NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 G 3.9159 8.3544 109.7448 44.5429 0.0000 173.4800 4 W 4.4984 8.0228 130.1028 54.1091 30.5895 172.1201 5 S 4.3117 8.7617 118.9827 55.5122 66.2319 173.3648 6 F 3.9319 8.0723 126.9993 60.7287 38.6926 177.7713 7 E 4.0453 8.1685 117.6328 59.5187 28.8782 178.9155 8 E 4.0234 8.0719 118.2272 59.7429 29.5048 179.5760 9 Q 4.1138 8.1553 117.8726 58.4976 28.7027 178.1937 10 F 3.9673 8.6014 122.3268 61.4610 39.4395 177.3884 11 K 3.9436 8.2787 117.8964 59.4468 31.5515 179.4752 12 Q 3.9487 7.4398 116.4048 59.2264 28.9885 178.9143 13 V 3.8396 8.1277 113.8250 64.1502 31.5123 178.4612 14 R 3.8907 8.3863 119.0857 59.7380 29.3097 178.5334 15 Q 4.0259 8.0895 117.5779 58.9322 28.3970 178.9323 16 L 3.9753 8.0000 119.9066 57.8431 41.7139 178.6696 17 Y 4.2098 7.7580 116.1665 60.7635 37.8005 177.6843 18 E 4.1510 8.5236 119.0001 59.2173 29.5540 178.9825 19 I 3.8146 6.7673 119.1134 63.4464 37.3890 175.1247 20 N 4.4328 6.9220 111.7128 52.7329 40.4401 174.7199 21 D 4.5756 8.5300 120.5100 53.2042 39.7353 177.1810 22 D 4.7640 7.5588 119.3456 51.4527 42.1164 174.0396 23 P 4.2592 0.0000 0.0000 65.5507 31.2393 178.0419 24 K 3.8619 7.9951 117.6047 59.4913 32.1318 178.5749 25 R 2.5100 9.5167 119.1904 58.6543 29.8302 178.3512 26 K 4.1319 7.7561 119.0460 59.7947 32.1908 178.4008 27 E 3.9400 7.9674 118.2813 59.6475 28.5799 179.1003 28 F 3.9810 7.7262 120.5732 61.0726 39.4445 176.9732 29 L 3.8725 8.0747 118.3278 57.8676 41.5548 179.4640 30 D 4.6837 8.9886 118.9495 57.6316 40.6156 178.4556 31 D 4.7046 8.8116 120.8685 56.6101 41.2346 177.8194 32 L 3.9547 8.8333 121.0438 58.3807 41.7889 179.0615 33 F 4.5354 7.5621 116.3908 60.4141 39.1971 177.7303 34 S 4.3593 8.1891 113.9139 61.5703 63.0430 176.2078 35 F 4.0389 9.8780 125.1558 61.0239 39.0285 176.8504 36 M 4.0779 8.8766 118.4944 58.4438 31.4782 178.3192 37 Q 3.9770 7.7289 118.6495 59.2657 29.2232 178.3210 38 K 3.9808 7.5760 119.4307 59.5163 32.2724 178.8108 39 R 3.9277 7.4159 117.0563 57.2489 30.1079 177.7844 40 G 3.9584 8.4900 106.0612 45.1891 0.0000 173.8784 41 T 4.4514 7.2705 109.9788 58.8805 68.3738 171.3046 42 P 4.5737 0.0000 0.0000 62.7297 32.7308 177.1810 43 I 4.1912 8.3586 121.9475 60.7734 36.4066 175.6356 44 N 4.7354 8.5971 122.9278 54.3281 39.0146 176.1927 45 R 4.4827 7.4402 117.0249 54.8227 33.6179 174.5481 46 L 4.1180 7.8156 124.1285 53.7005 42.5174 175.6236 47 P 4.2729 0.0000 0.0000 63.5249 32.2633 175.2502 48 I 4.8967 8.3158 124.0237 60.0715 40.0439 175.3193 49 M 4.5350 9.6433 124.3766 54.7711 35.4420 175.4589 50 A 3.9112 9.1889 127.4967 53.5677 15.9039 177.0277 51 K 3.9747 8.4506 114.3895 58.2997 29.6372 175.9496 52 S 4.7621 7.6578 111.2102 56.1863 66.1094 173.8434 53 V 3.5590 8.1446 114.8842 61.2014 31.9827 175.6959 54 L 4.2389 8.3246 125.7542 54.3613 42.6889 177.7865 55 D 4.5807 8.5116 125.9599 54.1943 39.3432 176.6539 56 L 4.0587 8.3337 125.4000 57.5079 41.7461 178.5079 57 Y 2.5870 7.6802 119.1220 60.3386 38.9483 177.1929 58 E 3.5044 7.8986 118.9563 59.0004 29.4742 178.9125 59 L 3.9384 7.8662 120.4113 58.8033 42.1659 177.7900 60 Y 4.2119 7.7354 119.3441 60.5863 38.4963 177.5222 61 N 4.0047 8.0353 116.7207 56.6410 38.6241 177.5181 62 L 3.7992 7.4117 118.9468 57.5771 41.9682 179.2541 63 V 3.3562 7.7492 118.4997 66.0873 31.3270 178.2274 64 I 3.4750 7.8739 119.4875 64.0265 36.6232 178.0946 65 A 3.4134 7.6867 121.0559 54.7845 18.1646 178.9003 66 R 4.2037 7.4287 113.7745 55.9324 30.4704 177.2606 67 G 3.7208 7.8228 108.2407 44.3462 0.0000 171.7098 68 G 3.4751 8.1394 104.1744 43.1028 0.0000 174.8233 69 L 3.4986 9.2939 127.7787 58.2768 41.8961 179.6508 70 V 3.6219 7.7357 117.3633 66.1751 31.4123 177.4186 71 D 4.3100 7.9013 118.2852 57.4099 40.6164 179.0993 72 V 3.2766 7.3556 118.0555 65.8034 31.2050 177.9666 73 I 4.1157 7.3411 117.8267 64.6980 37.1549 177.7242 74 N 4.4870 8.0988 116.0020 56.0899 38.5829 176.8999 75 K 4.2186 8.2359 116.8310 55.0764 33.8433 176.3629 76 K 4.0400 8.1338 118.3049 57.6918 29.7811 175.8934 77 L 4.4335 6.9197 115.2667 54.6987 42.0391 178.5367 78 W 4.1198 7.7927 122.1755 59.8643 28.9180 177.9315 79 Q 4.1179 8.3897 117.6092 59.4070 28.0298 179.1562 80 E 3.9483 8.0763 118.7531 59.2570 29.5609 179.3422 81 I 3.7751 7.5240 119.3614 64.3963 37.3569 178.2346 82 I 3.7226 9.2392 120.6739 64.7357 36.9229 178.7349 83 K 4.0952 8.4914 119.4503 59.2935 31.6889 179.5176 84 G 3.2723 8.5606 106.1311 47.5904 0.0000 174.6797 85 L 4.2841 7.6860 118.1210 54.0494 42.4172 176.0301 86 H 4.1023 8.7350 116.2110 56.7438 26.4124 175.2792 87 L 4.2661 7.6505 118.2424 53.7029 42.5732 175.8455 88 P 4.4704 0.0000 0.0000 62.4087 31.2839 177.3932 89 S 4.3568 8.6725 114.8128 59.7591 62.9349 176.1026 90 S 4.1725 7.9008 116.3826 60.6318 62.8727 174.1856 91 I 4.2344 6.9323 122.7221 59.7660 36.5851 175.5972 92 T 4.0977 8.4105 116.9152 63.9017 69.2520 175.7351 93 S 4.6879 7.7618 117.8667 58.6514 64.2728 176.2373 94 A 4.0476 8.0418 123.7597 54.9764 18.1871 179.1820 95 A 3.7113 7.8804 117.5699 55.2405 18.3821 179.3992 96 L 3.5124 7.5980 117.8002 58.5835 42.1689 179.0928 97 T 3.7822 8.3664 116.2411 66.5559 68.2827 176.6915 98 L 4.7032 8.3383 122.6189 57.2721 41.7529 179.5118 99 R 3.8201 7.8733 119.5725 59.6323 29.4774 178.4119 100 T 3.8532 8.2487 116.1664 66.7797 68.6509 176.5539 101 Q 4.2173 8.1104 119.2805 59.6051 28.8437 177.6249 102 Y 4.0684 8.6557 122.1583 60.6398 38.5760 177.9144 103 M 4.2290 8.1704 118.4701 58.6125 32.2109 178.7820 104 K 3.9350 7.3346 115.5342 59.5179 32.3105 178.8113 105 Y 4.4193 7.3580 115.1268 60.5967 38.5668 177.3328 106 L 4.5003 7.5345 116.9292 54.9719 41.9302 177.7820 107 Y 4.5330 8.1219 121.4677 60.2364 38.3309 176.2808 108 P 4.2137 0.0000 0.0000 65.6781 31.7697 177.7443 109 Y 3.6391 8.2532 117.8313 60.7036 38.4744 177.7930 110 E 4.2979 8.6362 120.1538 59.4860 29.7643 178.2746 111 C 4.0018 8.2708 118.9895 62.0312 31.4302 175.1511 112 E 3.9214 8.9747 120.7539 59.3062 29.4605 178.1414 113 K 4.1119 7.7884 116.3710 58.2022 32.2894 177.8796 114 K 4.3191 7.7221 117.9885 55.2614 33.7051 175.0615 115 N 4.2557 8.3729 116.6707 54.3524 37.6508 175.8625 116 L 4.1266 7.9659 117.9142 57.5782 42.3964 176.9509 117 S 4.5310 7.1828 107.3759 56.6224 65.1094 173.0953 118 T 4.9223 8.0689 107.9720 58.9139 72.1311 172.6746 119 P 4.1341 0.0000 0.0000 65.8918 31.3679 178.8327 120 A 4.4746 7.9971 118.9749 55.0794 18.2366 179.4489 121 E 3.8987 7.9360 116.3850 59.3637 29.5958 179.3017 122 L 3.9455 8.1160 120.3504 58.3474 42.2139 178.8470 123 Q 3.9514 9.3650 118.0109 59.0773 28.6139 178.9391 124 A 4.0135 8.5275 121.7084 55.1411 18.4041 179.5867 125 A 3.9954 8.3273 119.6686 55.1066 18.3227 180.0014 126 I 4.3764 8.1349 120.1489 64.2833 37.0258 178.1209 127 D 4.2202 8.3289 117.9785 57.3205 41.0864 178.1485 128 G 3.7653 8.2882 106.0903 47.3310 0.0000 174.6045 129 N 4.6303 8.1527 118.5153 53.6545 38.2075 175.9842 130 R 4.2311 8.0978 120.3577 55.6294 30.5329 176.7333 131 R 4.0489 8.3461 120.3395 56.1736 30.6420 177.7458 132 E 3.6925 8.9715 122.5105 57.2118 30.1075 176.8593 133 G 3.7519 7.1506 111.7995 46.5083 0.0000 172.1581 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 3 G 8.35 3.92 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 0.00 0.00 0.00 4 W 8.02 4.50 0.00 3.18 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 5 S 8.76 4.31 0.00 3.78 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 6 F 8.07 3.93 0.00 3.01 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 E 8.17 4.05 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 2.40 0.00 8 E 8.07 4.02 0.00 2.22 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 2.35 0.00 9 Q 8.16 4.11 0.00 2.25 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.83 0.00 0.00 0.00 0.00 0.00 2.56 2.69 0.00 10 F 8.60 3.97 0.00 3.24 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 11 K 8.28 3.94 0.00 1.93 1.91 0.00 1.78 0.00 0.00 1.72 0.00 0.00 3.01 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.63 1.82 7.81 12 Q 7.44 3.95 0.00 2.17 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 7.01 0.00 0.00 0.00 0.00 0.00 2.49 2.57 0.00 13 V 8.13 3.84 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 0.39 0.00 0.00 0.79 0.00 0.00 14 R 8.39 3.89 0.00 1.23 1.91 0.00 2.86 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 1.63 1.79 0.00 15 Q 8.09 4.03 0.00 2.35 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.61 0.00 0.00 0.00 0.00 0.00 2.54 2.56 0.00 16 L 8.00 3.98 0.00 1.63 1.41 1.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 17 Y 7.76 4.21 0.00 3.01 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 E 8.52 4.15 0.00 1.97 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 0.00 2.39 2.61 0.00 19 I 6.77 3.81 2.04 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 1.58 0.69 0.97 0.00 0.00 20 N 6.92 4.43 0.00 2.83 2.76 0.00 0.00 7.06 7.98 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 21 D 8.53 4.58 0.00 2.70 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 22 D 7.56 4.76 0.00 2.67 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 P 0.00 4.26 0.00 2.19 2.11 0.00 3.66 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.17 0.00 24 K 8.00 3.86 0.00 1.86 1.94 0.00 1.62 0.00 0.00 1.77 0.00 0.00 3.13 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.60 1.46 7.81 25 R 9.52 2.51 0.00 1.77 1.92 0.00 3.23 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.38 0.00 26 K 7.76 4.13 0.00 2.03 2.00 0.00 1.73 0.00 0.00 1.67 0.00 0.00 2.88 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.76 1.69 7.81 27 E 7.97 3.94 0.00 2.20 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 2.35 2.52 0.00 28 F 7.73 3.98 0.00 2.73 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 29 L 8.07 3.87 0.00 1.58 1.45 0.21 0.93 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 30 D 8.99 4.68 0.00 2.86 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 31 D 8.81 4.70 0.00 2.81 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 32 L 8.83 3.95 0.00 0.79 1.06 0.80 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 33 F 7.56 4.54 0.00 3.23 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 34 S 8.19 4.36 0.00 4.17 4.36 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 35 F 9.88 4.04 0.00 3.24 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 36 M 8.88 4.08 0.00 2.36 2.43 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.96 0.00 37 Q 7.73 3.98 0.00 2.17 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.99 0.00 0.00 0.00 0.00 0.00 2.46 2.59 0.00 38 K 7.58 3.98 0.00 1.60 1.49 0.00 1.69 0.00 0.00 1.53 0.00 0.00 2.13 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.13 1.31 7.81 39 R 7.42 3.93 0.00 1.90 1.94 0.00 2.90 0.00 0.00 2.85 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.59 0.00 40 G 8.49 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 0.00 0.00 0.00 41 T 7.27 4.45 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 1.20 0.00 0.00 42 P 0.00 4.57 0.00 2.28 2.17 0.00 3.72 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.94 0.00 43 I 8.36 4.19 2.12 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.76 0.79 0.00 0.00 44 N 8.60 4.74 0.00 2.61 2.79 0.00 0.00 6.64 7.07 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 45 R 7.44 4.48 0.00 1.74 1.81 0.00 3.30 0.00 0.00 3.27 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.74 0.00 46 L 7.82 4.12 0.00 1.63 1.59 1.05 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 47 P 0.00 4.27 0.00 2.05 2.00 0.00 3.38 0.00 0.00 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.93 0.00 48 I 8.32 4.90 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.65 0.93 0.00 0.00 49 M 9.64 4.54 0.00 2.03 1.92 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.48 0.00 50 A 9.19 3.91 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 51 K 8.45 3.97 0.00 1.93 1.91 0.00 1.70 0.00 0.00 1.76 0.00 0.00 3.03 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.35 1.41 7.81 52 S 7.66 4.76 0.00 3.98 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 53 V 8.14 3.56 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 0.84 0.00 0.00 0.93 0.00 0.00 54 L 8.32 4.24 0.00 1.64 1.59 0.95 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 55 D 8.51 4.58 0.00 2.79 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 56 L 8.33 4.06 0.00 1.77 1.83 0.81 0.74 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 57 Y 7.68 2.59 0.00 2.60 2.76 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 58 E 7.90 3.50 0.00 1.96 1.87 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 2.29 2.35 0.00 59 L 7.87 3.94 0.00 1.85 1.75 1.13 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 60 Y 7.74 4.21 0.00 3.03 2.58 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 0.00 0.00 0.00 0.00 61 N 8.04 4.00 0.00 2.38 2.65 0.00 0.00 6.63 6.10 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 62 L 7.41 3.80 0.00 1.64 1.58 0.84 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 63 V 7.75 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 0.41 0.00 0.00 0.61 0.00 0.00 64 I 7.87 3.47 1.59 0.00 0.00 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.16 0.78 0.00 0.00 65 A 7.69 3.41 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 66 R 7.43 4.20 0.00 1.62 1.78 0.00 3.09 0.00 0.00 3.02 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.51 0.00 67 G 7.82 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 68 G 8.14 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 0.00 0.00 0.00 69 L 9.29 3.50 0.00 1.76 1.70 0.17 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 70 V 7.74 3.62 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 1.01 0.00 0.00 0.97 0.00 0.00 71 D 7.90 4.31 0.00 2.77 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 72 V 7.36 3.28 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 -0.89 0.00 0.00 0.42 0.00 0.00 73 I 7.34 4.12 2.11 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.19 1.06 0.00 0.00 74 N 8.10 4.49 0.00 2.69 2.89 0.00 0.00 7.15 7.25 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 75 K 8.24 4.22 0.00 1.77 1.80 0.00 1.81 0.00 0.00 1.80 0.00 0.00 2.97 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.39 1.43 7.81 76 K 8.13 4.04 0.00 1.89 2.12 0.00 1.74 0.00 0.00 1.77 0.00 0.00 3.05 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.53 1.46 7.81 77 L 6.92 4.43 0.00 1.35 1.47 0.76 0.84 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 78 W 7.79 4.12 0.00 3.40 3.28 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 79 Q 8.39 4.12 0.00 2.16 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 7.11 0.00 0.00 0.00 0.00 0.00 2.49 2.60 0.00 80 E 8.08 3.95 0.00 2.09 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 2.36 2.35 0.00 81 I 7.52 3.78 2.11 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.56 0.99 0.00 0.00 82 I 9.24 3.72 1.95 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.40 0.94 0.00 0.00 83 K 8.49 4.10 0.00 1.78 1.83 0.00 1.71 0.00 0.00 1.66 0.00 0.00 2.98 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.62 1.60 7.81 84 G 8.56 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 0.00 0.00 0.00 85 L 7.69 4.28 0.00 1.77 1.73 0.95 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 86 H 8.74 4.10 0.00 3.24 3.42 0.00 5.65 0.00 0.00 0.00 0.00 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 L 7.65 4.27 0.00 1.82 1.62 1.00 0.92 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 88 P 0.00 4.47 0.00 2.22 2.18 0.00 3.72 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.96 0.00 89 S 8.67 4.36 0.00 4.03 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 0.00 90 S 7.90 4.17 0.00 4.03 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 91 I 6.93 4.23 1.87 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.60 0.93 0.00 0.00 92 T 8.41 4.10 4.23 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 1.20 0.00 0.00 93 S 7.76 4.69 0.00 3.85 3.84 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 94 A 8.04 4.05 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 95 A 7.88 3.71 1.07 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 96 L 7.60 3.51 0.00 1.62 1.69 0.81 0.75 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 97 T 8.37 3.78 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 98 L 8.34 4.70 0.00 1.67 2.09 1.12 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 99 R 7.87 3.82 0.00 0.67 1.46 0.00 2.96 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 1.58 1.78 0.00 100 T 8.25 3.85 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 1.20 0.00 0.00 101 Q 8.11 4.22 0.00 2.67 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.82 0.00 0.00 0.00 0.00 0.00 2.72 2.59 0.00 102 Y 8.66 4.07 0.00 3.54 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 M 8.17 4.23 0.00 1.99 2.39 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.94 2.60 0.00 104 K 7.33 3.93 0.00 0.79 1.28 0.00 1.39 0.00 0.00 1.50 0.00 0.00 3.15 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.29 1.52 7.81 105 Y 7.36 4.42 0.00 3.01 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 L 7.53 4.50 0.00 0.27 0.95 0.87 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 107 Y 8.12 4.53 0.00 3.31 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 P 0.00 4.21 0.00 2.48 2.18 0.00 3.93 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.28 0.00 109 Y 8.25 3.64 0.00 2.98 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 0.00 110 E 8.64 4.30 0.00 2.65 2.29 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 2.35 2.31 0.00 111 C 8.27 4.00 0.00 2.07 2.35 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 0.00 112 E 8.97 3.92 0.00 1.85 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 2.51 2.44 0.00 113 K 7.79 4.11 0.00 2.02 1.80 0.00 1.49 0.00 0.00 0.92 0.00 0.00 2.53 0.00 0.00 2.83 0.00 0.00 0.00 0.00 0.82 0.27 7.81 114 K 7.72 4.32 0.00 1.74 2.04 0.00 1.87 0.00 0.00 1.68 0.00 0.00 3.02 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.34 1.38 7.81 115 N 8.37 4.26 0.00 3.01 2.80 0.00 0.00 7.11 7.04 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 0.00 116 L 7.97 4.13 0.00 1.65 1.91 0.88 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 117 S 7.18 4.53 0.00 3.84 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 0.00 118 T 8.07 4.92 4.31 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 1.26 0.00 0.00 119 P 0.00 4.13 0.00 2.19 2.08 0.00 3.71 0.00 0.00 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.41 0.00 120 A 8.00 4.47 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 0.00 121 E 7.94 3.90 0.00 2.26 2.03 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 2.35 2.34 0.00 122 L 8.12 3.95 0.00 1.81 1.74 0.98 0.52 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 0.00 123 Q 9.37 3.95 0.00 2.14 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.50 0.00 0.00 0.00 0.00 0.00 2.44 2.48 0.00 124 A 8.53 4.01 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 0.00 125 A 8.33 4.00 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 0.00 126 I 8.13 4.38 1.98 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 1.38 1.02 0.89 0.00 0.00 127 D 8.33 4.22 0.00 2.61 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 0.00 128 G 8.29 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 N 8.15 4.63 0.00 2.98 3.10 0.00 0.00 6.93 6.94 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 0.00 130 R 8.10 4.23 0.00 1.80 1.89 0.00 3.14 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 1.64 1.77 0.00 131 R 8.35 4.05 0.00 1.90 2.01 0.00 3.16 0.00 0.00 3.25 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.67 0.00 132 E 8.97 3.69 0.00 1.92 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 2.29 2.30 0.00 133 G 7.15 3.75 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 0.00 0.00 0.00