NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 T 4.2207 8.1744 110.9372 61.5087 70.0116 173.0926 2 D 4.4362 8.4569 122.3318 52.0470 43.0788 173.6522 3 L 5.2815 8.5065 127.8670 54.0366 43.2569 177.9594 4 S 4.1443 8.5304 118.0800 61.5054 62.7781 176.3432 5 A 3.9940 7.9553 123.7934 55.1378 18.4175 179.3443 6 Q 4.0542 8.2061 116.0847 59.1300 28.7808 179.1745 7 K 3.9365 8.3901 119.5530 59.5391 31.9607 179.3456 8 R 3.9276 7.8593 118.4124 59.2925 29.9931 178.6378 9 L 4.0025 8.1735 118.6219 57.7211 41.7023 179.1606 10 A 4.0781 8.7860 120.8444 55.2229 18.3248 179.3803 11 A 3.9568 8.1107 119.1591 55.5657 18.3197 179.4270 12 D 4.3529 7.9816 116.7931 57.1530 41.0684 178.8772 13 V 3.6686 8.1020 119.5779 64.7421 31.6666 177.9552 14 L 4.1264 8.4297 117.6188 54.1635 42.6701 175.9609 15 D 4.3484 7.6421 117.8785 54.8803 39.7152 172.0424 16 V 4.5272 8.4460 117.3248 60.7920 35.7045 174.3857 17 G 3.7762 8.4048 111.7072 45.1268 0.0000 174.9034 18 K 3.8338 8.7725 121.9976 59.4460 32.2357 179.0110 19 N 4.4450 8.0758 114.4392 55.4365 38.7423 175.7970 20 R 4.3458 7.9913 116.4969 56.6124 30.9043 176.5013 21 V 4.2842 7.3955 112.2083 60.8550 32.3589 175.4269 22 W 4.7367 9.6720 135.0000 55.5127 33.4966 174.0041 23 F 5.3025 7.8897 125.0353 55.1738 40.9322 174.4306 24 N 3.1400 8.1503 123.2294 53.1269 38.9883 173.8987 25 P 4.1016 0.0000 0.0000 65.4052 31.5678 177.0381 26 E 4.3676 8.4212 115.4348 56.9390 29.7714 176.7542 27 R 4.6640 7.9450 119.1931 55.4571 31.5224 177.9059 28 Q 3.9676 8.3809 119.7775 59.0273 28.4440 178.4391 29 G 3.6094 7.8999 105.2645 47.9070 0.0000 175.0580 30 D 4.4562 7.8825 120.7981 57.2044 41.0322 178.8186 31 I 3.5266 7.9313 120.3115 63.9712 36.7134 178.2643 32 A 3.9612 8.0509 121.5948 55.2226 18.3055 178.9156 33 D 4.5651 7.5841 114.9807 54.6903 41.0882 176.6281 34 A 4.0746 7.4160 123.5982 52.3339 18.4601 176.9113 35 I 4.2939 8.7078 124.2365 61.8931 39.6044 176.8150 36 T 4.6203 7.6056 109.5297 59.7797 72.3064 175.4992 37 R 3.9505 8.3313 120.3079 59.3717 30.0631 178.9642 38 E 3.9275 8.1175 118.7545 59.3288 29.7852 178.3911 39 D 4.3644 8.2897 119.2405 57.1455 40.7403 179.0494 40 V 3.5058 7.7165 118.7530 66.2261 31.5806 178.1708 41 R 3.9580 8.2186 118.0545 59.3169 29.7715 178.7158 42 E 3.9063 8.1614 118.8901 59.4289 29.7363 178.9990 43 L 4.0406 7.8507 118.7626 57.4785 41.5311 179.7856 44 V 3.8956 8.0080 120.2387 65.7103 31.3472 177.8956 45 D 4.5999 8.2704 117.1766 56.6105 40.6632 177.5231 46 E 4.4605 7.7365 117.0137 55.4410 29.8088 177.0322 47 G 3.9731 8.3631 107.1854 45.8658 0.0000 174.8799 48 A 4.3305 8.1273 122.9869 53.8768 19.7354 177.8524 49 I 5.2752 7.9211 116.2130 59.9542 40.7631 175.0277 50 Q 4.8640 9.7911 124.5728 54.2965 33.9738 173.4943 51 A 5.1407 8.3869 121.3423 49.9871 20.8365 176.6161 52 K 4.1744 9.2086 124.8456 56.2543 33.3399 176.1342 53 D 4.6705 8.4263 123.8579 53.2394 41.8038 176.5807 54 K 4.2512 8.3858 122.8399 56.0129 33.7412 176.8741 55 K 4.4122 8.3857 121.3411 55.9064 34.1660 176.0226 56 G 4.1911 8.0450 107.1066 43.3857 0.0000 172.3810 57 N 4.4564 8.6498 120.4287 52.8391 39.1982 175.3755 58 S 4.2807 8.5703 119.2369 58.9376 63.6546 174.8083 59 R 4.6717 8.4834 122.1538 55.8804 30.5506 178.4511 60 G 3.6321 7.9281 107.5696 48.3053 0.0000 176.4654 61 R 3.9875 7.9993 120.5324 58.3236 30.0665 178.9997 62 A 3.9883 7.8258 120.3355 55.3058 18.5300 179.7138 63 R 3.9513 8.3717 117.0085 59.2816 30.0766 179.1896 64 E 3.9437 8.1054 118.1500 59.3457 29.4703 179.2513 65 R 3.8578 7.8198 118.2656 59.7579 30.1799 178.2821 66 Q 3.9965 8.5026 118.0796 59.1041 28.6832 179.6150 67 K 3.9525 8.0530 119.1635 59.3222 32.1118 179.3361 68 K 3.9172 7.9717 118.7202 59.9091 32.0658 179.6794 69 R 4.6310 8.4781 119.0865 58.6688 29.6823 179.0365 70 A 4.0532 7.7736 120.0910 54.5463 18.4752 178.8045 71 K 4.1218 7.8096 116.0939 57.1706 32.4963 177.5487 72 G 3.8979 7.9055 106.7075 46.1278 0.0000 173.0619 73 H 4.8045 8.4353 117.7456 54.6848 30.6428 174.3499 74 Q 3.6829 8.6129 115.9393 57.2239 25.6622 174.5147 75 K 4.6266 7.8924 112.1503 56.0116 33.9509 177.3098 76 G 3.8663 8.1363 107.9320 44.3921 0.0000 174.9610 77 A 3.9206 8.7698 121.5490 55.3335 18.1207 179.7302 78 G 3.8950 8.0408 101.8167 47.0593 0.0000 174.0652 79 S 4.6202 8.3999 114.9754 58.3654 64.1620 174.5708 80 R 4.3662 7.3855 118.6945 55.3018 30.7757 176.0513 81 K 4.3523 8.6421 121.2540 56.9936 34.4893 176.5930 82 G 3.9898 7.7394 105.8385 43.6753 0.0000 173.0472 83 K 4.1126 8.2367 120.2930 55.6118 33.2836 177.4929 84 A 4.1038 8.9204 125.4629 55.6312 17.9672 180.5361 85 G 3.6111 8.0738 101.4204 46.7365 0.0000 175.1932 86 A 4.2141 7.9675 122.9129 55.0792 18.6400 179.5850 87 R 4.2206 7.8850 115.3421 57.6350 30.1331 176.9103 88 Q 4.2450 8.0811 120.0014 53.1785 31.6376 173.1573 89 N 4.7948 8.8190 124.6430 53.4479 39.7550 175.1352 90 S 4.1525 8.7859 124.5506 61.5167 62.9395 176.4071 91 K 4.0300 8.1014 122.6770 59.3136 32.1465 178.2614 92 E 4.3206 8.8791 121.4142 58.7914 29.4340 178.3218 93 D 4.3255 8.4100 118.2663 57.1092 41.3165 178.0276 94 W 4.2061 8.3670 128.9468 60.4983 30.4906 177.8551 95 E 3.6824 8.3388 118.7669 59.0519 28.8594 179.1212 96 S 4.0518 7.8323 113.1000 61.4197 62.4825 176.3611 97 R 3.7852 7.9995 120.7098 59.4112 29.9135 179.1091 98 I 3.2190 7.3443 118.4323 63.6418 37.6045 178.1717 99 R 3.8318 7.6644 119.0525 58.8559 29.9162 178.6861 100 A 3.9371 7.8893 120.6390 55.3186 18.3741 179.7627 101 Q 3.9359 8.1538 116.6396 59.1291 28.7498 179.2225 102 R 4.0689 8.0030 119.2016 59.3489 30.0997 179.2260 103 T 3.9285 8.1793 115.9088 66.3299 68.4428 176.3604 104 K 3.8598 8.0776 121.5281 59.8404 32.2725 178.6248 105 L 4.1313 8.0302 118.9769 58.0004 41.3702 179.6541 106 R 3.9795 8.3014 118.6090 59.4216 29.9050 178.5297 107 E 3.9977 8.3133 118.4886 59.3486 29.6832 179.2453 108 L 3.9841 8.0625 118.8682 57.3360 41.5479 179.6721 109 R 4.0226 7.8141 118.5935 59.4427 29.8448 178.2195 110 D 4.2718 7.4758 117.3568 57.3005 40.9202 178.0628 111 E 4.0154 8.1699 119.0914 57.9162 29.5819 177.5945 112 G 4.0681 7.8333 105.9171 45.6663 0.0000 174.7955 113 T 3.9877 7.8342 115.1814 65.6477 68.6468 174.1861 114 L 4.8550 7.5738 119.9282 52.2391 44.8304 177.0236 115 S 4.5012 8.4386 117.8435 57.6543 65.5020 175.5351 116 S 4.1993 8.7075 118.7457 61.0103 62.4923 176.3481 117 S 4.3869 7.9435 117.5034 60.7321 63.4725 176.3000 118 Q 3.9845 7.9193 121.7744 58.8695 28.4640 177.4200 119 Y 4.1832 8.2466 120.7719 61.0067 38.7158 178.0772 120 R 3.7516 7.9517 119.3457 59.7481 29.9968 177.8392 121 D 4.3665 8.1358 117.4448 57.4095 41.1325 178.2478 122 L 4.2112 8.3515 119.9478 57.6839 41.6692 178.5801 123 Y 3.9155 8.6078 120.3050 60.9455 38.6191 177.9032 124 D 4.4529 8.3948 119.6979 57.5903 40.9634 179.2237 125 K 3.8868 7.9892 118.6117 59.0861 31.9989 179.3343 126 A 4.0491 8.5170 121.6577 55.2283 18.2097 180.0176 127 G 4.0415 7.9615 102.5819 47.1054 0.0000 175.0570 128 G 3.8925 7.5503 105.6946 43.8630 0.0000 173.4123 129 G 3.8863 8.4499 108.5128 46.7839 0.0000 175.0230 130 E 3.8585 7.6620 119.4692 56.7038 30.0971 177.2416 131 F 5.0413 7.1842 116.9868 55.4979 41.2964 175.3335 132 D 4.5334 9.1281 125.4415 57.0219 41.2301 176.2809 133 S 4.5457 7.5056 112.3835 56.2804 66.5988 175.9379 134 V 3.4539 8.1575 119.9167 66.0909 31.2166 177.1615 135 A 3.9510 8.0681 120.0507 55.6196 18.1686 178.9061 136 D 4.4045 7.9553 115.6523 57.2794 41.1082 178.3954 137 L 3.3127 7.7942 120.8271 58.0061 42.0051 178.5004 138 E 3.8977 8.5920 118.8282 59.5996 29.1909 179.6687 139 R 3.9196 8.1432 116.9813 59.6053 30.0461 178.1356 140 Y 4.2175 7.9894 119.0377 60.8143 38.4862 178.1811 141 I 3.7360 7.7571 120.1747 64.0292 37.6035 176.9993 142 D 4.5419 7.7892 118.9605 54.6517 41.2611 176.3615 143 A 3.8505 7.2350 126.3942 52.7406 19.3120 177.8373 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 T 8.17 4.22 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 1.19 0.00 0.00 2 D 8.46 4.44 0.00 2.68 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 3 L 8.51 5.28 0.00 1.91 1.80 0.92 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 4 S 8.53 4.14 0.00 4.07 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 5 A 7.96 3.99 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 6 Q 8.21 4.05 0.00 2.45 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.84 0.00 0.00 0.00 0.00 0.00 2.53 2.51 0.00 7 K 8.39 3.94 0.00 2.02 1.78 0.00 1.26 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.38 0.00 0.00 0.00 0.00 1.61 1.48 7.81 8 R 7.86 3.93 0.00 1.92 2.12 0.00 3.10 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.68 0.00 9 L 8.17 4.00 0.00 1.93 1.73 0.94 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 10 A 8.79 4.08 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 0.00 0.00 0.00 0.00 0.00 11 A 8.11 3.96 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 12 D 7.98 4.35 0.00 2.69 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 13 V 8.10 3.67 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 0.94 0.00 0.00 0.96 0.00 0.00 14 L 8.43 4.13 0.00 1.70 1.79 1.01 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 15 D 7.64 4.35 0.00 2.75 2.69 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 16 V 8.45 4.53 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 0.82 0.00 0.00 1.02 0.00 0.00 17 G 8.40 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 0.00 0.00 0.00 18 K 8.77 3.83 0.00 1.80 1.84 0.00 1.66 0.00 0.00 1.80 0.00 0.00 2.89 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.52 1.47 7.81 19 N 8.08 4.45 0.00 2.70 2.87 0.00 0.00 6.87 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 20 R 7.99 4.35 0.00 1.99 1.96 0.00 3.12 0.00 0.00 3.17 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.58 0.00 21 V 7.40 4.28 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 0.60 0.00 0.00 0.71 0.00 0.00 22 W 9.67 4.74 0.00 3.30 3.15 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 0.00 23 F 7.89 5.30 0.00 2.63 2.55 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 24 N 8.15 3.14 0.00 2.74 2.57 0.00 0.00 6.75 7.38 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 25 P 0.00 4.10 0.00 2.06 2.07 0.00 3.69 0.00 0.00 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.97 0.00 26 E 8.42 4.37 0.00 2.04 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 2.30 0.00 27 R 7.94 4.66 0.00 1.69 1.78 0.00 3.14 0.00 0.00 3.15 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.53 0.00 28 Q 8.38 3.97 0.00 2.04 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.90 0.00 0.00 0.00 0.00 0.00 2.39 2.56 0.00 29 G 7.90 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 30 D 7.88 4.46 0.00 2.75 2.66 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 0.00 0.00 0.00 0.00 31 I 7.93 3.53 1.54 0.00 0.00 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.86 0.11 0.00 0.00 32 A 8.05 3.96 1.34 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 33 D 7.58 4.57 0.00 2.72 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 34 A 7.42 4.07 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 35 I 8.71 4.29 1.86 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 1.57 0.96 0.90 0.00 0.00 36 T 7.61 4.62 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 37 R 8.33 3.95 0.00 1.88 2.03 0.00 3.14 0.00 0.00 3.27 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.70 0.00 38 E 8.12 3.93 0.00 2.08 1.94 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 2.38 2.46 0.00 39 D 8.29 4.36 0.00 2.91 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 V 7.72 3.51 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 1.16 0.00 0.00 1.01 0.00 0.00 41 R 8.22 3.96 0.00 1.89 2.00 0.00 3.19 0.00 0.00 3.11 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.93 0.00 42 E 8.16 3.91 0.00 2.20 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 0.00 2.48 2.35 0.00 43 L 7.85 4.04 0.00 1.87 1.65 0.78 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 44 V 8.01 3.90 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 1.25 0.00 0.00 1.03 0.00 0.00 45 D 8.27 4.60 0.00 2.84 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 46 E 7.74 4.46 0.00 2.07 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 2.31 2.41 0.00 47 G 8.36 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 48 A 8.13 4.33 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 49 I 7.92 5.28 1.99 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.21 1.27 0.00 0.00 50 Q 9.79 4.86 0.00 2.07 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.76 0.00 0.00 0.00 0.00 0.00 2.39 2.71 0.00 51 A 8.39 5.14 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 K 9.21 4.17 0.00 1.94 1.72 0.00 1.66 0.00 0.00 1.69 0.00 0.00 3.06 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.44 1.42 7.81 53 D 8.43 4.67 0.00 2.68 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 54 K 8.39 4.25 0.00 1.86 1.80 0.00 1.56 0.00 0.00 1.76 0.00 0.00 3.04 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.38 1.42 7.81 55 K 8.39 4.41 0.00 1.88 1.85 0.00 1.51 0.00 0.00 1.71 0.00 0.00 3.14 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.37 1.42 7.81 56 G 8.05 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 57 N 8.65 4.46 0.00 2.70 2.77 0.00 0.00 7.02 7.57 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 58 S 8.57 4.28 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 59 R 8.48 4.67 0.00 1.82 1.89 0.00 3.13 0.00 0.00 3.34 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.65 0.00 60 G 7.93 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 61 R 8.00 3.99 0.00 1.87 1.99 0.00 3.13 0.00 0.00 3.34 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.70 0.00 62 A 7.83 3.99 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 63 R 8.37 3.95 0.00 1.99 1.99 0.00 3.13 0.00 0.00 3.17 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.85 0.00 64 E 8.11 3.94 0.00 2.20 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 2.33 2.45 0.00 65 R 7.82 3.86 0.00 1.92 2.13 0.00 3.12 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.89 0.00 66 Q 8.50 4.00 0.00 2.27 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.60 0.00 0.00 0.00 0.00 0.00 2.39 2.54 0.00 67 K 8.05 3.95 0.00 2.04 1.85 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.66 7.81 68 K 7.97 3.92 0.00 1.94 1.92 0.00 1.73 0.00 0.00 1.68 0.00 0.00 2.94 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.66 1.66 7.81 69 R 8.48 4.63 0.00 1.85 1.98 0.00 3.14 0.00 0.00 3.27 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.65 0.00 70 A 7.77 4.05 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 71 K 7.81 4.12 0.00 1.72 2.09 0.00 1.60 0.00 0.00 1.68 0.00 0.00 3.13 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.34 1.21 7.81 72 G 7.91 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 73 H 8.44 4.80 0.00 3.26 3.20 0.00 5.78 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 Q 8.61 3.68 0.00 2.21 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 7.52 0.00 0.00 0.00 0.00 0.00 2.28 2.39 0.00 75 K 7.89 4.63 0.00 1.69 1.74 0.00 1.75 0.00 0.00 1.71 0.00 0.00 3.10 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.34 1.63 7.81 76 G 8.14 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 A 8.77 3.92 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 78 G 8.04 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 79 S 8.40 4.62 0.00 3.94 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 80 R 7.39 4.37 0.00 1.85 1.85 0.00 3.10 0.00 0.00 3.15 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.74 0.00 81 K 8.64 4.35 0.00 1.64 1.77 0.00 1.65 0.00 0.00 1.71 0.00 0.00 3.10 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.30 1.45 7.81 82 G 7.74 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 83 K 8.24 4.11 0.00 1.84 1.69 0.00 1.63 0.00 0.00 1.82 0.00 0.00 2.97 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.50 1.50 7.81 84 A 8.92 4.10 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 85 G 8.07 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 86 A 7.97 4.21 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 87 R 7.89 4.22 0.00 1.93 2.01 0.00 3.27 0.00 0.00 3.15 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.81 0.00 88 Q 8.08 4.24 0.00 2.03 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.90 6.98 0.00 0.00 0.00 0.00 0.00 2.27 2.30 0.00 89 N 8.82 4.79 0.00 2.81 2.72 0.00 0.00 6.90 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 S 8.79 4.15 0.00 4.11 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 91 K 8.10 4.03 0.00 1.84 2.02 0.00 1.80 0.00 0.00 1.96 0.00 0.00 2.94 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.59 1.46 7.81 92 E 8.88 4.32 0.00 2.29 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 2.32 2.20 0.00 93 D 8.41 4.33 0.00 2.96 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 94 W 8.37 4.21 0.00 3.49 3.32 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 95 E 8.34 3.68 0.00 2.19 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 2.43 2.77 0.00 96 S 7.83 4.05 0.00 3.99 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 97 R 8.00 3.79 0.00 1.76 1.87 0.00 3.30 0.00 0.00 3.12 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.76 0.00 98 I 7.34 3.22 0.56 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 0.51 0.68 0.35 0.00 0.00 99 R 7.66 3.83 0.00 2.05 1.89 0.00 3.20 0.00 0.00 3.13 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.57 0.00 100 A 7.89 3.94 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 0.00 101 Q 8.15 3.94 0.00 1.99 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.76 0.00 0.00 0.00 0.00 0.00 2.35 2.46 0.00 102 R 8.00 4.07 0.00 2.03 2.11 0.00 3.01 0.00 0.00 3.20 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.55 0.00 103 T 8.18 3.93 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 1.22 0.00 0.00 104 K 8.08 3.86 0.00 1.98 2.00 0.00 1.53 0.00 0.00 1.64 0.00 0.00 3.20 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.41 1.53 7.81 105 L 8.03 4.13 0.00 2.13 2.02 0.92 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 106 R 8.30 3.98 0.00 2.19 2.14 0.00 3.11 0.00 0.00 3.18 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 107 E 8.31 4.00 0.00 2.18 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 2.33 2.69 0.00 108 L 8.06 3.98 0.00 1.76 1.75 0.93 0.72 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 0.00 109 R 7.81 4.02 0.00 1.70 1.74 0.00 2.63 0.00 0.00 2.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.44 0.00 110 D 7.48 4.27 0.00 2.63 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 E 8.17 4.02 0.00 2.01 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 0.00 2.32 2.33 0.00 112 G 7.83 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 0.00 0.00 0.00 113 T 7.83 3.99 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 1.22 0.00 0.00 114 L 7.57 4.86 0.00 1.69 1.63 1.04 0.77 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 0.00 115 S 8.44 4.50 0.00 4.06 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 0.00 116 S 8.71 4.20 0.00 4.08 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 0.00 117 S 7.94 4.39 0.00 4.11 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 0.00 118 Q 7.92 3.98 0.00 2.16 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.76 0.00 0.00 0.00 0.00 0.00 2.42 2.41 0.00 119 Y 8.25 4.18 0.00 3.07 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 0.00 120 R 7.95 3.75 0.00 2.23 2.17 0.00 3.23 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.74 0.00 121 D 8.14 4.37 0.00 2.95 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 0.00 122 L 8.35 4.21 0.00 1.88 1.74 0.99 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 123 Y 8.61 3.92 0.00 2.38 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 0.00 124 D 8.39 4.45 0.00 2.91 2.75 0.00 0.00 0.00 0.00 0.00 0.00 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 7.99 3.89 0.00 1.96 1.46 0.00 1.77 0.00 0.00 1.53 0.00 0.00 2.99 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.37 1.63 7.81 126 A 8.52 4.05 1.50 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 0.00 127 G 7.96 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 0.00 128 G 7.55 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 0.00 129 G 8.45 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 0.00 130 E 7.66 3.86 0.00 1.16 1.12 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 2.11 2.01 0.00 131 F 7.18 5.04 0.00 3.18 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 0.00 132 D 9.13 4.53 0.00 2.72 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 0.00 133 S 7.51 4.55 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 0.00 134 V 8.16 3.45 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 1.04 0.00 0.00 0.90 0.00 0.00 135 A 8.07 3.95 1.34 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 0.00 136 D 7.96 4.40 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 0.00 137 L 7.79 3.31 0.00 1.42 1.70 -0.40 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 138 E 8.59 3.90 0.00 2.15 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 2.31 2.47 0.00 139 R 8.14 3.92 0.00 1.96 2.04 0.00 3.20 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.82 0.00 140 Y 7.99 4.22 0.00 3.20 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 0.00 141 I 7.76 3.74 2.06 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.82 0.89 0.00 0.00 142 D 7.79 4.54 0.00 2.56 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 0.00 143 A 7.23 3.85 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