NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 Q 4.1856 8.3449 119.6872 56.2396 30.0064 174.9649 2 L 3.4529 8.4249 111.5284 54.7686 38.7092 172.7052 3 P 4.2164 0.0000 0.0000 63.9449 33.6002 176.6983 4 R 4.6875 7.6848 120.4173 54.5414 33.0758 173.9752 5 L 5.3218 8.4687 124.8484 53.4131 45.7203 176.1123 6 C 5.2789 9.1981 119.2322 55.4004 40.6747 173.6417 7 K 5.0395 8.7483 119.5600 56.2158 33.4065 176.4467 8 F 5.0326 8.7014 124.8801 56.7928 40.7951 171.8957 9 C 5.1923 10.1212 119.8940 53.1413 45.3393 173.7356 10 D 4.9667 8.7691 121.0486 53.9108 41.8556 176.2001 11 V 4.7092 8.4817 120.1747 61.0122 31.9548 175.5346 12 K 4.7433 8.4664 123.5470 54.1452 36.8424 174.9031 13 A 4.3583 8.7061 122.3215 53.4010 18.4850 176.9247 14 T 4.5159 9.6852 117.1323 60.8934 70.1165 173.9165 15 T 4.5527 8.3178 116.9275 61.7839 67.6838 174.1162 16 C 4.4352 8.0794 119.8738 55.3944 44.3028 173.1355 17 S 4.3352 7.6938 122.1295 56.2616 65.4220 174.6895 18 N 3.1400 7.2481 119.1585 51.6767 35.2913 174.2251 19 Q 4.4554 6.3403 120.7157 54.5710 31.9209 177.1953 20 D 5.2081 8.7124 120.8597 56.6450 42.2715 176.3955 21 Q 4.8247 7.8558 117.8407 54.5667 32.2015 174.4505 22 C 5.0785 8.9955 125.1218 55.5057 48.1021 172.1779 23 T 5.1326 8.3050 116.9148 61.8486 70.8963 175.0404 24 S 4.3588 8.8849 119.0139 59.4407 63.6812 176.5363 25 N 4.4678 8.6418 115.2118 53.9595 38.3196 174.6639 26 C 4.6850 7.6856 113.9303 57.7937 40.9351 172.4633 27 N 5.0589 8.2829 117.7182 53.2692 39.0429 173.8661 28 I 4.7887 7.7661 116.0607 59.6789 42.2160 175.6512 29 T 5.0337 8.6115 121.1728 61.9759 70.6403 173.1753 30 S 4.6543 9.8724 123.5394 56.9616 65.0855 173.4202 31 I 4.4968 8.3126 125.1751 60.0207 38.1639 177.3481 32 C 4.9626 8.2238 124.5039 55.7872 39.5353 174.7681 33 E 4.0286 7.8752 115.6871 57.6788 29.9189 178.7494 34 K 4.0514 7.8710 118.4390 57.0292 33.0107 177.3501 35 N 4.6224 8.4183 123.5189 54.9289 39.2477 175.1451 36 N 4.7676 7.9513 111.6794 53.2946 38.4051 174.1413 37 E 4.6130 7.9842 117.9369 54.6628 32.0514 175.7616 38 V 4.5449 8.1264 115.8483 59.4962 36.1693 175.0070 39 C 5.0658 8.9973 119.5768 56.2358 42.2188 173.1200 40 A 5.2687 9.0259 125.0724 50.1587 22.1980 174.4557 41 A 5.2765 9.4266 124.4217 49.9938 22.4846 175.0320 42 V 4.9458 9.0249 122.9844 59.8951 34.1393 174.4322 43 W 5.1705 9.7886 135.0000 55.7466 32.5101 174.8256 44 R 4.9881 8.7853 126.5182 54.3663 33.3525 175.7039 45 R 4.2577 9.4658 118.2999 54.6365 32.1638 173.2977 46 N 4.7225 8.8899 122.9369 53.8259 39.4993 176.0566 47 D 4.1521 8.3744 121.0436 55.2216 41.1390 173.9489 48 E 4.5574 9.2048 119.3630 56.1836 31.2634 174.2276 49 N 4.7223 9.7634 115.5029 50.9771 39.3264 172.8077 50 V 4.3591 8.0074 123.8573 61.2166 33.5203 174.3738 51 T 5.1322 8.2617 117.9797 58.8458 71.8557 172.6180 52 L 5.1785 8.4328 125.4938 53.2398 45.4082 174.2480 53 E 5.1163 9.3952 126.8861 54.7389 32.5297 174.6351 54 T 5.1287 8.5225 122.4063 62.0785 72.8717 172.9736 55 I 3.7466 8.1285 117.5755 60.9725 41.3696 172.9872 56 C 5.8431 9.0011 123.8643 55.5147 42.3172 171.2910 57 H 5.1523 8.3439 123.1573 53.7038 32.7563 172.6268 58 D 4.5545 8.0946 124.2030 53.2834 41.4276 176.1153 59 P 4.7467 0.0000 0.0000 63.1795 31.2076 177.2145 60 Q 4.2769 8.3940 121.5352 58.7277 29.9393 176.0397 61 K 4.2419 7.7095 115.3705 55.4678 33.0738 176.9198 62 R 4.4002 8.2258 118.6799 54.8141 29.2108 175.7543 63 L 3.8107 8.4402 126.2667 55.7667 42.6738 176.1587 64 Y 3.7924 9.0195 121.2435 58.9431 35.5831 171.1682 65 G 3.9318 8.3539 104.4595 46.3054 0.0000 173.5359 66 H 5.0783 9.1427 116.8600 53.7368 31.8339 172.7025 67 M 5.0320 8.3591 121.7710 53.1842 34.4380 176.0101 68 L 4.2599 8.4023 123.4356 55.3094 42.9451 176.8262 69 D 4.7746 7.8717 118.8317 52.3178 42.0161 175.1056 70 D 4.9673 7.2597 114.7149 54.5538 43.7627 176.5102 71 S 4.8438 7.4085 114.0366 59.1476 64.1722 175.4586 72 S 4.4837 7.8464 113.6543 58.3313 62.6794 173.6604 73 S 4.4264 7.6496 113.9182 58.2314 63.0441 173.4098 74 E 4.0359 8.8220 127.0812 58.4721 29.7198 176.9282 75 Q 4.5250 7.7761 117.2964 54.0277 30.3681 175.2900 76 C 4.6539 8.3111 124.2230 56.0999 44.8174 172.4259 77 V 4.5747 8.2202 125.4874 59.9891 33.5514 175.0873 78 M 4.2178 9.2791 124.7434 54.9584 32.2828 176.0670 79 K 4.4184 8.4814 124.6500 55.3656 34.5541 175.3052 80 E 3.1417 8.2495 123.1617 54.3233 30.4540 175.1689 81 K 4.4969 7.2569 124.0257 53.5426 34.8869 176.4000 82 K 3.7313 8.6079 121.4593 57.6545 31.7598 176.1362 83 D 4.7547 8.4035 124.0841 52.4290 42.7410 175.1172 84 D 4.5939 8.7014 124.4917 54.1786 42.6575 176.5467 85 G 3.9880 8.9612 114.9683 44.0144 0.0000 172.7675 86 G 4.4723 6.9979 110.5155 46.0011 0.0000 172.3199 87 L 4.6864 8.1774 123.1332 54.2865 43.1332 175.9091 88 M 5.2223 10.6600 123.3182 53.7834 35.6048 174.2963 89 F 5.9120 10.5893 123.7995 55.2007 42.0328 174.7106 90 M 5.3624 8.6092 119.3732 53.8496 34.5899 174.6904 91 C 5.2249 9.2324 120.7584 55.3050 42.3266 172.4061 92 S 5.3505 8.2780 116.2645 56.8054 66.8995 171.4732 93 C 6.1031 8.7362 114.2089 55.7164 44.4191 174.6504 94 T 3.8591 9.0077 116.5826 62.9945 67.3997 174.6291 95 G 3.7617 7.7365 109.1755 45.7020 0.0000 172.8527 96 E 4.0967 8.7194 121.0637 57.2688 29.9464 176.2132 97 E 3.9688 9.1643 123.6978 56.0519 27.8064 176.0845 98 C 4.3959 7.9641 120.2370 58.6283 43.3258 174.9805 99 N 4.1434 8.0585 116.4141 54.6854 38.1943 176.6832 100 D 4.8222 8.1747 118.7731 55.3770 39.3445 176.4101 101 V 5.1339 7.9197 119.7423 60.8990 32.4385 175.4147 102 L 4.4265 8.3956 129.2033 54.0980 41.6983 175.3368 103 I 4.6890 7.7324 125.0521 60.3873 38.6416 175.1636 104 F 4.9982 9.5429 127.1381 55.6485 40.8318 175.2085 105 S 4.9416 8.7517 117.7841 56.4845 65.6585 173.5160 106 A 4.5508 8.6217 125.9726 53.2154 20.5654 176.3518 107 I 3.8940 7.7130 119.3661 61.3794 38.0626 175.3729 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 Q 8.34 4.19 0.00 2.06 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.54 0.00 0.00 0.00 0.00 0.00 2.26 2.39 0.00 2 L 8.42 3.45 0.00 1.88 1.64 0.92 0.63 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 P 0.00 4.22 0.00 2.18 2.17 0.00 3.71 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.95 0.00 4 R 7.68 4.69 0.00 1.94 1.81 0.00 3.09 0.00 0.00 3.37 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.63 0.00 5 L 8.47 5.32 0.00 1.56 1.51 0.97 0.92 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 6 C 9.20 5.28 0.00 2.91 2.97 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 7 K 8.75 5.04 0.00 1.76 1.76 0.00 1.93 0.00 0.00 1.74 0.00 0.00 2.82 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.58 1.52 7.81 8 F 8.70 5.03 0.00 3.04 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 9 C 10.12 5.19 0.00 3.03 3.16 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 10 D 8.77 4.97 0.00 2.59 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 11 V 8.48 4.71 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 0.77 0.00 0.00 0.86 0.00 0.00 12 K 8.47 4.74 0.00 1.79 1.89 0.00 1.55 0.00 0.00 1.84 0.00 0.00 2.85 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.52 1.44 7.81 13 A 8.71 4.36 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 14 T 9.69 4.52 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 15 T 8.32 4.55 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 16 C 8.08 4.44 0.00 3.05 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 17 S 7.69 4.34 0.00 3.59 3.45 0.00 0.00 0.00 0.00 0.00 0.00 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 N 7.25 3.14 0.00 2.39 2.11 0.00 0.00 5.62 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 19 Q 6.34 4.46 0.00 2.05 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.77 6.59 0.00 0.00 0.00 0.00 0.00 2.05 2.06 0.00 20 D 8.71 5.21 0.00 2.80 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 21 Q 7.86 4.82 0.00 2.03 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.57 0.00 0.00 0.00 0.00 0.00 2.23 2.34 0.00 22 C 9.00 5.08 0.00 3.31 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 T 8.31 5.13 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 1.32 0.00 0.00 24 S 8.88 4.36 0.00 3.85 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 N 8.64 4.47 0.00 2.90 3.03 0.00 0.00 7.06 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 C 7.69 4.69 0.00 3.09 3.06 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 0.00 27 N 8.28 5.06 0.00 2.62 2.73 0.00 0.00 6.80 7.96 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 28 I 7.77 4.79 2.05 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.96 1.05 0.00 0.00 29 T 8.61 5.03 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 1.24 0.00 0.00 30 S 9.87 4.65 0.00 3.80 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 31 I 8.31 4.50 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 1.35 0.57 1.00 0.00 0.00 32 C 8.22 4.96 0.00 3.02 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 E 7.88 4.03 0.00 2.07 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.33 0.00 34 K 7.87 4.05 0.00 1.78 2.06 0.00 1.94 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.44 1.42 7.81 35 N 8.42 4.62 0.00 2.91 2.90 0.00 0.00 7.09 6.80 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 36 N 7.95 4.77 0.00 2.75 2.80 0.00 0.00 6.83 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 37 E 7.98 4.61 0.00 1.94 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 2.26 2.32 0.00 38 V 8.13 4.54 2.18 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 0.93 0.00 0.00 0.97 0.00 0.00 39 C 9.00 5.07 0.00 2.91 3.18 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 40 A 9.03 5.27 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 41 A 9.43 5.28 1.28 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 0.00 0.00 42 V 9.02 4.95 2.26 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 1.20 0.00 0.00 1.18 0.00 0.00 43 W 9.79 5.17 0.00 3.58 3.44 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 44 R 8.79 4.99 0.00 1.39 1.54 0.00 2.61 0.00 0.00 2.36 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.46 0.00 45 R 9.47 4.26 0.00 1.64 0.66 0.00 2.90 0.00 0.00 3.22 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.70 0.00 46 N 8.89 4.72 0.00 2.81 2.85 0.00 0.00 6.68 7.64 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 47 D 8.37 4.15 0.00 2.77 2.46 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 48 E 9.20 4.56 0.00 1.86 1.84 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 2.16 2.27 0.00 49 N 9.76 4.72 0.00 2.83 2.67 0.00 0.00 6.52 7.52 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 50 V 8.01 4.36 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 0.43 0.00 0.00 0.88 0.00 0.00 51 T 8.26 5.13 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 1.06 0.00 0.00 52 L 8.43 5.18 0.00 1.95 1.64 1.22 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 53 E 9.40 5.12 0.00 2.06 1.84 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 2.16 2.47 0.00 54 T 8.52 5.13 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 1.26 0.00 0.00 55 I 8.13 3.75 1.07 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 0.79 1.31 -0.88 0.00 0.00 56 C 9.00 5.84 0.00 3.27 3.25 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 57 H 8.34 5.15 0.00 3.10 3.10 0.00 5.97 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 58 D 8.09 4.55 0.00 2.60 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 59 P 0.00 4.75 0.00 2.17 2.14 0.00 3.71 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 1.97 1.94 0.00 60 Q 8.39 4.28 0.00 1.93 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.62 6.90 0.00 0.00 0.00 0.00 0.00 2.28 2.29 0.00 61 K 7.71 4.24 0.00 1.88 1.72 0.00 1.79 0.00 0.00 1.79 0.00 0.00 3.07 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.42 1.41 7.81 62 R 8.23 4.40 0.00 1.90 1.97 0.00 3.19 0.00 0.00 3.14 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.54 0.00 63 L 8.44 3.81 0.00 1.38 1.36 0.10 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 64 Y 9.02 3.79 0.00 2.92 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 65 G 8.35 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 H 9.14 5.08 0.00 3.11 3.14 0.00 5.56 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 M 8.36 5.03 0.00 1.96 1.95 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.51 0.00 68 L 8.40 4.26 0.00 1.65 1.61 0.97 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 69 D 7.87 4.77 0.00 2.57 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 70 D 7.26 4.97 0.00 2.58 2.57 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 0.00 0.00 0.00 0.00 71 S 7.41 4.84 0.00 4.04 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 72 S 7.85 4.48 0.00 3.84 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 73 S 7.65 4.43 0.00 4.03 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 E 8.82 4.04 0.00 1.97 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 2.33 0.00 75 Q 7.78 4.52 0.00 2.06 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.71 0.00 0.00 0.00 0.00 0.00 2.27 2.31 0.00 76 C 8.31 4.65 0.00 2.92 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 77 V 8.22 4.57 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 0.77 0.00 0.00 0.99 0.00 0.00 78 M 9.28 4.22 0.00 1.54 0.95 0.00 0.00 0.00 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.88 0.00 79 K 8.48 4.42 0.00 1.88 1.54 0.00 1.45 0.00 0.00 1.66 0.00 0.00 2.93 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.30 1.32 7.81 80 E 8.25 3.14 0.00 1.66 1.54 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 2.01 2.21 0.00 81 K 7.26 4.50 0.00 0.79 1.48 0.00 1.67 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.14 1.08 7.81 82 K 8.61 3.73 0.00 1.83 1.88 0.00 1.42 0.00 0.00 1.71 0.00 0.00 3.16 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.40 1.52 7.81 83 D 8.40 4.75 0.00 2.75 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 84 D 8.70 4.59 0.00 2.62 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 85 G 8.96 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 86 G 7.00 4.47 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 0.00 87 L 8.18 4.69 0.00 1.84 2.10 1.02 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 88 M 10.66 5.22 0.00 1.95 2.32 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.41 0.00 89 F 10.59 5.91 0.00 3.43 2.99 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 90 M 8.61 5.36 0.00 2.26 2.20 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.68 0.00 91 C 9.23 5.22 0.00 3.02 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 S 8.28 5.35 0.00 3.88 3.91 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 93 C 8.74 6.10 0.00 3.08 3.21 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 94 T 9.01 3.86 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 1.30 0.00 0.00 95 G 7.74 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 96 E 8.72 4.10 0.00 2.02 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 2.39 2.35 0.00 97 E 9.16 3.97 0.00 2.17 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 2.21 0.00 98 C 7.96 4.40 0.00 2.99 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 99 N 8.06 4.14 0.00 2.94 3.19 0.00 0.00 6.15 8.25 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 0.00 100 D 8.17 4.82 0.00 2.96 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 0.00 101 V 7.92 5.13 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 0.83 0.00 0.00 0.94 0.00 0.00 102 L 8.40 4.43 0.00 1.36 1.74 1.23 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 103 I 7.73 4.69 1.95 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 1.22 0.43 0.90 0.00 0.00 104 F 9.54 5.00 0.00 2.82 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 0.00 105 S 8.75 4.94 0.00 3.94 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 A 8.62 4.55 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 0.00 107 I 7.71 3.89 1.89 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 1.28 0.74 0.93 0.00 0.00