NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.1606 8.3049 118.1575 54.2471 33.1285 174.9045 2 F 5.0083 7.7562 118.1484 55.6906 40.8402 172.8311 3 N 4.6584 10.0851 125.3635 54.8445 41.2283 174.8455 4 R 4.7377 8.6104 118.4275 54.9432 33.1297 173.6770 5 I 4.8326 8.9536 128.6177 59.8008 39.6539 174.5346 6 M 5.1043 9.0353 127.0880 53.8307 34.9053 174.7190 7 V 4.9906 8.7603 125.7906 59.4835 33.9305 172.4972 8 P 4.9192 0.0000 0.0000 62.4515 31.6882 176.5079 9 V 4.6036 9.0480 118.2903 59.3411 35.1554 175.8894 10 D 4.7284 8.5854 121.0162 52.7200 40.1632 177.2047 11 G 3.9899 8.3939 107.3073 46.0897 0.0000 174.5443 12 S 4.5861 8.1019 115.3239 57.2466 65.7194 175.2653 13 K 4.0969 8.5592 122.0965 59.5336 31.7901 179.7679 14 G 3.7299 8.3657 106.7314 47.2607 0.0000 175.4555 15 A 4.0565 8.1993 123.1003 54.6248 18.3522 179.9454 16 V 3.5117 7.6480 116.7635 66.1965 31.7458 178.4794 17 K 4.1591 8.1361 118.0538 59.2371 31.7376 179.2019 18 A 3.9693 8.0333 121.1820 55.0896 18.2850 179.3438 19 L 3.8808 8.1118 118.9711 58.4270 42.1206 179.0121 20 E 3.9905 8.2812 118.4211 59.4526 29.3933 179.5972 21 K 4.1274 8.0959 118.2100 59.1795 32.0825 179.5800 22 G 3.6522 8.3677 106.4417 47.8219 0.0000 175.8912 23 V 3.6982 8.3040 121.1976 65.5760 31.4408 178.1015 24 G 3.7576 8.0157 105.5267 48.1916 0.0000 175.6273 25 L 4.1119 8.1036 121.6156 57.1441 41.5799 179.3409 26 Q 4.0160 8.2412 119.8277 59.4773 28.8199 178.5389 27 Q 4.2192 8.1708 117.8604 58.6327 28.7501 178.0509 28 L 4.1879 7.6293 121.2039 57.1166 42.2542 177.8685 29 T 4.5370 7.7218 107.1005 60.2751 70.0487 174.9623 30 G 3.8542 8.5199 109.3421 46.3064 0.0000 173.6956 31 A 4.4445 7.5279 120.7393 51.2660 19.4468 178.3265 32 E 4.3815 9.1666 119.6501 56.3260 31.1916 175.9378 33 L 5.2378 9.6185 126.1101 53.7084 44.7248 174.4756 34 Y 5.3928 9.6551 125.1233 56.6914 40.1773 174.7204 35 I 4.9324 9.1852 126.4442 59.6655 39.6614 174.7422 36 L 5.1006 8.6767 128.1751 53.3091 45.5686 174.3568 37 C 5.2250 8.8657 126.1137 56.6699 34.1747 172.3777 38 V 4.8623 8.4661 126.4120 61.3251 32.8626 174.5534 39 F 5.0906 8.7060 123.0015 54.8792 40.5724 174.7330 40 K 4.7066 8.7831 122.2490 56.2557 32.6666 176.8236 41 H 4.8674 8.7373 120.8912 54.6973 30.3742 175.6914 42 H 4.0498 9.9169 119.9149 59.8811 29.3130 177.5124 43 S 4.1781 8.1209 114.7930 61.3481 63.0415 176.1425 44 L 4.0066 7.4808 122.6044 58.1870 41.7757 178.8858 45 L 4.0392 7.6265 117.4856 57.1263 41.5778 178.3379 46 E 4.4077 7.7205 115.5562 56.1293 29.7428 177.5614 47 A 4.1649 7.6055 122.0943 54.4324 19.0102 179.5604 48 S 4.7534 7.9080 111.4917 58.0405 63.8122 174.0479 49 L 4.6541 7.7945 119.2589 53.3630 43.2640 177.4545 50 S 4.4896 8.5234 116.3080 59.7374 63.9285 174.0492 51 M 4.7408 7.5769 116.4456 53.2150 33.7338 174.4110 52 A 4.2828 8.4025 123.6886 52.3487 19.2238 177.7172 53 R 4.1830 7.8082 119.5747 55.0564 31.0578 175.5806 54 P 4.4037 0.0000 0.0000 62.3308 32.5139 176.8649 55 E 3.8943 9.0717 121.5837 60.0513 29.1287 179.4697 56 Q 4.0302 8.0697 116.8875 58.4187 29.2363 176.9844 57 L 4.5459 7.6991 118.2028 54.6652 43.3186 177.0025 58 D 4.6066 7.4595 118.6454 53.4822 39.2549 173.5956 59 I 4.0886 7.7246 123.2899 59.2390 38.3652 175.0909 60 P 4.5431 0.0000 0.0000 62.5390 33.3376 176.9787 61 D 4.5012 8.7474 119.1363 57.7166 40.6372 178.9393 62 D 4.2274 8.0549 119.0124 56.3093 39.4505 178.4250 63 A 3.9377 7.8525 121.7226 54.7744 18.6502 179.3905 64 L 3.9783 7.8673 117.6058 57.7694 41.6100 179.7158 65 K 2.8351 7.7992 119.7572 59.1720 32.0146 178.5158 66 D 4.2764 8.1136 119.3873 57.5592 40.7025 178.2812 67 Y 4.2229 8.0661 119.7375 60.6961 38.7278 177.9021 68 A 3.7873 7.8745 121.3988 55.2843 18.3857 179.7390 69 T 3.7328 8.0737 114.5187 66.6860 68.4950 176.3489 70 E 3.8884 8.2230 121.1913 59.3492 29.6416 178.9812 71 I 3.5441 7.5004 119.4269 64.3326 37.1869 178.3283 72 A 3.9534 8.1370 121.8913 55.0956 18.1089 179.8935 73 V 3.4891 8.1083 117.2136 66.0472 31.5997 177.9912 74 Q 3.8959 8.2524 119.2175 59.1233 28.8544 178.1605 75 A 3.9751 8.0631 121.7352 55.0470 18.4329 179.4970 76 K 3.8916 8.0919 118.0993 59.8507 32.2212 179.0958 77 T 3.8237 8.0907 116.1552 66.7504 68.5189 176.5793 78 R 3.8621 8.4682 120.7143 59.2280 30.1977 178.2761 79 A 4.0041 8.4342 121.0472 55.6367 18.4755 179.8144 80 T 4.5233 7.8792 115.4930 66.2220 68.2580 176.5519 81 E 3.9798 8.0699 119.7415 59.6110 29.6969 178.9048 82 L 4.3590 7.5454 114.8485 54.8818 41.9156 176.5185 83 G 3.6071 7.5276 109.2356 45.5029 0.0000 175.0261 84 V 3.7003 7.8200 121.8403 61.7933 32.0511 173.5653 85 P 4.4700 0.0000 0.0000 62.7508 32.2376 176.7262 86 A 3.9958 8.9965 126.0874 55.4792 18.2803 179.3618 87 D 4.5076 8.0416 112.7729 55.4448 39.8024 177.0843 88 K 4.3644 8.2753 119.3142 56.6411 32.7479 175.9793 89 V 5.0040 7.5900 118.8346 59.8356 33.3824 175.4910 90 R 4.6072 9.0517 123.4750 54.0450 33.7166 174.2003 91 A 5.1685 8.1890 123.9897 50.3240 21.4691 176.0313 92 F 4.8156 9.2731 119.4353 55.6081 43.5609 174.1110 93 V 5.0475 8.5558 121.3744 61.1956 34.0420 174.7287 94 K 4.7498 8.9895 126.1418 54.6082 36.4492 175.5414 95 G 2.9545 9.3186 110.7254 44.3849 0.0000 174.5623 96 G 3.9516 7.2241 109.9032 44.0933 0.0000 172.5696 97 R 4.0772 8.0500 119.6977 55.0988 31.1451 175.3747 98 P 4.1959 0.0000 0.0000 65.7948 31.6223 178.7832 99 S 4.1053 8.0049 113.1551 61.9171 62.8684 177.0279 100 R 3.9737 7.8943 120.0334 59.4970 29.8244 179.1561 101 T 3.9101 8.2153 115.8780 66.5339 68.4441 176.8067 102 I 3.6769 8.1227 122.1348 64.4235 37.2587 178.6341 103 V 3.6421 7.8594 118.9415 66.1525 31.2754 178.2964 104 R 3.9391 8.1537 117.7942 59.1182 29.8117 178.7942 105 F 3.9557 8.5267 120.3876 61.2151 39.3453 176.9439 106 A 3.9905 8.2769 120.4158 55.1137 18.2767 179.6868 107 R 3.4169 7.8023 116.5697 59.3218 30.0217 178.6123 108 K 3.7738 7.8789 118.6804 59.5544 32.1776 177.7085 109 R 3.9619 7.6886 114.4204 55.6632 30.2338 175.9566 110 E 3.7139 7.4818 116.2839 57.4291 27.4159 174.9089 111 C 4.3098 8.2764 116.0131 59.9664 28.9392 173.9513 112 D 4.9209 8.4794 122.2577 53.2251 40.0784 175.8615 113 L 4.5937 7.4550 120.7512 53.9454 45.9266 173.8266 114 V 4.7947 8.4788 125.2278 61.0071 34.4606 174.1431 115 V 4.7874 8.9817 127.9511 61.1797 33.6906 174.0439 116 I 4.6666 8.8275 128.1065 58.7511 41.6664 174.7633 117 G 4.0095 8.7024 114.3174 46.1286 0.0000 173.6857 118 A 4.2260 8.7897 125.3568 54.1990 18.6787 177.4734 119 Q 5.0413 7.8684 112.7238 54.1582 33.8156 174.0321 120 G 4.4505 8.1850 109.5308 43.7491 0.0000 175.7860 121 T 3.8968 8.8869 112.0706 64.2170 68.9330 174.9092 122 N 4.8131 8.0698 118.1966 52.8719 38.6994 175.3089 123 G 3.8261 7.8444 108.0238 45.9239 0.0000 173.5706 124 D 4.5577 8.6036 121.4334 52.9799 41.8164 175.7828 125 K 4.0909 8.5722 119.2610 57.4587 31.9230 173.0857 126 S 4.4326 7.8070 110.9337 58.9769 62.7614 173.1585 127 L 4.6856 8.1171 121.3119 54.2447 41.8825 176.6764 128 L 4.1807 7.2375 119.7371 54.8681 41.0477 176.4427 129 L 4.0542 8.4803 125.8851 54.3645 42.8235 176.8039 130 G 3.8485 9.0135 115.7650 45.4488 0.0000 174.6497 131 S 4.0949 8.6111 116.4593 61.1627 62.9743 177.0738 132 V 3.8601 7.9654 122.4917 65.0498 31.3536 177.4815 133 A 3.9641 8.0066 120.1114 55.3381 18.0662 179.1360 134 Q 3.8843 8.3286 118.1059 59.5802 29.2780 178.8886 135 R 3.9544 7.9270 118.8905 59.0480 30.0426 179.2508 136 V 3.5631 8.1661 118.2419 65.9998 31.3681 177.9312 137 A 4.0689 8.1035 119.6090 55.1152 18.2144 179.4606 138 G 3.7169 7.8614 103.5417 46.7534 0.0000 175.2375 139 S 4.6207 7.7421 113.1679 57.3821 64.6657 174.6440 140 A 4.1878 7.5627 126.2085 52.3590 18.6328 177.4508 141 H 4.3695 8.9047 116.8371 57.3964 29.0970 174.6290 142 C 4.8002 7.2843 113.4436 55.0378 32.7195 171.8663 143 P 4.4139 0.0000 0.0000 62.7814 32.2743 175.9556 144 V 4.5709 8.1565 122.2527 61.0012 33.8603 174.6816 145 L 4.2455 9.0840 132.0661 54.3661 42.9288 175.6406 146 V 4.4864 8.3336 127.6487 61.7211 32.3852 175.7621 147 V 4.0309 8.5626 128.0589 62.9671 31.0219 175.3551 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 4.16 0.00 1.83 1.78 0.00 0.00 0.00 0.00 0.00 -0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 2.00 0.00 2 F 7.76 5.01 0.00 3.13 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 3 N 10.09 4.66 0.00 2.60 2.86 0.00 0.00 6.03 7.58 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 4 R 8.61 4.74 0.00 1.72 1.59 0.00 2.78 0.00 0.00 2.25 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.01 0.00 5 I 8.95 4.83 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 0.99 0.69 0.82 0.00 0.00 6 M 9.04 5.10 0.00 2.09 1.99 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.51 0.00 7 V 8.76 4.99 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 1.27 0.00 0.00 0.94 0.00 0.00 8 P 0.00 4.92 0.00 1.95 1.93 0.00 3.89 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.10 0.00 9 V 9.05 4.60 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 0.85 0.00 0.00 0.95 0.00 0.00 10 D 8.59 4.73 0.00 2.77 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 11 G 8.39 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 12 S 8.10 4.59 0.00 4.17 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 13 K 8.56 4.10 0.00 1.83 1.91 0.00 1.68 0.00 0.00 1.83 0.00 0.00 2.94 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.54 1.52 7.81 14 G 8.37 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 15 A 8.20 4.06 1.41 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 0.00 0.00 0.00 16 V 7.65 3.51 2.25 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 1.02 0.00 0.00 0.99 0.00 0.00 17 K 8.14 4.16 0.00 1.96 1.84 0.00 1.74 0.00 0.00 1.78 0.00 0.00 2.95 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.67 1.60 7.81 18 A 8.03 3.97 1.36 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 0.00 0.00 0.00 19 L 8.11 3.88 0.00 1.85 1.87 0.93 1.12 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 20 E 8.28 3.99 0.00 2.24 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 2.33 2.50 0.00 21 K 8.10 4.13 0.00 1.91 1.84 0.00 1.69 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.57 1.59 7.81 22 G 8.37 3.65 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 0.00 0.00 0.00 23 V 8.30 3.70 2.23 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 1.09 0.00 0.00 1.02 0.00 0.00 24 G 8.02 3.76 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 25 L 8.10 4.11 0.00 1.85 1.79 0.84 0.69 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 26 Q 8.24 4.02 0.00 2.25 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.80 0.00 0.00 0.00 0.00 0.00 2.55 2.60 0.00 27 Q 8.17 4.22 0.00 2.23 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.79 0.00 0.00 0.00 0.00 0.00 2.54 2.52 0.00 28 L 7.63 4.19 0.00 1.79 1.88 0.94 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 29 T 7.72 4.54 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 1.38 0.00 0.00 30 G 8.52 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 0.00 0.00 0.00 31 A 7.53 4.44 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 32 E 9.17 4.38 0.00 1.97 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 0.00 2.45 2.33 0.00 33 L 9.62 5.24 0.00 1.79 1.61 1.03 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 34 Y 9.66 5.39 0.00 2.98 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 I 9.19 4.93 1.91 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 0.86 0.91 0.00 0.00 36 L 8.68 5.10 0.00 1.15 1.20 0.58 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 37 C 8.87 5.22 0.00 2.96 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 38 V 8.47 4.86 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 0.81 0.00 0.00 0.85 0.00 0.00 39 F 8.71 5.09 0.00 3.22 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 40 K 8.78 4.71 0.00 1.71 1.80 0.00 1.76 0.00 0.00 1.75 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.54 1.45 7.81 41 H 8.74 4.87 0.00 3.69 3.46 0.00 5.47 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 H 9.92 4.05 0.00 3.45 3.41 0.00 5.59 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 43 S 8.12 4.18 0.00 3.93 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 44 L 7.48 4.01 0.00 1.41 1.65 0.88 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 45 L 7.63 4.04 0.00 1.77 1.68 0.92 1.04 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 46 E 7.72 4.41 0.00 1.94 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 2.14 2.13 0.00 47 A 7.61 4.16 1.37 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 0.00 0.00 0.00 48 S 7.91 4.75 0.00 3.82 3.83 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 49 L 7.79 4.65 0.00 1.59 1.69 0.98 1.03 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 50 S 8.52 4.49 0.00 3.97 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 51 M 7.58 4.74 0.00 2.09 2.02 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 2.46 2.53 0.00 52 A 8.40 4.28 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 53 R 7.81 4.18 0.00 1.64 1.87 0.00 3.17 0.00 0.00 3.20 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.58 0.00 54 P 0.00 4.40 0.00 2.17 1.97 0.00 3.63 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 2.11 2.07 0.00 55 E 9.07 3.89 0.00 1.99 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 2.39 2.35 0.00 56 Q 8.07 4.03 0.00 2.08 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.70 0.00 0.00 0.00 0.00 0.00 2.33 2.44 0.00 57 L 7.70 4.55 0.00 1.78 1.69 0.91 0.91 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 58 D 7.46 4.61 0.00 2.77 2.74 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 59 I 7.72 4.09 1.89 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 1.66 0.91 0.90 0.00 0.00 60 P 0.00 4.54 0.00 2.43 2.17 0.00 3.71 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 2.16 2.04 0.00 61 D 8.75 4.50 0.00 2.85 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 62 D 8.05 4.23 0.00 2.82 2.90 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 63 A 7.85 3.94 1.36 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 0.00 0.00 0.00 64 L 7.87 3.98 0.00 1.86 1.85 1.15 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 65 K 7.80 2.84 0.00 0.89 1.56 0.00 1.57 0.00 0.00 1.54 0.00 0.00 2.93 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.18 0.95 7.81 66 D 8.11 4.28 0.00 2.84 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 67 Y 8.07 4.22 0.00 2.97 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 68 A 7.87 3.79 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 69 T 8.07 3.73 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 1.16 0.00 0.00 70 E 8.22 3.89 0.00 2.14 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 0.00 2.30 2.37 0.00 71 I 7.50 3.54 1.77 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.23 0.80 0.00 0.00 72 A 8.14 3.95 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 73 V 8.11 3.49 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 1.03 0.00 0.00 0.93 0.00 0.00 74 Q 8.25 3.90 0.00 2.18 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.34 2.41 0.00 75 A 8.06 3.98 1.37 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 0.00 0.00 0.00 76 K 8.09 3.89 0.00 1.82 1.94 0.00 1.69 0.00 0.00 1.57 0.00 0.00 2.87 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.41 1.46 7.81 77 T 8.09 3.82 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 1.26 0.00 0.00 78 R 8.47 3.86 0.00 1.93 2.11 0.00 3.23 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.69 0.00 79 A 8.43 4.00 1.40 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 80 T 7.88 4.52 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 1.21 0.00 0.00 81 E 8.07 3.98 0.00 2.16 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 2.35 2.54 0.00 82 L 7.55 4.36 0.00 1.80 1.71 0.93 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 83 G 7.53 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 84 V 7.82 3.70 2.19 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 0.99 0.00 0.00 1.04 0.00 0.00 85 P 0.00 4.47 0.00 2.24 1.99 0.00 3.70 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.11 0.00 86 A 9.00 4.00 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 87 D 8.04 4.51 0.00 2.81 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 88 K 8.28 4.36 0.00 2.01 1.94 0.00 1.83 0.00 0.00 1.76 0.00 0.00 2.98 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.55 7.81 89 V 7.59 5.00 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 0.82 0.00 0.00 0.96 0.00 0.00 90 R 9.05 4.61 0.00 1.46 1.27 0.00 3.09 0.00 0.00 3.02 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.47 0.00 91 A 8.19 5.17 1.09 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 0.00 0.00 92 F 9.27 4.82 0.00 2.75 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 93 V 8.56 5.05 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 1.00 0.00 0.00 0.93 0.00 0.00 94 K 8.99 4.75 0.00 1.62 1.57 0.00 1.80 0.00 0.00 1.76 0.00 0.00 3.16 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.37 1.50 7.81 95 G 9.32 2.95 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 96 G 7.22 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 97 R 8.05 4.08 0.00 1.85 1.86 0.00 3.14 0.00 0.00 3.33 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.70 0.00 98 P 0.00 4.20 0.00 2.14 2.08 0.00 3.59 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.17 0.00 99 S 8.00 4.11 0.00 3.86 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 0.00 100 R 7.89 3.97 0.00 1.84 1.97 0.00 3.12 0.00 0.00 3.33 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.71 0.00 101 T 8.22 3.91 4.34 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 1.17 0.00 0.00 102 I 8.12 3.68 2.06 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 1.35 0.97 0.92 0.00 0.00 103 V 7.86 3.64 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 0.99 0.00 0.00 104 R 8.15 3.94 0.00 2.00 1.97 0.00 3.19 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.80 0.00 105 F 8.53 3.96 0.00 3.20 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 0.00 106 A 8.28 3.99 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 0.00 107 R 7.80 3.42 0.00 1.88 2.00 0.00 3.16 0.00 0.00 3.02 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.67 0.00 108 K 7.88 3.77 0.00 1.72 1.60 0.00 1.79 0.00 0.00 1.58 0.00 0.00 2.93 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.33 1.34 7.81 109 R 7.69 3.96 0.00 1.37 1.56 0.00 3.53 0.00 0.00 3.01 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.50 0.00 110 E 7.48 3.71 0.00 2.04 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 2.18 2.17 0.00 111 C 8.28 4.31 0.00 2.92 2.87 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 0.00 112 D 8.48 4.92 0.00 2.80 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 0.00 113 L 7.45 4.59 0.00 0.91 1.06 0.53 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 114 V 8.48 4.79 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 0.71 0.00 0.00 0.93 0.00 0.00 115 V 8.98 4.79 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 0.97 0.00 0.00 0.82 0.00 0.00 116 I 8.83 4.67 1.85 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 1.15 1.54 0.95 0.00 0.00 117 G 8.70 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 0.00 0.00 0.00 118 A 8.79 4.23 1.31 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 0.00 0.00 119 Q 7.87 5.04 0.00 2.07 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.49 0.00 0.00 0.00 0.00 0.00 2.40 2.31 0.00 120 G 8.18 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 0.00 0.00 0.00 0.00 121 T 8.89 3.90 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 0.00 122 N 8.07 4.81 0.00 2.74 2.87 0.00 0.00 6.88 7.65 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 0.00 123 G 7.84 3.83 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 0.00 0.00 0.00 124 D 8.60 4.56 0.00 2.74 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 0.00 125 K 8.57 4.09 0.00 1.80 1.77 0.00 1.81 0.00 0.00 1.63 0.00 0.00 2.67 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.36 0.99 7.81 126 S 7.81 4.43 0.00 3.86 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 0.00 127 L 8.12 4.69 0.00 1.66 1.65 0.92 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 128 L 7.24 4.18 0.00 1.84 1.68 0.92 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 129 L 8.48 4.05 0.00 1.61 1.62 0.97 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 130 G 9.01 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 0.00 0.00 0.00 131 S 8.61 4.09 0.00 4.06 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 0.00 132 V 7.97 3.86 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 1.48 0.00 0.00 0.93 0.00 0.00 133 A 8.01 3.96 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 0.00 134 Q 8.33 3.88 0.00 2.21 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.77 0.00 0.00 0.00 0.00 0.00 2.36 2.40 0.00 135 R 7.93 3.95 0.00 1.93 1.95 0.00 3.28 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 136 V 8.17 3.56 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 1.08 0.00 0.00 0.95 0.00 0.00 137 A 8.10 4.07 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 0.00 138 G 7.86 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 0.00 139 S 7.74 4.62 0.00 4.06 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 0.00 140 A 7.56 4.19 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 0.00 141 H 8.90 4.37 0.00 3.29 3.43 0.00 5.48 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 C 7.28 4.80 0.00 2.95 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 0.00 143 P 0.00 4.41 0.00 2.11 2.05 0.00 3.80 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 2.29 2.14 0.00 144 V 8.16 4.57 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 0.76 0.00 0.00 0.99 0.00 0.00 145 L 9.08 4.25 0.00 1.67 1.46 0.91 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 146 V 8.33 4.49 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 0.81 0.00 0.00 0.92 0.00 0.00 147 V 8.56 4.03 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 0.77 0.00 0.00 0.91 0.00 0.00