NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3424 8.2649 123.5813 52.5227 20.1290 176.2050 2 T 4.3229 8.2649 115.3338 63.7884 70.7386 173.2819 3 K 5.2949 8.3253 121.0471 54.7616 37.0356 174.9375 4 A 5.2931 9.0650 123.5875 51.2063 23.3260 175.3253 5 V 5.1298 8.9114 117.5046 60.5816 35.4044 173.4420 6 A 5.0082 9.1853 123.6839 50.3634 22.5620 175.0351 7 V 4.4899 8.3835 122.4774 61.2269 33.6419 174.5175 8 L 4.6284 8.9263 129.7599 54.2830 42.9118 176.4244 9 K 4.8271 9.1174 122.1377 55.5086 37.0502 176.3519 10 G 4.6481 7.9809 108.8778 45.5678 0.0000 172.0414 11 D 4.5837 8.8091 118.0812 55.2396 41.9514 176.9417 12 G 4.3469 7.5841 109.2644 44.1248 0.0000 171.6694 13 P 4.3765 0.0000 0.0000 64.0952 32.1161 176.5389 14 V 4.5238 7.8428 120.2748 62.7025 31.8003 174.9104 15 Q 5.0919 7.4835 124.3199 55.5381 32.3313 173.2598 16 G 4.2380 7.7454 106.1799 46.4585 0.0000 171.6480 17 I 5.1070 7.8305 119.3536 59.4406 40.7841 175.0197 18 I 4.5500 8.7363 128.0801 59.5090 39.8612 174.6641 19 N 4.8932 8.3919 124.6949 51.7164 40.8516 174.1697 20 F 5.3069 8.9630 119.7437 55.8943 43.5119 173.7513 21 E 5.2066 9.4622 122.9208 55.0003 33.4891 173.5105 22 Q 4.9038 9.3755 128.1488 54.2369 30.7447 174.7241 23 K 4.1475 9.1126 128.6183 58.7913 32.8209 176.7835 24 E 4.8196 7.8217 116.9011 53.9451 32.9532 176.7188 25 S 4.3430 8.9222 117.0905 60.8568 62.9117 174.8900 26 N 4.7913 8.2180 115.7732 52.2553 37.2667 174.3329 27 G 4.0304 8.1363 109.1900 43.4938 0.0000 171.7162 28 P 4.7139 0.0000 0.0000 62.5286 32.7253 175.6817 29 V 4.6550 9.0804 120.7565 61.2573 33.9081 174.4387 30 K 4.9870 9.3155 127.9603 55.3575 34.0665 175.6791 31 V 4.9156 9.3437 125.4085 60.7893 34.3148 174.2438 32 W 5.9232 7.4442 123.4574 55.5540 31.8098 175.2909 33 G 3.9351 8.0915 106.2557 46.1130 0.0000 171.0460 34 S 5.1050 7.6474 114.0973 57.2395 66.8453 173.5371 35 I 5.1375 8.6730 121.6366 59.4926 41.1763 174.5893 36 K 4.8687 9.1535 124.8703 55.6218 36.3337 176.9491 37 G 3.7578 8.9663 106.7574 45.5719 0.0000 173.3907 38 L 4.5046 7.5827 119.8345 53.0325 43.2226 176.2825 39 T 4.3768 8.1278 111.0578 60.8050 69.7328 174.2200 40 E 4.0744 8.6517 124.4299 57.8777 30.2589 175.1488 41 G 3.7136 8.5334 110.1406 43.8248 0.0000 172.5499 42 L 4.7819 8.1448 118.5643 54.9981 42.7634 176.7717 43 H 5.0521 9.0312 119.0087 53.8228 33.2906 173.3172 44 G 4.1113 9.0073 110.7468 47.1377 0.0000 172.5559 45 F 5.5036 8.9657 124.8123 57.2852 42.3408 172.8506 46 H 5.0849 8.9456 122.5640 54.3511 34.1364 172.6546 47 V 4.5985 8.6880 120.7251 62.1073 32.9351 174.7342 48 H 5.0717 9.5070 126.2683 54.6412 30.3413 175.7062 49 E 3.6137 8.8080 123.7121 59.2495 29.4106 177.2040 50 F 4.9079 8.0409 118.0262 55.0177 41.3029 176.8560 51 G 4.2907 8.3193 112.3774 44.2036 0.0000 174.3703 52 D 4.7155 7.8917 117.8108 52.7476 42.4812 174.2695 53 N 5.3561 8.7170 124.1796 52.7302 39.1676 176.5123 54 T 3.9142 8.5850 109.6902 63.4873 68.5310 174.3868 55 A 4.7018 8.0836 125.9870 51.4726 20.3743 176.7089 56 G 4.1755 7.9194 110.1554 48.3276 0.0000 175.9911 57 C 4.4467 8.6079 116.4680 59.5091 40.1238 175.5856 58 T 3.8126 7.4170 116.6803 66.1627 67.8318 175.6543 59 S 4.4752 7.9509 113.5627 59.0129 63.5565 175.4106 60 A 4.1433 7.4896 126.4818 53.8993 18.2165 178.5817 61 G 4.2906 7.8209 105.8985 43.9730 0.0000 170.6446 62 P 4.6822 0.0000 0.0000 62.0178 33.8614 175.0684 63 H 4.4006 8.3864 116.4444 55.6841 29.5477 175.6065 64 F 4.2427 9.1753 125.5999 58.2891 40.1920 174.9298 65 N 5.1449 7.9577 125.5563 51.4134 38.7818 172.9590 66 P 4.0623 0.0000 0.0000 65.1598 31.9705 177.9303 67 L 4.2250 7.5890 116.4340 53.7848 42.2663 176.2910 68 S 3.5916 7.4160 114.2363 60.0398 60.5581 170.7768 69 R 4.6260 8.4530 117.8195 54.0250 33.5373 176.3611 70 K 4.3949 8.7537 118.1887 55.9416 33.4720 176.7742 71 H 4.0526 8.5873 123.0509 57.1999 30.5830 174.8681 72 G 4.0040 7.7180 108.6966 45.8960 0.0000 172.8378 73 G 4.0987 8.9618 109.2486 43.6119 0.0000 173.2214 74 P 4.3247 0.0000 0.0000 64.6271 31.1167 177.3071 75 K 4.4060 7.9444 115.5034 56.1249 32.2191 175.7679 76 D 4.7716 7.8462 119.8618 52.9243 42.0468 176.4828 77 E 3.8951 8.7881 124.0125 58.9177 29.8678 176.5649 78 E 4.2366 7.8862 120.7395 55.5670 29.3363 174.8999 79 R 4.9121 7.5894 120.1213 56.5199 31.8031 173.8691 80 H 4.6818 9.0562 116.4930 55.1566 29.4450 177.1936 81 V 3.5282 8.2972 122.6944 66.0543 31.5311 177.1938 82 G 3.8235 8.2959 106.6536 46.1550 0.0000 172.8069 83 D 4.9036 8.2318 121.3653 54.4080 39.8991 176.1625 84 L 4.7346 8.3544 124.0936 54.0570 43.2657 178.6484 85 G 3.9835 7.9706 109.7433 47.0246 0.0000 174.6890 86 N 5.6979 8.7557 120.5644 51.3400 42.0776 173.2683 87 V 4.3868 8.5328 114.2694 59.9122 35.5977 174.7735 88 T 5.0529 8.1843 118.1776 61.8330 71.3528 173.0001 89 A 4.9138 9.0126 129.6199 50.8955 20.7710 177.2902 90 D 4.9317 9.0747 122.7232 51.8785 41.3400 177.1710 91 K 3.8859 8.5374 117.3027 59.9961 32.3712 177.1983 92 D 4.5525 8.2733 117.2543 54.0024 41.0487 176.8327 93 G 4.3377 8.5741 108.2454 44.8619 0.0000 172.7858 94 V 4.8068 8.3656 120.0939 60.6889 34.0652 174.2793 95 A 5.4604 8.9396 129.8897 49.5754 21.1814 174.8055 96 D 5.0171 8.6611 123.0994 53.6871 42.0982 176.3349 97 V 4.0947 8.6765 124.9974 61.5805 33.3995 174.9931 98 S 4.9225 8.4814 122.6819 57.5121 64.1832 172.6679 99 I 4.8918 9.6633 128.5345 59.5366 41.9090 174.2133 100 E 5.1409 8.7179 124.0546 54.7521 32.5266 174.0695 101 D 4.9598 9.4993 126.1438 52.3669 45.0574 175.5432 102 S 4.8498 8.8265 118.0374 58.1727 63.6356 174.4584 103 V 4.0964 8.2992 121.8924 64.8022 32.2799 176.6810 104 I 4.1516 7.8037 111.0587 60.7869 38.5735 174.6459 105 S 4.6821 8.2260 114.4760 57.2557 65.4136 173.9487 106 L 4.5480 8.9883 124.1067 54.1667 41.4832 176.1198 107 S 4.3735 7.7651 111.5539 58.1785 66.0441 175.0361 108 G 4.0297 8.6245 105.1135 45.0759 0.0000 173.7892 109 D 4.4285 8.4781 118.0438 56.9095 41.0095 176.8019 110 H 5.2657 7.8551 114.9200 55.2122 29.5715 174.1295 111 S 4.4375 8.0436 113.9030 58.6846 62.8977 173.8900 112 I 3.8307 8.2206 118.0318 60.5645 37.9727 175.7806 113 I 3.6678 7.2535 123.5570 62.9661 37.4551 176.4954 114 G 3.8055 9.3310 113.4538 45.3671 0.0000 172.8680 115 R 4.9997 7.3820 119.1323 54.7134 33.7701 174.4170 116 T 4.9553 8.0442 115.4235 62.1186 71.3502 173.6069 117 L 4.7775 8.6276 128.6816 53.8880 43.9502 175.3125 118 V 4.9378 8.9373 126.2137 60.9340 35.2558 174.1873 119 V 5.1107 8.5630 126.6567 60.4686 33.6717 174.9220 120 H 5.2521 9.2241 122.1444 54.4926 30.3369 175.2596 121 E 4.1327 9.1566 121.3784 59.3718 29.8963 176.9154 122 K 4.7042 8.4577 117.7861 54.2479 35.8186 175.0282 123 A 4.6563 8.2963 121.8764 51.9700 19.9889 176.2148 124 D 4.7052 9.6863 121.9315 53.2490 41.8375 175.9503 125 D 4.6647 9.3472 125.3630 52.8682 39.4673 176.4561 126 L 3.5333 9.6684 118.7047 56.1125 39.8105 175.3603 127 G 4.2891 8.8018 103.6243 46.7576 0.0000 175.2052 128 K 4.5246 8.1884 116.5278 55.5271 32.9218 178.4604 129 G 3.6932 7.5154 108.5037 46.4411 0.0000 175.1717 130 G 3.9533 7.8829 107.1320 45.0602 0.0000 172.6926 131 N 5.0669 7.4605 115.3161 50.1853 40.3180 174.6316 132 E 4.0278 8.7035 118.9169 59.5789 29.4679 178.5523 133 E 3.9589 8.1897 118.7842 59.1527 29.7452 178.5693 134 S 4.1200 8.6206 114.0537 61.0148 62.4167 175.1931 135 T 4.3336 7.6435 110.3662 62.0591 68.5807 175.2066 136 K 4.2916 7.7119 119.0237 58.0334 34.2524 177.3147 137 T 4.2487 8.0029 107.4824 60.1606 69.9819 175.2308 138 G 4.1293 7.9559 109.5475 45.7830 0.0000 173.1661 139 N 4.3143 7.7806 114.4412 53.9361 36.7802 175.7838 140 A 4.1591 6.9454 119.0397 51.9018 19.3713 179.9079 141 G 3.6238 7.3491 104.9543 44.5221 0.0000 173.4866 142 S 4.4208 8.4066 114.1812 58.5483 64.7828 173.9593 143 R 4.4797 8.3261 119.7194 55.0649 30.1124 176.5487 144 L 4.2984 8.6298 125.4448 57.4564 43.0112 177.2458 145 A 5.1174 7.7096 117.8978 51.3389 22.7996 174.0238 146 C 5.1575 9.1512 113.5824 55.2005 46.9768 172.8470 147 G 4.7367 8.3819 104.2603 45.8276 0.0000 172.9247 148 V 4.2412 8.3020 122.8396 62.4819 32.7482 175.6905 149 I 4.0535 9.0195 129.4949 61.1183 37.6873 175.2312 150 G 4.4051 8.8166 115.0649 43.8459 0.0000 171.9769 151 I 4.3981 8.3139 121.9112 61.2442 37.6298 175.3866 152 A 4.8327 8.3613 127.5046 49.6119 22.3151 176.0621 153 Q 4.0697 8.5379 118.7201 56.4480 29.2085 176.0205 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 8.26 4.34 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 T 8.26 4.32 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 1.30 0.00 0.00 3 K 8.33 5.29 0.00 1.87 1.71 0.00 1.79 0.00 0.00 1.94 0.00 0.00 3.28 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.55 1.49 7.81 4 A 9.07 5.29 1.08 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 5 V 8.91 5.13 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 0.75 0.00 0.00 0.94 0.00 0.00 6 A 9.19 5.01 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 7 V 8.38 4.49 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 0.99 0.00 0.00 0.92 0.00 0.00 8 L 8.93 4.63 0.00 1.71 1.59 1.04 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 9 K 9.12 4.83 0.00 1.65 1.62 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.81 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.35 1.39 7.81 10 G 7.98 4.65 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 11 D 8.81 4.58 0.00 2.68 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 12 G 7.58 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 13 P 0.00 4.38 0.00 2.18 2.18 0.00 3.77 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.94 0.00 14 V 7.84 4.52 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 0.56 0.00 0.00 0.92 0.00 0.00 15 Q 7.48 5.09 0.00 2.16 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.64 0.00 0.00 0.00 0.00 0.00 2.51 2.20 0.00 16 G 7.75 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 I 7.83 5.11 1.82 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 1.21 1.50 0.84 0.00 0.00 18 I 8.74 4.55 1.83 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.27 0.46 0.00 0.00 19 N 8.39 4.89 0.00 1.44 1.52 0.00 0.00 6.33 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 F 8.96 5.31 0.00 2.86 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 21 E 9.46 5.21 0.00 2.48 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 2.34 2.55 0.00 22 Q 9.38 4.90 0.00 2.08 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.72 0.00 0.00 0.00 0.00 0.00 2.44 2.49 0.00 23 K 9.11 4.15 0.00 1.78 1.85 0.00 1.78 0.00 0.00 1.72 0.00 0.00 2.89 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.44 1.49 7.81 24 E 7.82 4.82 0.00 2.00 1.89 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 2.30 2.21 0.00 25 S 8.92 4.34 0.00 3.98 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 26 N 8.22 4.79 0.00 2.84 2.93 0.00 0.00 5.90 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 G 8.14 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 0.00 0.00 0.00 28 P 0.00 4.71 0.00 2.14 2.10 0.00 3.76 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.99 0.00 29 V 9.08 4.65 2.22 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 1.31 0.00 0.00 1.05 0.00 0.00 30 K 9.32 4.99 0.00 1.93 1.88 0.00 1.62 0.00 0.00 1.47 0.00 0.00 2.89 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.45 1.44 7.81 31 V 9.34 4.92 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 0.70 0.00 0.00 1.00 0.00 0.00 32 W 7.44 5.92 0.00 3.51 3.20 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 0.00 0.00 0.00 33 G 8.09 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 34 S 7.65 5.10 0.00 3.84 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 35 I 8.67 5.14 1.80 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.59 0.95 0.00 0.00 36 K 9.15 4.87 0.00 1.75 1.86 0.00 1.32 0.00 0.00 1.64 0.00 0.00 2.85 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.44 1.34 7.81 37 G 8.97 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 38 L 7.58 4.50 0.00 1.80 1.45 0.84 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 39 T 8.13 4.38 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 1.24 0.00 0.00 40 E 8.65 4.07 0.00 1.95 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 0.00 2.30 2.46 0.00 41 G 8.53 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 L 8.14 4.78 0.00 1.51 1.59 0.92 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 43 H 9.03 5.05 0.00 3.03 3.28 0.00 5.64 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 44 G 9.01 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 0.00 0.00 0.00 45 F 8.97 5.50 0.00 2.95 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.95 5.08 0.00 3.06 3.16 0.00 5.85 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 V 8.69 4.60 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 0.89 0.00 0.00 0.89 0.00 0.00 48 H 9.51 5.07 0.00 3.07 3.42 0.00 5.72 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 49 E 8.81 3.61 0.00 1.67 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 1.47 2.03 0.00 50 F 8.04 4.91 0.00 3.13 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 51 G 8.32 4.29 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 0.00 0.00 0.00 52 D 7.89 4.72 0.00 2.63 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 N 8.72 5.36 0.00 2.77 2.71 0.00 0.00 7.43 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 54 T 8.58 3.91 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 55 A 8.08 4.70 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 56 G 7.92 4.18 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 0.00 0.00 0.00 0.00 0.00 0.00 57 C 8.61 4.45 0.00 2.96 3.09 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 58 T 7.42 3.81 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 1.23 0.00 0.00 59 S 7.95 4.48 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 60 A 7.49 4.14 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 61 G 7.82 4.29 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 0.00 0.00 0.00 62 P 0.00 4.68 0.00 2.04 2.20 0.00 3.74 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.99 0.00 63 H 8.39 4.40 0.00 2.82 3.20 0.00 5.73 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 F 9.18 4.24 0.00 2.93 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 65 N 7.96 5.14 0.00 2.57 2.43 0.00 0.00 6.93 7.71 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 66 P 0.00 4.06 0.00 1.59 1.62 0.00 2.96 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.94 0.00 67 L 7.59 4.22 0.00 1.56 1.68 0.88 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 68 S 7.42 3.59 0.00 3.96 3.86 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 0.00 0.00 0.00 0.00 69 R 8.45 4.63 0.00 1.85 1.96 0.00 3.11 0.00 0.00 3.37 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.68 0.00 70 K 8.75 4.39 0.00 1.67 1.68 0.00 1.66 0.00 0.00 1.56 0.00 0.00 2.79 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.43 1.37 7.81 71 H 8.59 4.05 0.00 3.20 3.15 0.00 5.98 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 G 7.72 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 73 G 8.96 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 0.00 0.00 0.00 74 P 0.00 4.32 0.00 2.23 2.39 0.00 3.39 0.00 0.00 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.02 0.00 75 K 7.94 4.41 0.00 1.77 1.87 0.00 1.77 0.00 0.00 1.72 0.00 0.00 3.02 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.41 1.40 7.81 76 D 7.85 4.77 0.00 2.79 2.61 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 77 E 8.79 3.90 0.00 1.91 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 0.00 2.28 2.23 0.00 78 E 7.89 4.24 0.00 1.92 1.83 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 2.23 2.30 0.00 79 R 7.59 4.91 0.00 1.95 1.77 0.00 2.72 0.00 0.00 3.87 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.53 0.00 80 H 9.06 4.68 0.00 3.52 3.41 0.00 5.65 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 V 8.30 3.53 1.58 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 0.88 0.00 0.00 0.71 0.00 0.00 82 G 8.30 3.82 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 0.00 0.00 0.00 83 D 8.23 4.90 0.00 2.83 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 84 L 8.35 4.73 0.00 1.89 1.87 0.93 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 85 G 7.97 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 0.00 0.00 0.00 86 N 8.76 5.70 0.00 2.59 2.70 0.00 0.00 6.60 7.68 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 87 V 8.53 4.39 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 -0.20 0.00 0.00 0.80 0.00 0.00 88 T 8.18 5.05 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 1.20 0.00 0.00 89 A 9.01 4.91 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 90 D 9.07 4.93 0.00 2.82 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 91 K 8.54 3.89 0.00 1.88 1.99 0.00 1.56 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.40 1.47 7.81 92 D 8.27 4.55 0.00 2.82 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 93 G 8.57 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 0.00 0.00 0.00 0.00 94 V 8.37 4.81 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 0.92 0.00 0.00 0.92 0.00 0.00 95 A 8.94 5.46 1.16 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 96 D 8.66 5.02 0.00 2.56 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 97 V 8.68 4.09 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.55 0.00 0.00 98 S 8.48 4.92 0.00 3.90 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 99 I 9.66 4.89 1.97 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.89 1.01 0.00 0.00 100 E 8.72 5.14 0.00 1.95 1.80 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 2.22 2.33 0.00 101 D 9.50 4.96 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 0.00 102 S 8.83 4.85 0.00 4.01 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 0.00 103 V 8.30 4.10 2.28 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 0.83 0.00 0.00 0.95 0.00 0.00 104 I 7.80 4.15 1.95 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.81 1.05 0.00 0.00 105 S 8.23 4.68 0.00 3.86 3.79 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 0.00 106 L 8.99 4.55 0.00 1.87 1.62 1.03 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 107 S 7.77 4.37 0.00 3.98 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 0.00 108 G 8.62 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 0.00 0.00 0.00 109 D 8.48 4.43 0.00 2.61 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 H 7.86 5.27 0.00 3.20 3.37 0.00 5.78 0.00 0.00 0.00 0.00 7.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 S 8.04 4.44 0.00 3.96 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 0.00 112 I 8.22 3.83 1.64 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.13 0.93 0.00 0.00 113 I 7.25 3.67 1.77 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.80 0.83 0.00 0.00 114 G 9.33 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 R 7.38 5.00 0.00 1.62 1.82 0.00 2.21 0.00 0.00 2.25 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.22 0.00 116 T 8.04 4.96 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 1.21 0.00 0.00 117 L 8.63 4.78 0.00 1.78 1.53 0.32 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 118 V 8.94 4.94 2.01 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 0.74 0.00 0.00 0.75 0.00 0.00 119 V 8.56 5.11 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 0.77 0.00 0.00 0.98 0.00 0.00 120 H 9.22 5.25 0.00 3.19 3.59 0.00 5.66 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 E 9.16 4.13 0.00 2.03 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 2.37 2.34 0.00 122 K 8.46 4.70 0.00 1.75 1.73 0.00 1.72 0.00 0.00 1.67 0.00 0.00 2.86 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.39 1.40 7.81 123 A 8.30 4.66 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 D 9.69 4.71 0.00 2.80 2.78 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 0.00 125 D 9.35 4.66 0.00 2.89 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 0.00 126 L 9.67 3.53 0.00 1.83 1.74 0.94 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 127 G 8.80 4.29 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 0.00 0.00 0.00 128 K 8.19 4.52 0.00 1.78 1.78 0.00 1.69 0.00 0.00 1.77 0.00 0.00 2.93 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.34 1.48 7.81 129 G 7.52 3.69 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 0.00 130 G 7.88 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 0.00 131 N 7.46 5.07 0.00 2.78 2.79 0.00 0.00 6.03 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 E 8.70 4.03 0.00 2.05 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 2.38 2.37 0.00 133 E 8.19 3.96 0.00 2.11 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 2.43 2.43 0.00 134 S 8.62 4.12 0.00 4.06 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 0.00 135 T 7.64 4.33 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 136 K 7.71 4.29 0.00 1.79 1.80 0.00 1.82 0.00 0.00 1.74 0.00 0.00 3.08 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.32 1.62 7.81 137 T 8.00 4.25 4.16 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 1.18 0.00 0.00 138 G 7.96 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 0.00 139 N 7.78 4.31 0.00 2.85 2.88 0.00 0.00 6.94 7.50 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 0.00 140 A 6.95 4.16 1.20 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 0.00 0.00 0.00 0.00 0.00 141 G 7.35 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 S 8.41 4.42 0.00 3.96 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 0.00 143 R 8.33 4.48 0.00 1.68 1.84 0.00 3.25 0.00 0.00 3.13 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.66 0.00 144 L 8.63 4.30 0.00 1.62 1.69 0.96 0.67 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 0.00 145 A 7.71 5.12 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 0.00 146 C 9.15 5.16 0.00 3.02 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 0.00 147 G 8.38 4.74 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 0.00 0.00 0.00 148 V 8.30 4.24 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 0.81 0.00 0.00 0.96 0.00 0.00 149 I 9.02 4.05 1.75 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.35 0.31 0.00 0.00 150 G 8.82 4.41 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 0.00 151 I 8.31 4.40 1.85 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 1.24 0.53 0.90 0.00 0.00 152 A 8.36 4.83 1.20 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 0.00 0.00 0.00 0.00 0.00 153 Q 8.54 4.07 0.00 2.04 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.78 6.60 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00