 8.44 4.01 0.00 2.10 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 2.39 2.50 0.00 50 E 8.70 4.29 0.00 2.20 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 2.32 2.41 0.00 51 L 8.57 4.60 0.00 1.87 1.69 1.14 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 52 G 7.84 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 53 E 8.44 3.02 0.00 1.91 1.88 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 2.34 2.33 0.00 54 D 7.90 4.40 0.00 2.64 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 55 N 7.88 4.03 0.00 2.87 2.49 0.00 0.00 6.77 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 56 F 7.89 4.33 0.00 2.84 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 57 R 8.30 4.03 0.00 2.17 1.96 0.00 3.39 0.00 0.00 3.30 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.78 0.00 58 M 7.84 3.91 0.00 1.84 1.84 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.40 0.00 59 F 7.65 4.41 0.00 3.10 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 60 E 8.38 3.74 0.00 1.85 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 2.05 1.50 0.00 61 K 7.79 3.64 0.00 1.64 1.90 0.00 1.80 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.41 1.62 7.81 62 N 8.07 4.44 0.00 2.82 2.86 0.00 0.00 6.73 6.50 0.00 0.00 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 L 7.98 3.94 0.00 1.89 1.61 0.89 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 64 I 7.95 3.67 1.99 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.60 0.95 0.00 0.00 65 D 7.65 4.37 0.00 2.74 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 66 E 7.88 4.08 0.00 2.02 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 2.35 2.38 0.00 67 L 8.44 3.87 0.00 1.86 1.66 0.88 0.71 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 68 K 7.67 4.21 0.00 1.91 1.88 0.00 1.69 0.00 0.00 1.76 0.00 0.00 3.12 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.50 1.66 7.81 69 T 7.82 4.36 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 1.26 0.00 0.00 70 L 7.05 4.21 0.00 1.81 1.70 0.79 0.92 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 71 K 8.63 4.21 0.00 1.86 1.94 0.00 1.51 0.00 0.00 1.78 0.00 0.00 3.09 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.40 1.54 7.81 72 T 7.65 4.26 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 1.21 0.00 0.00 73 P 0.00 4.58 0.00 1.98 2.21 0.00 3.64 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.13 0.00 74 H 9.11 5.13 0.00 3.01 3.26 0.00 5.62 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 V 8.83 4.56 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 1.04 0.00 0.00 0.96 0.00 0.00 76 I 8.89 5.07 1.92 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.53 0.93 0.00 0.00 77 S 9.08 4.97 0.00 3.92 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 78 T 8.25 4.92 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 1.37 0.00 0.00 79 G 8.92 3.95 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 0.00 0.00 0.00 0.00 0.00 0.00 80 G 8.85 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 81 G 8.06 4.12 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 0.00 0.00 0.00 82 I 8.05 3.94 2.09 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.27 1.02 0.00 0.00 83 V 7.68 3.85 1.92 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 0.83 0.00 0.00 0.61 0.00 0.00 84 M 7.74 4.08 0.00 1.90 2.05 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.46 0.00 85 H 7.61 4.82 0.00 3.31 3.20 0.00 5.62 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 E 8.80 3.92 0.00 1.98 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 2.36 2.28 0.00 87 N 7.98 4.53 0.00 2.86 2.91 0.00 0.00 5.94 7.79 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 88 L 7.77 3.98 0.00 1.89 1.73 1.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 89 K 7.32 4.16 0.00 1.56 1.68 0.00 1.80 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.35 7.81 90 G 9.09 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.20 4.05 0.00 1.86 1.77 0.95 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 92 G 6.50 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 0.00 0.00 0.00 93 T 8.07 4.43 4.30 0.00 0.00 0.00 0.00 0.00 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 94 T 8.06 5.69 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 95 F 8.57 5.24 0.00 3.11 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 96 Y 9.35 4.97 0.00 3.09 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 97 L 9.41 4.48 0.00 1.68 1.63 1.03 0.93 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 98 K 8.37 3.94 0.00 0.79 1.35 0.00 1.53 0.00 0.00 1.45 0.00 0.00 2.78 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.28 1.24 7.81 99 M 8.57 5.23 0.00 2.17 1.92 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.66 0.00 100 D 8.30 5.28 0.00 2.96 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 0.00 101 F 8.49 3.19 0.00 1.60 2.73 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 0.00 102 E 7.92 3.74 0.00 1.99 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 2.24 2.33 0.00 103 T 7.74 3.93 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 1.21 0.00 0.00 104 L 7.61 3.90 0.00 1.84 1.45 1.18 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 105 I 6.62 3.36 1.76 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.54 0.79 0.00 0.00 106 K 7.06 4.03 0.00 1.68 1.83 0.00 1.71 0.00 0.00 1.74 0.00 0.00 3.13 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.43 1.46 7.81 107 R 7.88 4.03 0.00 1.84 1.97 0.00 3.09 0.00 0.00 3.35 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.93 0.00 108 L 7.61 4.50 0.00 1.76 1.78 0.93 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 109 N 7.92 4.54 0.00 2.74 2.76 0.00 0.00 7.04 6.98 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 0.00 110 Q 8.22 2.81 0.00 2.09 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.88 6.65 0.00 0.00 0.00 0.00 0.00 2.31 2.42 0.00 *113 R 7.96 4.31 0.00 1.92 1.97 0.00 3.14 0.00 0.00 3.22 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.70 0.00 114 E 7.96 4.33 0.00 1.89 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 2.27 2.33 0.00 115 K 8.27 3.99 0.00 1.62 1.66 0.00 1.77 0.00 0.00 1.60 0.00 0.00 2.99 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.23 1.30 7.81 116 R 6.67 2.64 0.00 1.47 1.55 0.00 3.33 0.00 0.00 3.35 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.04 0.00 117 P 0.00 4.33 0.00 2.26 2.29 0.00 3.47 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.04 0.00 118 L 7.85 4.07 0.00 1.93 2.00 1.01 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 119 L 7.39 4.18 0.00 1.76 1.78 0.67 1.04 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 0.00 120 N 7.92 4.58 0.00 2.87 2.91 0.00 0.00 6.72 7.40 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 0.00 121 N 8.14 4.80 0.00 2.85 3.01 0.00 0.00 7.17 7.22 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 0.00 122 L 8.51 3.78 0.00 1.81 1.88 0.96 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 123 T 7.89 4.19 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 1.20 0.00 0.00 124 Q 8.06 4.02 0.00 2.47 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.84 0.00 0.00 0.00 0.00 0.00 2.47 2.45 0.00 125 A 8.93 4.25 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 0.00 0.00 0.00 0.00 0.00 0.00 126 K 8.43 2.75 0.00 1.05 1.48 0.00 0.61 0.00 0.00 1.18 0.00 0.00 2.75 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.09 0.87 7.81 127 E 7.99 3.88 0.00 2.09 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 2.32 2.31 0.00 128 L 8.51 4.00 0.00 2.12 2.19 1.05 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 129 F 8.92 3.89 0.00 2.55 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 0.00 130 E 8.42 3.90 0.00 2.11 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 2.36 2.39 0.00 131 K 8.48 4.04 0.00 1.77 2.02 0.00 1.63 0.00 0.00 1.65 0.00 0.00 2.92 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.38 1.44 7.81 132 R 8.93 3.46 0.00 1.82 1.21 0.00 3.23 0.00 0.00 2.93 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 2.07 0.00 133 Q 7.80 3.88 0.00 2.05 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.19 2.41 0.00 134 A 7.82 3.94 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 0.00 135 L 7.09 3.78 0.00 1.49 1.43 0.78 0.71 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 0.00 136 Y 7.61 3.93 0.00 2.02 1.43 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 0.00 137 E 7.78 4.02 0.00 1.95 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 0.00 2.64 2.49 0.00 138 K 7.88 4.05 0.00 1.75 1.78 0.00 1.63 0.00 0.00 1.66 0.00 0.00 3.07 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.40 1.46 7.81 139 N 7.89 4.75 0.00 2.83 2.82 0.00 0.00 7.04 7.15 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 0.00 140 A 7.48 4.20 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 S 8.22 3.88 0.00 3.47 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 0.00 142 F 7.95 4.73 0.00 2.74 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 0.00 0.00 0.00 0.00 143 I 8.43 4.96 1.94 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.73 0.84 0.00 0.00 144 I 8.57 4.62 2.12 0.00 0.00 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 1.35 1.04 0.95 0.00 0.00 145 D 9.13 4.63 0.00 2.71 2.73 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 0.00 146 A 8.83 4.64 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 0.00 147 R 8.56 3.78 0.00 2.00 2.00 0.00 3.17 0.00 0.00 3.38 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.57 0.00 148 G 7.11 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 G 8.30 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 0.00 150 L 8.38 3.94 0.00 1.71 1.66 0.95 0.56 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 0.00 151 N 8.15 4.25 0.00 2.75 2.83 0.00 0.00 6.74 6.92 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 0.00 152 N 8.04 4.14 0.00 2.81 2.87 0.00 0.00 7.22 7.63 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 0.00 153 S 8.09 4.12 0.00 4.08 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 L 8.48 3.86 0.00 1.83 1.75 0.88 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 155 K 8.51 3.76 0.00 1.87 1.95 0.00 1.64 0.00 0.00 1.60 0.00 0.00 2.91 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.36 1.46 7.81 156 Q 7.45 3.79 0.00 2.26 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.63 0.00 0.00 0.00 0.00 0.00 2.39 2.43 0.00 157 V 7.95 3.57 1.85 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 0.14 0.00 0.00 0.81 0.00 0.00 158 L 8.05 3.89 0.00 1.59 1.62 0.85 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 159 Q 7.30 3.81 0.00 1.24 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 7.21 0.00 0.00 0.00 0.00 0.00 2.19 2.41 0.00 160 F 6.74 4.30 0.00 2.98 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 0.00 0.00 0.00 0.00 161 I 8.62 3.68 1.93 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 1.15 0.33 0.97 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.