NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3804 8.3044 120.3206 55.9145 33.8154 174.8654 2 H 4.7054 8.3992 118.4730 54.8909 29.3370 172.5232 3 L 4.6995 8.0505 120.4932 53.5619 44.7832 177.3878 4 T 4.1400 8.1817 119.9842 62.4049 70.4870 174.1891 5 P 4.0730 0.0000 0.0000 66.2440 31.3167 178.8407 6 E 3.9977 8.0548 116.5330 59.3395 29.5727 179.1001 7 E 3.9588 7.8895 118.2691 59.1134 29.6157 179.2382 8 K 3.8822 8.7801 119.5507 59.5216 32.1712 179.5698 9 S 4.1407 8.1898 114.2397 61.2657 62.7362 176.4571 10 A 3.9968 7.8372 124.1141 54.9482 18.0940 179.4658 11 V 3.3701 7.5861 116.3566 66.4111 31.2356 177.9847 12 T 3.9402 7.9561 114.9904 67.0669 68.2351 176.4221 13 A 4.0786 7.9378 120.8214 54.8712 18.6554 179.1111 14 L 3.9647 8.0098 118.9155 57.8040 42.1780 178.6750 15 W 4.4096 8.8366 128.7234 60.6381 30.3527 178.0499 16 G 3.7586 7.8834 104.4913 47.3643 0.0000 174.7775 17 K 4.3586 7.8490 117.7981 55.6614 32.8506 176.8387 18 V 3.7884 7.0649 120.2879 61.8703 32.3482 175.7439 19 N 4.5523 8.1682 125.0715 52.2023 39.0267 175.5819 20 V 3.4953 8.0392 128.5226 65.6783 31.5425 177.2766 21 D 4.3247 8.0663 118.3562 57.4716 40.7798 178.4813 22 E 3.9199 8.5657 118.9569 59.4808 29.4850 179.6696 23 V 3.5934 7.9451 118.5600 65.5929 31.6045 178.3657 24 G 3.6514 8.4155 106.0446 47.7486 0.0000 175.9746 25 G 3.5962 7.7888 108.7692 47.3464 0.0000 175.4473 26 E 3.9031 8.2148 121.7462 58.7173 29.6795 178.7221 27 A 3.9122 8.1381 120.9771 55.1831 18.6421 179.3816 28 L 3.9888 7.8399 118.7332 58.1876 42.0610 179.4620 29 G 3.5508 8.0388 105.6656 47.8592 0.0000 175.9611 30 R 3.8991 8.2037 120.8704 58.6051 30.0149 178.7213 31 L 3.9888 7.9239 120.1813 58.4780 42.0074 179.2913 32 L 4.0424 7.8493 118.0875 57.0841 41.1935 179.4724 33 V 3.7112 7.0790 117.1231 65.2188 31.9300 177.8891 34 V 3.5008 7.9004 117.0224 64.5443 32.8143 175.8573 35 Y 3.7766 7.0859 117.2342 53.9479 37.5496 173.9340 36 P 4.5488 0.0000 0.0000 64.8856 31.2153 178.3016 37 W 4.4178 8.0800 115.5152 58.9637 27.6482 177.6372 38 T 4.2768 7.7409 110.4850 63.6664 68.3211 175.8800 39 Q 4.3826 8.2069 121.5757 57.8198 28.5344 177.9367 40 R 3.8230 7.4746 116.9329 58.4833 29.3019 177.7960 41 F 4.3067 7.0363 115.4976 57.0581 40.6663 175.5133 42 F 4.5755 7.4657 117.3292 56.4650 39.1899 176.5024 43 E 4.1682 7.9359 122.6507 59.2713 30.0792 179.6849 44 S 4.4825 8.0655 111.0138 59.8601 63.4235 175.0143 45 F 4.5395 7.9584 118.9396 59.0715 39.8860 175.3615 46 G 4.0305 7.2468 105.4665 44.4290 0.0000 175.1528 47 D 4.6499 8.7921 127.5089 53.6070 39.6826 175.7473 48 L 4.9189 8.2262 127.8104 54.6681 42.9748 179.0961 49 S 4.4049 8.2547 117.3741 61.0259 63.1889 175.1655 50 T 4.7265 7.3562 108.0244 58.1947 72.9270 172.6627 51 P 4.1864 0.0000 0.0000 66.1745 31.3976 178.2737 52 D 4.3619 8.1988 116.4494 57.7284 40.5885 179.0537 53 A 4.0626 8.1912 119.5853 54.5942 18.4430 179.6609 54 V 3.7545 7.8223 117.1591 66.4469 31.6047 178.2451 55 M 4.1787 8.6060 117.3879 57.9512 31.8035 178.3364 56 G 3.9737 7.9437 104.3934 44.8483 0.0000 173.3302 57 N 4.3651 7.5638 120.5863 52.9773 39.2132 173.6553 58 P 4.2683 0.0000 0.0000 65.9265 31.3060 178.5757 59 K 3.6800 8.0071 117.8661 58.8965 31.8245 179.3574 60 V 3.7140 8.0372 118.5956 66.0918 31.6411 178.2810 61 K 3.9247 8.1430 118.0212 59.4574 31.7068 179.2197 62 A 4.0651 8.1839 121.0792 55.0940 18.2892 179.1945 63 H 4.3675 8.3709 117.2743 59.2122 29.9688 177.6713 64 G 3.6087 8.3224 107.8693 47.7211 0.0000 175.6178 65 K 4.0470 7.9869 121.4941 58.9036 32.1634 178.9936 66 K 3.9972 7.7652 120.2584 59.3141 32.1417 179.0866 67 V 3.5990 7.8909 118.5191 66.2107 31.4979 178.1598 68 L 4.3296 8.1969 118.6127 57.4350 41.3597 179.5031 69 G 3.8049 8.1897 105.7075 47.8539 0.0000 175.3480 70 A 4.1471 8.0313 123.4102 54.5587 18.7330 179.2502 71 F 4.2752 8.5343 118.9321 61.6124 39.4314 176.9892 72 S 4.2446 9.1439 113.3680 62.0352 62.0468 176.1029 73 D 4.5391 8.4471 121.1700 56.9749 40.5447 178.8011 74 G 3.5319 8.0290 106.0897 46.9092 0.0000 175.0847 75 L 3.9930 7.2883 119.1694 55.7956 41.7679 177.7139 76 A 4.5348 7.4654 119.6828 52.0499 20.0752 176.3365 77 H 4.8226 7.9292 115.3865 54.8027 29.9551 175.1444 78 L 3.8749 8.1578 121.8399 57.3304 42.1298 176.6762 79 D 4.8643 7.5217 116.0227 54.0976 41.6976 176.3963 80 N 4.6764 7.7987 114.1521 52.1865 41.2690 175.0373 81 L 4.0191 7.5486 122.7439 57.2314 41.7938 178.6047 82 K 3.9516 8.1757 119.4860 59.8885 31.8544 178.9006 83 G 3.6276 8.0379 104.4560 48.0155 0.0000 175.4444 84 T 3.7999 7.3693 117.0284 65.4801 68.6519 175.9411 85 F 4.8015 8.0914 117.6047 57.0209 39.2211 177.2584 86 A 4.0465 7.5755 121.9373 56.0207 18.1777 180.5768 87 T 3.8616 7.8498 113.3219 66.6611 68.5871 176.6677 88 L 4.1134 7.9633 121.8981 57.9353 42.2833 178.8166 89 S 4.4808 8.5734 115.0297 60.9816 62.3680 176.0219 90 E 3.8925 8.2162 121.3419 59.1495 29.0949 178.9939 91 L 3.9039 7.9506 120.3735 58.6819 42.2026 178.8624 92 H 4.1453 8.2986 116.0403 59.2102 28.2044 176.9035 93 C 3.5591 7.6336 120.3708 62.1090 31.1166 175.3135 94 D 4.3947 8.5024 121.8821 56.2083 40.6254 177.4471 95 K 4.3223 7.5971 116.5683 57.6495 33.8204 177.3220 96 L 4.1684 7.9781 116.9865 55.0901 42.2027 176.3460 97 H 4.1788 7.2266 113.2318 56.6603 26.5764 175.0764 98 V 3.8224 7.7791 118.4684 61.1005 32.5273 174.8113 99 D 4.3938 8.6452 127.3199 53.4979 41.8206 175.0732 100 P 3.3153 0.0000 0.0000 64.8438 31.7698 177.9678 101 E 3.8829 8.2420 118.9104 59.1749 29.2769 178.4416 102 N 4.2876 7.9194 116.6335 56.1758 38.5761 177.2583 103 F 4.5036 7.5315 119.2903 60.6080 38.9765 177.9370 104 R 4.0138 7.8068 117.3534 58.9891 29.9837 178.7919 105 L 3.7388 7.7430 118.8591 57.5987 41.4776 179.2733 106 L 4.0406 8.1330 120.4094 58.0534 42.0486 178.9725 107 G 3.8765 8.0265 105.1861 47.9996 0.0000 175.3985 108 A 4.0643 7.9541 123.2777 54.7094 18.3326 179.8218 109 V 3.5517 7.9917 116.8374 66.0116 31.5417 177.6140 110 L 3.8450 8.7196 121.2890 58.5290 41.8553 179.1702 111 V 3.5475 7.9048 117.7092 66.3374 31.4046 177.7940 112 C 4.1934 7.9966 116.2064 62.5582 27.8677 176.2645 113 V 3.5754 7.9477 120.2384 65.9412 31.0585 178.0665 114 L 3.8296 7.8938 118.6973 57.6552 41.3860 179.4273 115 A 3.7256 7.3725 120.5978 55.1326 18.0777 179.0088 116 H 4.0724 7.9855 115.7660 59.8787 29.9917 176.9718 117 H 3.9519 8.1414 116.4981 58.3923 28.9559 177.0944 118 F 4.6303 8.5783 117.6867 55.3692 39.6143 178.3185 119 G 3.9045 8.7885 108.9109 45.7219 0.0000 175.0591 120 K 3.8731 9.3570 121.4376 59.7644 31.9137 177.2335 121 E 4.0442 8.2060 119.2620 58.4515 29.8534 177.2275 122 F 4.5210 8.0328 122.6209 57.0180 37.9291 175.3869 123 T 4.2104 7.3472 115.5047 59.9696 71.4620 173.5655 124 P 4.1285 0.0000 0.0000 65.7421 31.2181 177.1881 125 P 4.2145 0.0000 0.0000 65.4136 31.3205 178.9134 126 V 3.5908 7.4057 116.9454 65.7356 31.4072 177.8945 127 Q 3.5773 8.1939 119.4971 58.8643 28.7044 177.9216 128 A 3.9978 8.0938 121.6409 55.3665 18.4166 179.5521 129 A 3.9218 7.8089 119.1992 55.4775 18.3416 179.5262 130 Y 3.9093 8.0864 115.1838 61.0909 37.9208 178.4550 131 Q 4.1335 8.7805 119.7115 58.9229 28.7695 178.9310 132 K 4.0422 7.9282 119.7433 59.1595 31.9600 179.7392 133 V 3.4896 7.5440 118.1732 66.0842 31.4737 178.5306 134 V 3.7305 8.2802 112.3649 64.3359 31.3098 178.4235 135 A 4.0886 8.1720 120.6461 55.0606 18.2077 179.6796 136 G 3.6235 8.1435 104.2784 48.0578 0.0000 175.8642 137 V 3.3637 8.4348 121.2917 65.4861 31.6172 177.7922 138 A 3.9025 8.0746 120.4707 55.3344 18.0573 179.3926 139 N 4.2906 8.4141 114.7858 56.2819 38.3953 177.4610 140 A 4.0247 7.8820 121.1063 55.3797 18.6857 179.5697 141 L 3.9151 8.0691 117.2794 57.1016 41.5086 178.7290 142 A 4.4554 7.7579 118.8298 52.6311 18.9473 178.3216 143 H 4.1148 7.8694 117.3554 59.1870 29.8997 176.0537 144 K 4.3631 8.2466 115.3353 56.4480 32.0751 176.6256 145 Y 4.1750 7.9288 117.7435 58.4039 38.4115 175.7148 146 H 4.4587 8.3279 117.7796 56.1504 28.3117 173.2563 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 4.38 0.00 1.97 2.09 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.53 0.00 2 H 8.40 4.71 0.00 3.14 3.22 0.00 5.71 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 8.05 4.70 0.00 1.58 1.47 0.80 0.91 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 4 T 8.18 4.14 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 1.29 0.00 0.00 5 P 0.00 4.07 0.00 2.12 2.10 0.00 3.56 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.18 0.00 6 E 8.05 4.00 0.00 2.02 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 0.00 2.38 2.44 0.00 7 E 7.89 3.96 0.00 2.17 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 2.35 2.35 0.00 8 K 8.78 3.88 0.00 1.87 1.79 0.00 1.61 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.38 1.48 7.81 9 S 8.19 4.14 0.00 4.05 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 10 A 7.84 4.00 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 11 V 7.59 3.37 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 0.60 0.00 0.00 0.57 0.00 0.00 12 T 7.96 3.94 4.50 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 1.28 0.00 0.00 13 A 7.94 4.08 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 14 L 8.01 3.96 0.00 1.81 2.05 0.39 0.48 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 15 W 8.84 4.41 0.00 3.80 3.36 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 16 G 7.88 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 17 K 7.85 4.36 0.00 2.07 2.18 0.00 1.96 0.00 0.00 1.76 0.00 0.00 3.17 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.52 1.48 7.81 18 V 7.06 3.79 1.17 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 -0.10 0.00 0.00 0.71 0.00 0.00 19 N 8.17 4.55 0.00 2.70 2.60 0.00 0.00 6.83 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 20 V 8.04 3.50 2.09 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 1.21 0.00 0.00 0.90 0.00 0.00 21 D 8.07 4.32 0.00 3.01 2.68 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 22 E 8.57 3.92 0.00 1.94 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 2.29 2.43 0.00 23 V 7.95 3.59 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 0.96 0.00 0.00 0.64 0.00 0.00 24 G 8.42 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 25 G 7.79 3.60 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 26 E 8.21 3.90 0.00 2.27 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 2.29 2.32 0.00 27 A 8.14 3.91 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 28 L 7.84 3.99 0.00 1.77 1.63 0.89 0.89 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 29 G 8.04 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.20 3.90 0.00 1.89 1.95 0.00 3.10 0.00 0.00 3.03 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.71 0.00 31 L 7.92 3.99 0.00 1.91 1.92 0.96 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 32 L 7.85 4.04 0.00 1.88 1.70 0.81 0.77 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 33 V 7.08 3.71 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 0.73 0.00 0.00 0.91 0.00 0.00 34 V 7.90 3.50 1.49 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 -0.04 0.00 0.00 0.79 0.00 0.00 35 Y 7.09 3.78 0.00 2.44 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 36 P 0.00 4.55 0.00 2.35 2.35 0.00 3.73 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 1.94 0.00 37 W 8.08 4.42 0.00 3.57 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 T 7.74 4.28 4.42 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 1.05 0.00 0.00 39 Q 8.21 4.38 0.00 2.25 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.82 0.00 0.00 0.00 0.00 0.00 2.44 2.48 0.00 40 R 7.47 3.82 0.00 1.55 1.92 0.00 2.98 0.00 0.00 2.57 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 0.50 0.00 41 F 7.04 4.31 0.00 1.56 2.41 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 42 F 7.47 4.58 0.00 2.83 1.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 E 7.94 4.17 0.00 2.01 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 0.00 2.33 2.20 0.00 44 S 8.07 4.48 0.00 4.11 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 45 F 7.96 4.54 0.00 3.21 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 46 G 7.25 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 47 D 8.79 4.65 0.00 2.67 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 48 L 8.23 4.92 0.00 1.73 1.61 1.05 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 49 S 8.25 4.40 0.00 3.95 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 50 T 7.36 4.73 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 51 P 0.00 4.19 0.00 2.15 2.13 0.00 3.60 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.18 0.00 52 D 8.20 4.36 0.00 2.67 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 53 A 8.19 4.06 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 54 V 7.82 3.75 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 1.07 0.00 0.00 0.96 0.00 0.00 55 M 8.61 4.18 0.00 1.96 2.10 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.92 0.00 56 G 7.94 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 0.00 0.00 0.00 57 N 7.56 4.37 0.00 2.94 2.93 0.00 0.00 6.77 9.00 0.00 0.00 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 P 0.00 4.27 0.00 2.25 2.26 0.00 3.74 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.03 0.00 59 K 8.01 3.68 0.00 1.76 0.74 0.00 1.41 0.00 0.00 1.20 0.00 0.00 2.79 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.09 1.26 7.81 60 V 8.04 3.71 2.31 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 1.09 0.00 0.00 1.11 0.00 0.00 61 K 8.14 3.92 0.00 1.82 1.82 0.00 1.87 0.00 0.00 1.67 0.00 0.00 2.93 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.44 7.81 62 A 8.18 4.07 1.32 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 0.00 0.00 63 H 8.37 4.37 0.00 3.56 3.45 0.00 5.79 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 G 8.32 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 65 K 7.99 4.05 0.00 2.00 1.94 0.00 1.65 0.00 0.00 1.59 0.00 0.00 2.93 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.45 7.81 66 K 7.77 4.00 0.00 2.03 1.94 0.00 1.76 0.00 0.00 1.64 0.00 0.00 3.07 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.51 1.50 7.81 67 V 7.89 3.60 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 1.00 0.00 0.00 0.87 0.00 0.00 68 L 8.20 4.33 0.00 1.97 1.86 1.21 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 69 G 8.19 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 0.00 0.00 0.00 70 A 8.03 4.15 1.53 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 0.00 0.00 71 F 8.53 4.28 0.00 3.27 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 S 9.14 4.24 0.00 4.60 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 73 D 8.45 4.54 0.00 2.74 2.68 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 74 G 8.03 3.53 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 0.00 0.00 0.00 75 L 7.29 3.99 0.00 1.49 1.43 -0.37 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.47 4.53 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 77 H 7.93 4.82 0.00 3.04 3.14 0.00 5.83 0.00 0.00 0.00 0.00 7.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 8.16 3.87 0.00 1.47 1.61 0.72 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 79 D 7.52 4.86 0.00 2.64 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 80 N 7.80 4.68 0.00 2.69 2.59 0.00 0.00 7.22 7.49 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 81 L 7.55 4.02 0.00 1.77 1.88 0.88 0.87 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 82 K 8.18 3.95 0.00 1.81 1.76 0.00 1.51 0.00 0.00 1.75 0.00 0.00 2.95 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.26 1.33 7.81 83 G 8.04 3.63 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 0.00 0.00 0.00 84 T 7.37 3.80 3.52 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 0.48 0.00 0.00 85 F 8.09 4.80 0.00 3.18 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 86 A 7.58 4.05 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 87 T 7.85 3.86 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 88 L 7.96 4.11 0.00 1.90 1.98 1.05 1.08 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 89 S 8.57 4.48 0.00 4.06 4.07 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 90 E 8.22 3.89 0.00 2.06 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 2.33 2.55 0.00 91 L 7.95 3.90 0.00 1.84 1.87 0.91 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 92 H 8.30 4.15 0.00 3.62 3.81 0.00 5.86 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 C 7.63 3.56 0.00 1.62 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 94 D 8.50 4.39 0.00 2.72 2.68 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 95 K 7.60 4.32 0.00 1.83 1.78 0.00 1.60 0.00 0.00 1.69 0.00 0.00 3.04 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.33 1.46 7.81 96 L 7.98 4.17 0.00 1.71 1.64 0.72 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.23 4.18 0.00 3.47 3.44 0.00 5.64 0.00 0.00 0.00 0.00 8.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.78 3.82 2.09 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 0.13 0.00 0.00 0.55 0.00 0.00 99 D 8.65 4.39 0.00 2.80 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 0.00 100 P 0.00 3.32 0.00 1.93 1.84 0.00 3.37 0.00 0.00 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.46 0.00 101 E 8.24 3.88 0.00 2.03 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 2.31 2.39 0.00 102 N 7.92 4.29 0.00 2.52 2.68 0.00 0.00 6.90 7.43 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 0.00 103 F 7.53 4.50 0.00 3.10 2.91 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 0.00 104 R 7.81 4.01 0.00 2.01 1.96 0.00 3.28 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 1.73 1.75 0.00 105 L 7.74 3.74 0.00 1.69 1.29 0.69 -0.02 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 0.00 106 L 8.13 4.04 0.00 1.80 1.78 0.92 1.05 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 0.00 107 G 8.03 3.88 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 0.00 0.00 0.00 108 A 7.95 4.06 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 0.00 0.00 109 V 7.99 3.55 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 1.14 0.00 0.00 1.14 0.00 0.00 110 L 8.72 3.84 0.00 1.68 1.85 0.86 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 111 V 7.90 3.55 2.32 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 1.28 0.00 0.00 1.17 0.00 0.00 112 C 8.00 4.19 0.00 3.21 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 0.00 113 V 7.95 3.58 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 1.06 0.00 0.00 0.96 0.00 0.00 114 L 7.89 3.83 0.00 1.01 0.90 0.67 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 115 A 7.37 3.73 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 0.00 116 H 7.99 4.07 0.00 3.22 3.57 0.00 5.95 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 0.00 117 H 8.14 3.95 0.00 2.86 2.63 0.00 5.70 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 0.00 118 F 8.58 4.63 0.00 3.27 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 0.00 119 G 8.79 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 0.00 0.00 0.00 120 K 9.36 3.87 0.00 1.92 2.04 0.00 1.64 0.00 0.00 1.66 0.00 0.00 3.01 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.66 1.53 7.81 121 E 8.21 4.04 0.00 2.37 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 0.00 2.35 2.33 0.00 122 F 8.03 4.52 0.00 3.10 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 0.00 123 T 7.35 4.21 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 1.30 0.00 0.00 124 P 0.00 4.13 0.00 2.14 2.15 0.00 3.57 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.20 0.00 125 P 0.00 4.21 0.00 2.11 2.06 0.00 3.45 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.11 0.00 126 V 7.41 3.59 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 0.98 0.00 0.00 0.90 0.00 0.00 127 Q 8.19 3.58 0.00 1.52 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.54 0.00 0.00 0.00 0.00 0.00 2.39 2.52 0.00 128 A 8.09 4.00 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 0.00 129 A 7.81 3.92 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 0.00 130 Y 8.09 3.91 0.00 3.47 3.27 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 0.00 131 Q 8.78 4.13 0.00 2.23 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.81 0.00 0.00 0.00 0.00 0.00 2.77 2.61 0.00 132 K 7.93 4.04 0.00 1.91 1.83 0.00 1.62 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 3.30 0.00 0.00 0.00 0.00 1.46 1.61 7.81 133 V 7.54 3.49 2.09 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 0.82 0.00 0.00 0.75 0.00 0.00 134 V 8.28 3.73 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 0.99 0.00 0.00 1.10 0.00 0.00 135 A 8.17 4.09 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 0.00 136 G 8.14 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 0.00 137 V 8.43 3.36 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 0.72 0.00 0.00 0.68 0.00 0.00 138 A 8.07 3.90 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 0.00 0.00 139 N 8.41 4.29 0.00 2.96 2.88 0.00 0.00 6.93 7.26 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 0.00 140 A 7.88 4.02 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 L 8.07 3.92 0.00 1.31 0.70 -0.11 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.76 4.46 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 0.00 143 H 7.87 4.11 0.00 3.24 3.67 0.00 5.75 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 8.25 4.36 0.00 1.81 1.82 0.00 1.66 0.00 0.00 1.73 0.00 0.00 3.14 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.49 1.79 7.81 145 Y 7.93 4.18 0.00 3.10 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 0.00 146 H 8.33 4.46 0.00 3.22 3.23 0.00 5.75 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