NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4762 8.3049 120.3283 54.6763 33.9843 174.5104 2 D 4.8973 7.6807 117.9865 50.8530 44.3510 173.5528 3 Y 4.0770 9.4162 122.6804 58.6448 39.9360 175.2031 4 C 4.2868 7.5293 124.0760 57.8292 29.1859 173.4989 5 N 4.4812 8.4111 122.6729 53.2130 38.8349 174.5899 6 K 4.6948 8.3856 119.9953 54.5072 35.7561 175.6216 7 K 4.6940 8.1601 119.4981 54.1722 35.2794 175.7433 8 H 4.1401 8.7524 120.2814 56.8325 30.1312 175.2898 9 T 3.9828 8.1711 123.1051 63.0244 69.0122 174.2036 10 A 4.1468 8.3455 128.7365 52.0288 19.0483 177.4914 11 E 4.3244 8.5678 121.8101 56.3093 30.4025 176.1963 12 E 4.8152 8.3606 118.8003 54.8398 33.4652 174.7496 13 Y 4.7381 8.5046 121.7772 55.7413 41.4785 174.6217 14 V 3.9127 7.6605 126.0003 60.4634 33.6630 174.5076 15 K 3.8161 8.0866 128.8425 55.8325 32.7242 175.9936 16 I 4.1221 8.1502 127.2489 60.1080 37.4447 174.9813 17 S 4.8921 8.0998 121.8194 56.4346 64.5195 175.6184 18 D 4.7744 8.7386 123.5261 57.5337 40.8155 178.5227 19 N 4.5336 8.2500 115.1451 55.5085 38.6446 175.2172 20 N 4.7716 8.0393 113.8991 53.1816 39.1140 174.5288 21 Y 4.5264 7.6923 116.6452 58.0217 38.5779 175.4893 22 V 4.7407 8.9329 116.4014 58.4689 36.3290 173.2387 23 P 4.9323 0.0000 0.0000 62.9753 31.5912 176.4188 24 F 4.5820 9.5142 128.0097 56.7571 40.3834 173.3549 25 P 4.1621 0.0000 0.0000 63.4154 31.1183 177.1932 26 E 4.0339 8.7697 121.1369 58.8770 29.6980 178.1462 27 A 3.8744 7.8629 120.7429 54.0955 18.7184 177.8126 28 F 4.9537 7.7323 113.6202 56.8450 40.4821 175.1417 29 S 5.1560 7.8424 112.0300 57.9263 65.6425 173.2307 30 D 4.7228 9.2110 119.6209 53.8616 44.8190 175.8754 31 G 4.1434 9.1304 110.3465 44.6383 0.0000 173.1074 32 G 4.1322 7.9346 103.6319 45.2680 0.0000 174.8708 33 I 4.2656 7.5184 121.0101 61.6705 38.7685 177.3203 34 T 5.5231 8.7428 116.7662 60.2934 72.4734 172.9267 35 W 5.6599 9.6437 118.8168 56.7474 32.1757 172.7779 36 Q 3.6751 7.9674 116.7839 54.2793 32.9385 173.7609 37 L 3.9702 5.6200 125.5683 53.9569 42.3424 175.8147 38 L 4.2142 8.4192 126.5471 56.8263 43.0728 176.5389 39 H 4.7925 7.6773 115.3745 55.2393 33.2301 172.7051 40 S 4.9649 8.2745 119.2232 56.9804 66.6466 174.2602 41 S 4.4850 8.8235 120.9412 55.5977 63.0873 173.0159 42 P 2.9700 0.0000 0.0000 64.4749 31.4349 178.2069 43 E 4.0610 7.8334 119.0964 59.1014 29.9224 177.5535 44 T 4.0443 7.6971 114.0697 64.6509 69.0597 175.5594 45 S 4.3439 8.8981 114.9336 58.4661 61.7946 168.2169 46 S 5.6748 7.8931 114.6108 57.7315 65.7439 172.5335 47 W 5.8637 9.0787 117.2319 55.9452 31.9214 173.5170 48 T 5.1516 9.3607 116.8099 62.1643 72.4334 172.9605 49 A 4.8750 8.6468 125.5273 50.8802 23.8077 174.5260 50 I 4.8695 8.0409 118.1761 59.3662 41.6978 174.0566 51 F 5.3955 9.1115 126.8891 55.7486 43.0680 173.7786 52 N 5.0919 9.3169 119.7904 51.8598 41.0101 173.3958 53 C 4.8203 8.6434 122.7047 56.9593 30.7872 172.4811 54 P 4.6822 0.0000 0.0000 61.8528 32.5038 175.9618 55 A 3.9550 8.3562 124.7874 53.7341 18.7289 178.3644 56 G 3.8930 9.1021 110.8402 45.4152 0.0000 173.6241 57 S 4.9129 7.4797 114.9632 57.7319 65.5421 172.7902 58 S 5.5314 8.6023 113.4073 59.0442 66.6611 173.8079 59 F 5.3371 8.7125 118.0607 55.5084 41.5904 175.6852 60 A 4.5659 9.0780 123.5675 51.8181 19.4991 177.7292 61 S 4.6501 9.0400 115.4236 58.9791 63.9930 173.4607 62 H 5.0917 8.7944 118.2130 54.7253 32.2052 172.2586 63 I 4.8867 8.3649 119.7933 59.7816 40.6233 174.6224 64 H 4.6788 8.8109 123.8588 55.0244 28.9877 176.1978 65 A 3.7156 8.7942 127.0962 54.4254 18.9568 176.6932 66 G 4.5988 7.9884 99.9460 42.5166 0.0000 170.5597 67 P 4.5084 0.0000 0.0000 62.7023 32.6774 175.7940 68 G 4.2680 8.6396 108.8246 44.4523 0.0000 171.0785 69 E 5.1784 8.7561 122.6185 54.2831 33.1153 174.5531 70 Y 5.4980 8.1542 122.2240 55.1516 41.8240 174.7398 71 F 5.5645 9.8022 123.7170 56.5679 42.1897 173.8074 72 L 4.8687 9.7210 130.9617 55.0294 41.9839 176.9829 73 T 4.1234 8.4133 117.4869 62.9509 70.1223 175.3171 74 K 4.4706 7.9089 120.4395 56.1291 36.7943 177.1077 75 G 4.3534 9.6859 109.0600 45.9400 0.0000 171.6614 76 K 4.8986 8.2153 119.9989 55.0423 36.3106 175.8942 77 M 4.3900 8.7472 125.5932 53.6763 35.8754 173.4881 78 E 4.9883 8.8771 126.3375 54.7838 31.5699 175.2052 79 V 4.2799 8.2953 124.8113 60.1513 34.1547 176.1933 80 R 3.8760 9.4895 119.9699 57.3766 27.4770 178.0328 81 G 3.7716 8.2347 106.3952 44.3742 0.0000 175.2710 82 G 4.0392 8.0376 105.5118 45.4586 0.0000 174.2733 83 E 4.3480 8.8711 115.8946 58.6270 29.2809 179.3124 84 Q 4.1626 8.1062 116.5684 57.9252 28.8374 176.5552 85 E 4.4194 7.6990 117.8913 56.1830 30.6645 176.6239 86 G 4.0008 8.2295 106.3828 45.4543 0.0000 175.4656 87 G 4.2846 8.2047 109.0330 45.2771 0.0000 173.4412 88 S 5.0211 9.0640 118.7220 56.9803 67.6015 173.4335 89 T 4.8467 8.6589 119.2501 61.8981 70.3777 173.3443 90 A 4.7826 8.9559 129.6249 50.7964 21.0125 175.1889 91 Y 4.9456 8.6687 118.9382 55.7286 40.7349 175.6314 92 A 4.5823 8.7210 126.6517 51.5000 19.1816 175.1673 93 P 5.5923 0.0000 0.0000 61.7383 33.0353 175.2208 94 S 4.8819 8.8152 115.2009 57.9160 66.3308 172.1231 95 Y 5.2385 8.6615 121.1742 56.1226 41.8469 174.7186 96 G 3.0344 6.3114 108.9712 44.2322 0.0000 171.5771 97 F 5.0210 8.3774 125.4979 56.1742 41.5654 174.3188 98 E 4.4552 8.4022 127.4511 54.2360 31.4025 176.2568 99 S 4.2995 8.0989 119.7301 57.1670 65.0814 173.6402 100 S 4.4898 8.4017 115.2219 60.1129 62.2674 174.1338 101 G 3.9414 9.7438 117.4678 44.8486 0.0000 173.5694 102 A 3.9009 7.8442 122.2577 52.6468 19.3300 176.1917 103 L 4.4975 8.4691 124.9540 54.2148 43.4636 176.0287 104 H 4.7048 8.9884 125.3251 53.5984 29.1491 175.0613 105 G 3.6060 8.4362 112.4392 48.2669 0.0000 171.0688 106 K 5.0758 7.2392 117.5269 55.9907 33.7305 172.8353 107 T 3.9985 8.1371 118.6324 63.3400 69.8711 172.6551 108 F 5.1801 8.6624 128.9195 56.2854 42.7899 174.1462 109 F 4.8907 7.6872 123.8738 54.1536 39.9267 174.3481 110 P 4.0645 0.0000 0.0000 64.4097 31.6985 176.7955 111 V 4.5066 7.3403 117.2843 60.2971 35.1558 174.5731 112 E 4.1710 8.8408 125.6432 57.2410 30.2503 175.9547 113 S 4.9034 9.3334 121.8561 57.4635 68.5179 172.2623 114 Q 5.6276 9.2140 119.9623 55.9312 32.6222 173.1526 115 F 5.4875 8.6501 119.4158 55.9091 41.6170 172.0775 116 Y 5.1861 9.1402 122.3266 56.6077 41.2798 173.9980 117 M 5.2647 8.3567 124.3567 54.3743 36.5757 173.1471 118 T 4.7794 8.2413 115.2291 59.7727 71.6907 173.0187 119 F 4.9686 9.0784 123.1705 55.3818 42.8595 173.7458 120 L 4.7309 8.8219 125.0539 55.2007 43.7542 176.9196 121 G 4.1865 9.1946 115.4334 43.9956 0.0000 169.9049 122 P 5.1413 0.0000 0.0000 62.0592 34.0534 174.6575 123 L 4.8014 8.6937 120.1525 53.1029 44.0922 175.8642 124 N 5.2532 8.9584 123.1665 51.9021 39.5608 174.4010 125 F 4.8285 9.4373 124.9061 57.1042 40.1238 175.1492 126 I 5.1757 8.4670 117.3005 59.1470 40.6522 175.4581 127 D 4.7837 8.5682 123.2050 52.3592 41.2453 176.6526 128 D 4.4652 8.5850 117.6345 56.7626 40.7744 176.9176 129 N 4.6233 9.0940 115.7348 52.7593 38.9053 175.9067 130 G 3.9054 8.2797 106.8664 45.1901 0.0000 173.5435 131 K 4.1495 7.9069 121.3539 55.0605 32.9812 176.1057 132 V 4.1380 8.4409 126.4430 63.3366 31.6169 175.2283 133 I 4.4283 8.5251 121.0443 61.4923 39.1841 175.8563 134 A 4.3736 7.7681 121.3264 51.2303 22.4933 175.0123 135 S 4.9594 8.9938 118.3194 56.9649 63.5462 173.6331 136 I 3.9877 9.0577 130.7618 60.1648 38.1450 175.2558 137 G 4.3997 8.9572 120.1102 43.0540 0.0000 172.0952 138 W 3.4894 8.5217 115.1932 59.4939 27.6575 177.9568 139 A 2.8390 5.8289 120.6014 54.4891 17.7932 179.3140 140 E 3.6468 7.4433 116.3459 59.2444 29.4701 179.3388 141 A 3.8537 7.6628 121.1633 55.2084 18.3395 179.5342 142 Q 4.1578 8.2700 118.4281 59.0914 28.9359 178.7127 143 G 3.5007 8.1091 106.8210 47.7578 0.0000 175.6582 144 A 4.0502 8.1168 123.5840 54.2993 18.3060 179.6045 145 W 4.2975 8.6648 127.0630 60.8718 30.6992 178.3932 146 L 3.7209 8.1043 116.8567 56.9698 41.0651 178.6905 147 A 4.1791 7.5982 119.7341 53.8465 18.7531 178.5484 148 T 4.2813 6.8735 111.3867 64.3482 69.8454 174.5606 149 K 3.6727 7.5063 125.9590 56.8258 32.9300 174.2566 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 M 8.30 4.48 0.00 2.04 2.19 0.00 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.58 0.00 2 D 7.68 4.90 0.00 2.73 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 3 Y 9.42 4.08 0.00 2.91 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 4 C 7.53 4.29 0.00 2.68 2.65 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.41 4.48 0.00 2.69 2.78 0.00 0.00 6.95 7.61 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 6 K 8.39 4.69 0.00 1.72 1.66 0.00 1.66 0.00 0.00 1.64 0.00 0.00 2.89 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.40 1.33 7.81 7 K 8.16 4.69 0.00 1.71 1.70 0.00 1.80 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.33 1.33 7.81 8 H 8.75 4.14 0.00 3.10 3.22 0.00 5.73 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 9 T 8.17 3.98 4.15 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 1.18 0.00 0.00 10 A 8.35 4.15 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 11 E 8.57 4.32 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 2.35 2.43 0.00 12 E 8.36 4.82 0.00 1.92 1.82 0.00 0.00 0.00 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 2.45 0.00 13 Y 8.50 4.74 0.00 2.83 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 14 V 7.66 3.91 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 0.68 0.00 0.00 0.89 0.00 0.00 15 K 8.09 3.82 0.00 1.64 1.60 0.00 1.74 0.00 0.00 1.84 0.00 0.00 3.03 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.45 1.51 7.81 16 I 8.15 4.12 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 1.29 0.62 0.88 0.00 0.00 17 S 8.10 4.89 0.00 3.88 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 18 D 8.74 4.77 0.00 2.77 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 19 N 8.25 4.53 0.00 2.74 2.91 0.00 0.00 6.86 8.00 0.00 0.00 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 N 8.04 4.77 0.00 2.79 2.95 0.00 0.00 7.01 6.77 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 21 Y 7.69 4.53 0.00 2.93 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 22 V 8.93 4.74 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 0.70 0.00 0.00 1.14 0.00 0.00 23 P 0.00 4.93 0.00 2.04 2.10 0.00 3.77 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 2.09 2.18 0.00 24 F 9.51 4.58 0.00 3.07 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 25 P 0.00 4.16 0.00 2.29 2.05 0.00 2.20 0.00 0.00 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 1.25 0.00 26 E 8.77 4.03 0.00 1.95 2.04 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 2.33 2.32 0.00 27 A 7.86 3.87 0.70 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 28 F 7.73 4.95 0.00 2.79 2.53 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 0.00 29 S 7.84 5.16 0.00 3.83 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 30 D 9.21 4.72 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 31 G 9.13 4.14 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 0.00 0.00 0.00 0.00 0.00 0.00 32 G 7.93 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 0.00 0.00 0.00 33 I 7.52 4.27 1.78 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 1.12 0.33 0.82 0.00 0.00 34 T 8.74 5.52 4.57 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 1.39 0.00 0.00 35 W 9.64 5.66 0.00 3.15 3.33 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 36 Q 7.97 3.68 0.00 1.25 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.86 6.92 0.00 0.00 0.00 0.00 0.00 2.17 1.21 0.00 37 L 5.62 3.97 0.00 0.48 0.13 1.16 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 38 L 8.42 4.21 0.00 1.60 1.64 1.01 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 39 H 7.68 4.79 0.00 3.16 3.10 0.00 5.61 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 40 S 8.27 4.96 0.00 3.74 3.68 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 0.00 0.00 0.00 0.00 41 S 8.82 4.48 0.00 3.89 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 42 P 0.00 2.97 0.00 1.74 0.86 0.00 3.42 0.00 0.00 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.62 0.00 43 E 7.83 4.06 0.00 1.86 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 2.26 2.30 0.00 44 T 7.70 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 1.25 0.00 0.00 45 S 8.90 4.34 0.00 4.39 4.49 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.89 5.67 0.00 4.09 4.11 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 47 W 9.08 5.86 0.00 3.72 3.33 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 48 T 9.36 5.15 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 0.91 0.00 0.00 49 A 8.65 4.88 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 50 I 8.04 4.87 1.92 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 1.34 1.73 0.73 0.00 0.00 51 F 9.11 5.40 0.00 2.36 2.82 0.00 0.00 0.00 0.00 0.00 0.00 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 N 9.32 5.09 0.00 2.44 2.54 0.00 0.00 6.82 8.50 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 53 C 8.64 4.82 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 0.00 0.00 0.00 54 P 0.00 4.68 0.00 2.03 1.93 0.00 3.49 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.05 0.00 55 A 8.36 3.96 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 56 G 9.10 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 0.00 0.00 0.00 57 S 7.48 4.91 0.00 4.00 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 58 S 8.60 5.53 0.00 4.16 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 59 F 8.71 5.34 0.00 3.22 3.22 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 60 A 9.08 4.57 1.52 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 0.00 0.00 61 S 9.04 4.65 0.00 4.04 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 62 H 8.79 5.09 0.00 2.52 2.25 0.00 5.20 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 63 I 8.36 4.89 1.83 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 1.17 0.79 0.88 0.00 0.00 64 H 8.81 4.68 0.00 2.98 3.41 0.00 5.62 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 65 A 8.79 3.72 1.42 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 0.00 0.00 0.00 0.00 0.00 0.00 66 G 7.99 4.60 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 0.00 0.00 0.00 67 P 0.00 4.51 0.00 2.17 2.22 0.00 3.69 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.08 0.00 68 G 8.64 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 0.00 0.00 0.00 0.00 69 E 8.76 5.18 0.00 1.99 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 2.61 2.38 0.00 70 Y 8.15 5.50 0.00 3.26 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 71 F 9.80 5.56 0.00 3.23 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 72 L 9.72 4.87 0.00 2.03 1.81 1.16 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 73 T 8.41 4.12 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 0.26 0.00 0.00 74 K 7.91 4.47 0.00 1.76 1.68 0.00 1.66 0.00 0.00 1.80 0.00 0.00 2.81 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.42 1.43 7.81 75 G 9.69 4.35 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 0.00 0.00 0.00 76 K 8.22 4.90 0.00 1.53 1.41 0.00 0.94 0.00 0.00 0.83 0.00 0.00 2.70 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.05 0.95 7.81 77 M 8.75 4.39 0.00 1.75 1.62 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.90 0.00 78 E 8.88 4.99 0.00 1.86 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 2.16 2.15 0.00 79 V 8.30 4.28 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 0.71 0.00 0.00 0.68 0.00 0.00 80 R 9.49 3.88 0.00 2.00 2.00 0.00 3.09 0.00 0.00 3.34 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.58 0.00 81 G 8.23 3.77 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 82 G 8.04 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 83 E 8.87 4.35 0.00 2.21 2.27 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 2.33 2.24 0.00 84 Q 8.11 4.16 0.00 2.22 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.10 7.02 0.00 0.00 0.00 0.00 0.00 2.39 2.31 0.00 85 E 7.70 4.42 0.00 1.91 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 2.23 2.17 0.00 86 G 8.23 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 87 G 8.20 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 0.00 0.00 0.00 0.00 88 S 9.06 5.02 0.00 3.75 3.74 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 0.00 0.00 0.00 89 T 8.66 4.85 4.35 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 1.01 0.00 0.00 90 A 8.96 4.78 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 91 Y 8.67 4.95 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 92 A 8.72 4.58 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 93 P 0.00 5.59 0.00 2.42 2.25 0.00 3.52 0.00 0.00 4.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.92 0.00 94 S 8.82 4.88 0.00 4.07 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 0.00 95 Y 8.66 5.24 0.00 2.87 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 96 G 6.31 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 0.00 0.00 0.00 97 F 8.38 5.02 0.00 2.98 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 98 E 8.40 4.46 0.00 1.59 1.59 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 2.24 2.37 0.00 99 S 8.10 4.30 0.00 3.90 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 0.00 100 S 8.40 4.49 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 0.00 101 G 9.74 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 0.00 0.00 0.00 102 A 7.84 3.90 1.13 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 0.00 0.00 103 L 8.47 4.50 0.00 1.61 1.56 0.89 0.98 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 0.00 104 H 8.99 4.70 0.00 2.69 2.99 0.00 5.69 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 0.00 105 G 8.44 3.61 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 0.00 0.00 0.00 106 K 7.24 5.08 0.00 1.70 1.66 0.00 1.58 0.00 0.00 2.24 0.00 0.00 2.94 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.39 1.48 7.81 107 T 8.14 4.00 4.38 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 0.79 0.00 0.00 108 F 8.66 5.18 0.00 3.10 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 0.00 109 F 7.69 4.89 0.00 2.82 2.96 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 0.00 110 P 0.00 4.06 0.00 1.88 2.18 0.00 3.55 0.00 0.00 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.15 0.00 111 V 7.34 4.51 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 0.77 0.00 0.00 0.93 0.00 0.00 112 E 8.84 4.17 0.00 1.98 1.84 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 2.24 2.41 0.00 113 S 9.33 4.90 0.00 3.63 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 0.00 114 Q 9.21 5.63 0.00 2.07 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.05 6.70 0.00 0.00 0.00 0.00 0.00 2.30 2.43 0.00 115 F 8.65 5.49 0.00 3.30 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 0.00 116 Y 9.14 5.19 0.00 3.16 2.96 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 0.00 117 M 8.36 5.26 0.00 2.00 2.08 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 0.83 0.00 118 T 8.24 4.78 4.15 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 1.15 0.00 0.00 119 F 9.08 4.97 0.00 1.63 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 0.00 120 L 8.82 4.73 0.00 1.85 1.69 1.02 1.14 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 0.00 121 G 9.19 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 0.00 0.00 0.00 122 P 0.00 5.14 0.00 2.16 2.24 0.00 3.76 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.04 0.00 123 L 8.69 4.80 0.00 1.50 1.13 0.54 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 124 N 8.96 5.25 0.00 2.60 2.80 0.00 0.00 6.59 8.17 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 0.00 125 F 9.44 4.83 0.00 3.31 3.23 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 0.00 126 I 8.47 5.18 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 1.32 0.71 1.00 0.00 0.00 127 D 8.57 4.78 0.00 2.94 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 0.00 128 D 8.59 4.47 0.00 2.69 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 0.00 129 N 9.09 4.62 0.00 2.80 2.84 0.00 0.00 7.07 7.81 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 0.00 130 G 8.28 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 0.00 131 K 7.91 4.15 0.00 1.81 1.90 0.00 1.73 0.00 0.00 1.75 0.00 0.00 2.89 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.51 1.43 7.81 132 V 8.44 4.14 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 0.95 0.00 0.00 0.96 0.00 0.00 133 I 8.53 4.43 1.90 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 1.47 0.92 1.02 0.00 0.00 134 A 7.77 4.37 1.45 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 0.00 0.00 0.00 135 S 8.99 4.96 0.00 3.90 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 0.00 136 I 9.06 3.99 1.95 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.27 0.55 0.00 0.00 137 G 8.96 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 0.00 0.00 0.00 0.00 138 W 8.52 3.49 0.00 3.59 3.39 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 0.00 139 A 5.83 2.84 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 7.44 3.65 0.00 1.83 1.73 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 2.32 2.23 0.00 141 A 7.66 3.85 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 Q 8.27 4.16 0.00 2.29 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.76 0.00 0.00 0.00 0.00 0.00 2.44 2.54 0.00 143 G 8.11 3.50 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 A 8.12 4.05 1.35 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 0.00 0.00 145 W 8.66 4.30 0.00 3.27 3.29 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.10 3.72 0.00 1.64 1.66 0.97 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 147 A 7.60 4.18 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 0.00 148 T 6.87 4.28 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 1.23 0.00 0.00 149 K 7.51 3.67 0.00 1.25 0.74 0.00 1.49 0.00 0.00 1.57 0.00 0.00 3.01 0.00 0.00 2.63 0.00 0.00 0.00 0.00 0.94 0.84 7.81