NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4302 8.3049 120.3222 54.5500 34.6067 174.9650 2 L 4.4121 7.3339 121.1489 52.1469 43.3572 176.1012 3 T 4.1019 9.1729 114.9965 61.2192 71.6877 175.1141 4 A 3.9294 8.5189 123.2739 55.5954 18.2419 179.5876 5 E 3.8778 8.1134 117.0225 59.5406 29.7557 178.7898 6 E 3.9411 8.1340 118.6966 59.0957 29.5051 179.1932 7 K 3.8767 8.3440 119.8521 59.2410 32.1697 178.8808 8 A 3.9635 8.2040 120.9931 54.9161 18.3467 179.2555 9 A 3.9823 8.1137 119.4436 55.4990 18.3979 179.9975 10 V 3.5905 7.8002 116.4867 66.5259 31.4637 178.4255 11 T 3.9842 8.1673 115.2352 66.5377 68.0662 176.6664 12 A 4.0386 8.3518 122.8907 55.0641 18.3616 179.3995 13 F 4.1695 8.4991 119.1690 61.4013 39.3657 177.1517 14 W 4.3072 8.9142 127.0670 60.2878 30.5317 177.5447 15 G 3.8969 8.2778 105.5067 47.8175 0.0000 175.2492 16 K 4.0269 7.3418 119.5950 58.0390 33.3948 178.1825 17 V 3.2233 6.1741 112.2352 60.4618 31.8325 176.0378 18 K 4.1322 8.2960 123.3222 56.1132 32.0447 176.9048 19 V 4.4115 7.9472 116.7698 60.9707 32.2334 177.3181 20 D 4.5420 8.1454 119.7471 55.0160 39.8466 176.4656 21 E 4.5042 7.8556 118.4238 56.2915 30.9051 177.8379 22 V 3.6571 7.8342 119.8403 65.8051 31.5303 178.0582 23 G 3.7088 8.1343 105.1781 47.8870 0.0000 175.7881 24 G 3.6168 8.0225 108.0661 47.2917 0.0000 175.2883 25 E 3.9101 8.1206 121.0184 58.8843 29.5646 178.7888 26 A 3.9275 8.1970 121.0749 55.0555 18.6126 179.3423 27 L 3.9226 8.0807 119.0438 58.0915 42.1387 179.3130 28 G 3.5811 8.0536 105.5675 47.9742 0.0000 175.7631 29 R 3.8489 8.2290 121.5366 58.5985 29.9966 178.6025 30 L 4.0774 8.1085 120.3757 58.6559 41.9420 179.2590 31 L 4.1598 7.7365 119.2346 56.5992 41.2581 179.7197 32 V 3.5151 7.4302 117.9038 65.9148 31.6762 177.9846 33 V 3.5952 7.8151 116.9197 64.1503 32.6710 175.4624 34 Y 4.2344 7.5544 116.7492 54.6565 37.8773 174.1341 35 P 4.7409 0.0000 0.0000 63.5944 31.8531 177.5448 36 W 4.3871 8.4318 116.0761 59.6975 27.7108 177.9940 37 T 4.3290 7.4684 110.2648 64.3288 68.0282 176.3408 38 Q 4.1611 8.2165 121.5379 58.8475 28.3981 178.2448 39 R 3.7547 7.8036 119.2781 59.6920 30.0255 177.9174 40 F 4.2288 7.6911 114.9108 58.4074 39.2567 175.7408 41 F 4.4834 8.0330 118.5530 56.5710 39.5597 177.0052 42 E 3.9592 8.4323 124.2337 59.3240 29.5585 178.4133 43 S 4.4325 8.0162 111.2208 60.0693 63.2589 174.7053 44 F 4.6495 8.3976 119.6409 58.6109 40.1036 175.7806 45 G 3.9955 7.4926 106.2520 44.3074 0.0000 176.3089 46 D 4.5428 8.6975 128.9131 53.8207 40.5030 175.0278 47 L 4.8462 8.3758 126.5566 54.5329 42.6390 178.0048 48 S 4.3951 8.6305 115.5650 60.1567 63.6406 174.5696 49 T 4.7020 7.4432 110.5379 58.6527 72.9913 174.0655 50 A 3.9494 8.6031 123.8993 55.8307 18.3356 179.8375 51 D 4.2676 8.1140 116.2810 57.3991 40.6971 178.7674 52 A 3.9682 7.8314 120.0349 55.1197 18.8232 179.3852 53 V 3.6967 8.0768 117.0912 66.7386 31.3821 178.2691 54 M 4.1281 8.0094 116.7578 57.8003 31.8677 177.5329 55 N 4.8180 7.8533 113.8479 51.8996 39.4627 174.6158 56 N 4.4388 7.5307 121.1903 52.8137 39.4515 174.0421 57 P 4.2948 0.0000 0.0000 65.4040 31.3320 178.8529 58 K 3.6830 8.0244 117.4233 58.9918 31.7655 179.5096 59 V 3.7279 7.8464 118.1445 65.9578 31.5269 178.0377 60 K 3.9215 7.8990 117.5135 59.4397 31.7817 179.2425 61 A 3.9555 8.0838 121.0450 55.3654 18.3285 179.2142 62 H 4.3105 8.5588 117.1965 59.3646 29.9823 177.5358 63 G 3.7189 8.5565 108.0531 47.7702 0.0000 175.1963 64 K 3.8985 8.0585 121.9020 59.4794 32.1477 178.9562 65 K 4.0121 7.7780 118.6590 59.3506 31.8656 179.5199 66 V 3.6558 7.8932 118.5379 66.0225 31.4247 177.8759 67 L 4.1690 8.2335 120.1495 58.2416 41.8489 178.4135 68 D 4.4951 8.5269 119.1797 57.6443 40.8164 178.9087 69 S 4.1392 8.4016 113.4176 61.3360 62.3921 175.8265 70 F 4.2758 8.6967 123.6647 61.6733 38.9151 177.3025 71 S 4.1149 9.0127 114.0520 61.3890 62.9565 175.6677 72 N 4.5114 8.5802 120.2563 56.8032 38.6113 176.8315 73 G 3.7760 8.0406 106.8027 48.4187 0.0000 175.4052 74 M 3.7622 7.5131 119.7933 57.4467 31.9420 178.1497 75 K 4.2384 7.6512 116.1384 56.8962 33.5741 176.3145 76 H 4.9529 8.0873 117.0415 54.8507 29.5486 175.0992 77 L 3.9794 7.8182 119.5880 57.3582 42.0868 178.9065 78 D 4.4941 7.9459 116.7653 55.2892 40.3949 175.9484 79 D 4.7705 8.2061 120.9194 52.0884 41.6556 176.2969 80 L 4.1583 7.9920 122.1433 57.7635 41.8510 179.0236 81 K 3.9939 8.0887 118.5128 59.6068 32.1555 178.6285 82 G 3.6692 8.3199 105.9058 47.9819 0.0000 175.8216 83 T 3.7275 7.7344 117.1980 65.7070 68.7306 175.8442 84 F 4.6536 7.8459 116.7910 56.9853 39.3825 177.3469 85 A 3.9686 7.5717 121.7780 55.3319 18.1864 180.2703 86 A 3.9351 7.8746 118.5235 55.4457 18.6107 179.7668 87 L 4.0948 7.9512 116.9624 57.7100 41.6184 179.6384 88 S 4.2233 8.6155 115.1129 60.7338 62.3189 175.6237 89 E 3.9545 8.0986 121.8306 59.2778 29.3187 178.3606 90 L 3.9463 7.9803 120.1277 58.7859 42.0653 178.8041 91 H 4.2104 8.5195 115.9972 58.9982 28.5122 177.3988 92 C 4.3468 8.5107 118.7191 62.7920 28.0749 175.9249 93 D 4.4418 8.4476 120.0460 56.7868 40.8537 177.8669 94 K 4.2493 8.0164 116.5023 57.6793 33.1413 177.3848 95 L 4.2829 8.0070 116.5348 54.5857 42.2463 176.0941 96 H 4.2693 7.4754 114.8942 56.6612 26.6334 175.1194 97 V 3.8668 8.0020 119.2440 61.4697 32.0828 174.9998 98 D 4.1851 8.7053 127.4302 53.5135 41.7432 175.1950 99 P 3.1566 0.0000 0.0000 64.9870 31.6440 177.8127 100 E 3.8593 8.3263 120.0062 59.4652 29.2371 178.5108 101 N 4.3365 8.1122 116.4396 55.8961 38.4822 177.3303 102 F 4.4250 7.3773 119.5814 60.4451 38.9239 177.7906 103 K 4.0232 8.0199 117.7079 59.3487 31.8724 179.1347 104 L 3.8449 7.7550 119.2668 57.7534 41.4247 179.4416 105 L 4.0411 8.1769 120.4280 58.0017 42.0514 179.0509 106 G 3.6875 8.1491 105.7591 48.0522 0.0000 175.4265 107 N 4.4464 8.2747 118.8291 55.8676 38.5677 177.6057 108 V 3.6000 8.1138 120.0422 65.9682 31.5010 177.6303 109 L 3.8580 8.1995 120.3112 58.2908 41.7941 179.1403 110 V 3.6057 7.8580 117.9503 65.9957 31.3912 178.0160 111 V 3.6009 8.0695 118.2015 66.0792 31.3147 178.1574 112 V 3.4607 8.1442 118.2584 65.9205 31.4758 177.9251 113 L 3.8680 8.0091 118.7467 57.6606 41.4074 179.4134 114 A 3.9142 7.9180 121.0000 55.0982 18.1225 179.6684 115 R 3.8707 7.7658 116.3501 59.6539 30.2253 178.2035 116 N 4.1693 7.8006 115.1553 54.7455 38.5062 176.4107 117 F 5.1528 7.4704 115.6680 57.3392 40.8233 177.6020 118 G 3.7821 8.2903 107.4118 46.2978 0.0000 176.1542 119 K 4.1656 8.7875 118.9288 59.4378 33.0000 178.5557 120 E 4.1287 8.3483 118.5027 58.9666 29.8306 177.3862 121 F 4.2897 8.0343 122.9512 56.8770 37.8891 175.3531 122 T 4.1347 7.2492 115.7086 60.2044 71.3199 173.4507 123 P 4.1347 0.0000 0.0000 65.8428 31.2735 179.0852 124 V 3.5112 7.6016 116.2823 65.8836 31.4776 177.7192 125 L 3.8395 7.8305 120.0764 58.0687 41.8680 178.5094 126 Q 3.3222 7.8603 119.6419 59.0059 28.9649 178.2950 127 A 4.0048 7.9999 121.6483 55.0939 18.4604 179.2298 128 D 4.2396 7.9993 117.3852 57.7543 40.8663 179.1542 129 F 3.9746 8.4223 118.1340 60.5777 38.8323 177.6628 130 Q 4.0909 8.6125 118.2040 58.9718 28.4271 179.1376 131 K 3.9476 7.9587 118.9849 59.3161 31.9891 179.5759 132 V 3.4751 7.5469 118.1996 66.2447 31.4862 178.6252 133 V 3.7274 8.3075 112.2120 64.2539 31.2616 178.4970 134 A 4.1026 8.3853 121.0408 54.8986 18.1919 179.9650 135 G 3.4564 8.2923 104.4427 47.9223 0.0000 176.0332 136 V 3.1397 7.9292 121.1784 65.4854 31.4433 177.9921 137 A 3.8050 8.0522 120.4938 55.0418 17.9907 179.1062 138 N 4.2728 8.1536 114.5863 56.7807 38.9284 176.6752 139 A 4.1564 8.0497 122.2138 55.1645 18.3638 179.6659 140 L 3.7549 7.7548 117.3428 57.5334 41.4590 179.2632 141 A 4.3966 8.0729 120.0671 54.1254 18.2855 178.6775 142 H 3.9266 7.8027 116.8373 59.6490 29.8477 176.8811 143 R 4.2094 8.0685 114.8777 57.7102 29.8888 176.7167 144 Y 4.2406 8.5234 119.6565 58.9404 39.3285 174.8467 145 H 4.6216 8.1490 121.4541 55.7879 29.0349 174.0963 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 4.43 0.00 1.99 2.05 0.00 0.00 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.55 0.00 2 L 7.33 4.41 0.00 1.65 1.62 0.76 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 3 T 9.17 4.10 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 4 A 8.52 3.93 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 5 E 8.11 3.88 0.00 2.03 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 2.37 2.40 0.00 6 E 8.13 3.94 0.00 2.25 1.90 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 2.45 2.28 0.00 7 K 8.34 3.88 0.00 1.88 1.87 0.00 1.60 0.00 0.00 1.60 0.00 0.00 2.89 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.38 1.38 7.81 8 A 8.20 3.96 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 A 8.11 3.98 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 10 V 7.80 3.59 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 0.84 0.00 0.00 0.09 0.00 0.00 11 T 8.17 3.98 4.44 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 1.26 0.00 0.00 12 A 8.35 4.04 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 F 8.50 4.17 0.00 3.48 3.67 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 14 W 8.91 4.31 0.00 3.77 3.23 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 15 G 8.28 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 16 K 7.34 4.03 0.00 1.77 1.85 0.00 1.60 0.00 0.00 1.74 0.00 0.00 2.97 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.50 1.10 7.81 17 V 6.17 3.22 0.68 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 -1.14 0.00 0.00 -0.06 0.00 0.00 18 K 8.30 4.13 0.00 1.74 1.74 0.00 1.64 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.39 1.45 7.81 19 V 7.95 4.41 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 0.29 0.00 0.00 0.56 0.00 0.00 20 D 8.15 4.54 0.00 2.74 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 21 E 7.86 4.50 0.00 1.97 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 2.27 2.22 0.00 22 V 7.83 3.66 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 1.16 0.00 0.00 0.93 0.00 0.00 23 G 8.13 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 24 G 8.02 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 25 E 8.12 3.91 0.00 2.03 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 2.24 2.26 0.00 26 A 8.20 3.93 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 27 L 8.08 3.92 0.00 1.90 1.61 0.82 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 28 G 8.05 3.58 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 0.00 0.00 0.00 29 R 8.23 3.85 0.00 2.01 1.95 0.00 3.11 0.00 0.00 3.05 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.67 0.00 30 L 8.11 4.08 0.00 1.87 1.88 0.87 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 31 L 7.74 4.16 0.00 1.71 1.66 0.71 0.34 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 32 V 7.43 3.52 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 0.72 0.00 0.00 0.90 0.00 0.00 33 V 7.82 3.60 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 0.79 0.00 0.00 34 Y 7.55 4.23 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 35 P 0.00 4.74 0.00 2.22 2.09 0.00 4.02 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.13 0.00 36 W 8.43 4.39 0.00 3.60 3.54 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 37 T 7.47 4.33 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 38 Q 8.22 4.16 0.00 2.33 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.74 0.00 0.00 0.00 0.00 0.00 2.41 2.44 0.00 39 R 7.80 3.75 0.00 1.79 1.42 0.00 3.14 0.00 0.00 2.93 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.55 0.00 40 F 7.69 4.23 0.00 2.54 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 8.03 4.48 0.00 2.82 2.24 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 42 E 8.43 3.96 0.00 1.98 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 2.41 2.33 0.00 43 S 8.02 4.43 0.00 4.17 4.08 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 44 F 8.40 4.65 0.00 3.16 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 45 G 7.49 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 46 D 8.70 4.54 0.00 2.67 2.64 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.38 4.85 0.00 1.66 1.63 1.05 1.04 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 48 S 8.63 4.40 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 49 T 7.44 4.70 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 1.21 0.00 0.00 50 A 8.60 3.95 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 51 D 8.11 4.27 0.00 2.69 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 52 A 7.83 3.97 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.08 3.70 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 1.04 0.00 0.00 1.00 0.00 0.00 54 M 8.01 4.13 0.00 2.00 2.08 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.91 0.00 55 N 7.85 4.82 0.00 2.78 2.83 0.00 0.00 6.98 7.27 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 56 N 7.53 4.44 0.00 3.00 2.84 0.00 0.00 7.18 7.42 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 57 P 0.00 4.29 0.00 2.14 2.04 0.00 3.61 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.14 0.00 58 K 8.02 3.68 0.00 1.70 0.74 0.00 1.68 0.00 0.00 1.23 0.00 0.00 2.76 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.09 1.23 7.81 59 V 7.85 3.73 2.24 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 1.07 0.00 0.00 1.06 0.00 0.00 60 K 7.90 3.92 0.00 1.99 1.82 0.00 1.69 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.43 1.43 7.81 61 A 8.08 3.96 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 H 8.56 4.31 0.00 3.51 3.62 0.00 5.80 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 63 G 8.56 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 64 K 8.06 3.90 0.00 1.87 2.05 0.00 1.65 0.00 0.00 1.66 0.00 0.00 3.06 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.48 1.52 7.81 65 K 7.78 4.01 0.00 1.89 1.89 0.00 1.78 0.00 0.00 1.61 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.73 1.66 7.81 66 V 7.89 3.66 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 1.15 0.00 0.00 0.94 0.00 0.00 67 L 8.23 4.17 0.00 1.91 1.80 1.07 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 68 D 8.53 4.50 0.00 3.04 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 S 8.40 4.14 0.00 4.03 4.25 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 70 F 8.70 4.28 0.00 3.23 3.40 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 71 S 9.01 4.11 0.00 4.23 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 0.00 72 N 8.58 4.51 0.00 2.81 2.93 0.00 0.00 7.06 8.67 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 73 G 8.04 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 74 M 7.51 3.76 0.00 1.69 2.05 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.64 0.00 75 K 7.65 4.24 0.00 1.75 1.59 0.00 1.66 0.00 0.00 1.69 0.00 0.00 3.07 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.40 1.45 7.81 76 H 8.09 4.95 0.00 3.04 3.13 0.00 5.62 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 77 L 7.82 3.98 0.00 1.56 1.66 0.79 0.94 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 78 D 7.95 4.49 0.00 2.77 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 79 D 8.21 4.77 0.00 2.68 2.52 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 0.00 80 L 7.99 4.16 0.00 1.77 1.83 0.92 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 81 K 8.09 3.99 0.00 1.75 1.83 0.00 1.78 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.33 1.34 7.81 82 G 8.32 3.67 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 0.00 0.00 0.00 83 T 7.73 3.73 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.47 0.00 0.00 84 F 7.85 4.65 0.00 3.01 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 85 A 7.57 3.97 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 86 A 7.87 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 87 L 7.95 4.09 0.00 2.00 1.87 1.10 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 88 S 8.62 4.22 0.00 4.06 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 89 E 8.10 3.95 0.00 2.29 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.37 0.00 90 L 7.98 3.95 0.00 1.84 1.87 0.92 0.88 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 91 H 8.52 4.21 0.00 3.48 3.65 0.00 5.86 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 C 8.51 4.35 0.00 3.14 3.24 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 93 D 8.45 4.44 0.00 2.92 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 94 K 8.02 4.25 0.00 1.88 1.83 0.00 1.74 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.37 1.45 7.81 95 L 8.01 4.28 0.00 1.78 1.70 0.73 1.20 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 96 H 7.48 4.27 0.00 3.43 3.48 0.00 5.65 0.00 0.00 0.00 0.00 8.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 V 8.00 3.87 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 0.10 0.00 0.00 0.31 0.00 0.00 98 D 8.71 4.19 0.00 2.70 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 P 0.00 3.16 0.00 2.07 2.04 0.00 3.15 0.00 0.00 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.79 0.00 100 E 8.33 3.86 0.00 2.11 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 2.28 2.37 0.00 101 N 8.11 4.34 0.00 2.52 2.72 0.00 0.00 6.93 8.19 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 0.00 102 F 7.38 4.42 0.00 3.11 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 0.00 103 K 8.02 4.02 0.00 1.99 1.85 0.00 1.67 0.00 0.00 1.82 0.00 0.00 2.96 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.55 1.56 7.81 104 L 7.76 3.84 0.00 1.59 1.09 0.59 0.28 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 0.00 105 L 8.18 4.04 0.00 1.77 1.70 0.92 0.98 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 0.00 106 G 8.15 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 0.00 107 N 8.27 4.45 0.00 3.06 2.93 0.00 0.00 6.65 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 0.00 108 V 8.11 3.60 2.24 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 1.07 0.00 0.00 1.14 0.00 0.00 109 L 8.20 3.86 0.00 1.64 1.76 0.83 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 110 V 7.86 3.61 2.33 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 1.35 0.00 0.00 1.19 0.00 0.00 111 V 8.07 3.60 2.24 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 1.01 0.00 0.00 1.05 0.00 0.00 112 V 8.14 3.46 2.16 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 0.97 0.00 0.00 0.94 0.00 0.00 113 L 8.01 3.87 0.00 0.98 0.76 0.68 1.61 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 0.00 114 A 7.92 3.91 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 0.00 115 R 7.77 3.87 0.00 1.84 1.93 0.00 3.20 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.61 0.00 116 N 7.80 4.17 0.00 1.79 1.42 0.00 0.00 6.88 6.97 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 0.00 117 F 7.47 5.15 0.00 3.25 3.23 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 0.00 118 G 8.29 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 0.00 119 K 8.79 4.17 0.00 1.92 2.01 0.00 1.62 0.00 0.00 1.74 0.00 0.00 3.05 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.46 1.52 7.81 120 E 8.35 4.13 0.00 2.27 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 0.00 2.43 2.44 0.00 121 F 8.03 4.29 0.00 2.96 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 0.00 122 T 7.25 4.13 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 1.29 0.00 0.00 123 P 0.00 4.13 0.00 2.13 2.12 0.00 3.56 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.13 0.00 124 V 7.60 3.51 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 0.99 0.00 0.00 0.90 0.00 0.00 125 L 7.83 3.84 0.00 1.65 1.25 1.05 0.06 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 0.00 126 Q 7.86 3.32 0.00 1.25 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.37 2.50 0.00 127 A 8.00 4.00 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 0.00 128 D 8.00 4.24 0.00 2.84 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 0.00 129 F 8.42 3.97 0.00 3.34 3.33 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 0.00 130 Q 8.61 4.09 0.00 2.23 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.81 0.00 0.00 0.00 0.00 0.00 2.71 2.59 0.00 131 K 7.96 3.95 0.00 1.99 1.81 0.00 1.68 0.00 0.00 1.53 0.00 0.00 2.88 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.60 7.81 132 V 7.55 3.48 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 0.67 0.00 0.00 133 V 8.31 3.73 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 0.96 0.00 0.00 1.09 0.00 0.00 134 A 8.39 4.10 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 0.00 135 G 8.29 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.93 3.14 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 0.30 0.00 0.00 0.84 0.00 0.00 137 A 8.05 3.80 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 0.00 138 N 8.15 4.27 0.00 2.80 2.99 0.00 0.00 7.23 7.74 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 0.00 139 A 8.05 4.16 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 0.00 140 L 7.75 3.75 0.00 0.92 0.13 0.10 0.43 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 0.00 141 A 8.07 4.40 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 0.00 0.00 0.00 0.00 0.00 0.00 142 H 7.80 3.93 0.00 3.33 3.42 0.00 5.59 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 R 8.07 4.21 0.00 1.98 2.05 0.00 3.49 0.00 0.00 3.22 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.82 0.00 144 Y 8.52 4.24 0.00 3.03 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 0.00 145 H 8.15 4.62 0.00 3.10 3.13 0.00 5.74 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