NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -3 R 4.1588 8.2431 119.0383 55.2244 32.3305 174.6058 -2 G 4.4090 8.4060 106.2244 46.1925 0.0000 174.1404 -1 S 4.3499 8.5728 116.1959 60.4297 64.0318 173.8080 0 H 4.4114 7.9059 119.3970 58.0642 28.5468 176.9818 1 M 3.8287 7.5134 121.3344 57.7915 31.5172 178.3730 2 R 2.8906 6.6432 117.5397 59.5767 30.2414 178.7686 3 T 3.7916 7.5378 114.8538 66.2540 68.4985 176.2841 4 L 3.9779 7.5986 121.7354 58.3681 42.1372 179.1180 5 L 4.2984 8.3696 119.1789 57.7659 41.5158 179.7139 6 I 2.9170 7.7319 119.7775 64.1999 37.0001 178.5954 7 R 3.9473 8.0578 118.8466 59.3718 29.7861 178.3438 8 Y 2.9175 8.5402 119.4416 60.6134 38.8846 178.3667 9 I 3.2767 7.8361 120.5734 64.2436 37.3308 178.5488 10 L 3.4463 7.7220 119.8140 57.2289 41.4014 179.3396 11 W 4.2982 8.2063 128.4680 60.5381 30.5545 178.3070 12 R 3.3684 7.7127 118.1369 58.6908 29.0815 178.5968 13 N 4.9031 7.5768 117.5402 55.1807 39.0939 175.7010 14 D 4.7146 7.5284 116.4714 51.7855 40.8625 175.2145 15 N 3.3864 8.0489 118.0451 54.1639 38.1533 173.4784 16 D 4.6904 8.2304 116.2438 53.0073 41.5988 176.1459 17 Q 4.2321 9.0930 128.9205 59.6703 29.2900 178.5541 18 T 3.7106 8.3201 114.0103 66.5915 68.4505 174.3166 19 Y 4.6716 8.0873 116.2779 57.8156 38.0614 175.2517 20 Y 3.7467 7.9440 121.5078 57.5178 39.6595 174.8696 21 N 4.0300 5.7700 122.2056 50.7651 42.0725 174.4944 22 D 4.2078 8.3880 125.9638 57.9123 40.5634 178.9790 23 D 4.4430 8.1715 118.7056 56.9273 40.6576 178.8378 24 F 4.1667 7.9404 118.8892 59.9097 38.5173 177.4140 25 K 4.0134 7.9105 117.9889 59.6890 32.2510 178.8556 26 K 4.0617 8.0789 117.7614 59.5947 32.1614 179.2820 27 L 3.8536 7.3903 118.7504 57.9430 41.2732 179.5209 28 M 4.5301 8.2294 119.9342 57.5721 32.0257 178.5549 29 L 4.0574 7.8481 118.6608 57.2389 41.7255 178.8811 30 L 4.2396 7.8823 118.0648 56.6008 41.0415 178.5601 31 D 4.4892 8.3449 120.1545 57.1731 40.5295 177.9318 32 E 4.1998 7.6351 115.2700 58.1220 29.7906 178.5287 33 L 4.1411 8.0164 120.0134 55.8148 42.1423 177.2174 34 V 4.4222 6.7527 110.6593 58.9054 34.3005 174.9778 35 D 4.4589 8.5017 123.5575 54.0328 41.7349 176.7667 36 D 4.5837 8.9745 126.7817 57.2164 40.7177 179.2142 37 G 3.5933 8.2038 106.1952 47.7815 0.0000 175.4144 38 D 4.3980 8.0318 121.1779 56.9888 40.7190 179.0960 39 V 3.5673 7.7063 118.2597 66.1881 31.6664 177.4244 40 C 4.0900 7.8905 117.9653 62.8119 31.3433 175.7400 41 T 3.8717 7.9541 117.3420 66.4508 68.0659 176.4532 42 L 3.9374 8.0498 122.2829 58.2166 42.0563 179.0513 43 I 3.7016 8.1089 120.1078 64.2858 37.0483 178.5142 44 K 3.9273 8.0860 119.2248 59.7142 31.9833 179.2235 45 N 4.3828 8.1926 116.6184 56.3923 38.3587 177.5289 46 M 4.0980 8.0249 120.2914 58.4143 31.7231 178.9757 47 R 3.9100 8.1898 118.6474 59.3424 30.0337 178.8513 48 M 4.1175 7.9839 115.4620 57.7610 31.5897 177.7776 49 T 4.0416 7.7389 112.6149 61.5484 68.0579 173.6495 50 L 3.5465 7.2738 121.0802 55.4484 40.9544 172.9915 51 S 4.4145 7.7891 109.8496 56.7551 66.0744 175.0243 52 D 4.5932 8.2383 118.4982 53.3238 39.3003 177.9062 53 G 3.8186 7.6732 108.4369 48.1852 0.0000 174.0684 54 P 4.3519 0.0000 0.0000 64.7666 31.2410 178.5926 55 L 3.9258 7.7208 118.8683 58.1529 42.1973 178.8605 56 L 3.9510 8.0982 119.1432 57.6751 41.2429 179.2970 57 D 4.2995 8.0862 118.4071 57.4213 41.1455 178.4128 58 R 4.0261 7.9815 119.1660 59.4807 29.8420 178.5517 59 L 4.1270 7.9100 117.8723 57.3269 41.6978 178.3425 60 N 4.5962 7.7599 114.2225 53.3390 39.0677 175.5765 61 Q 4.1870 7.2311 120.0297 54.7056 29.4591 174.5686 62 P 4.3869 0.0000 0.0000 62.8880 31.9015 175.9874 63 V 4.3141 8.1961 118.7577 61.5537 33.3807 174.7810 64 N 4.9530 8.8821 123.9975 53.4135 40.2388 174.4234 65 N 5.0052 7.5017 114.9525 50.3184 41.9676 174.6874 66 I 3.3083 8.0110 118.7645 63.7170 38.0810 177.3265 67 E 4.0205 8.1061 119.2794 59.1276 29.4089 178.6249 68 D 4.3131 8.9254 119.3260 56.9814 40.8374 178.4520 69 A 3.9522 7.5188 120.8199 55.3265 18.3571 179.7214 70 K 3.8896 7.9616 116.8450 59.6041 31.9991 179.5688 71 R 3.8618 7.7867 118.4559 59.7690 30.0870 178.3492 72 M 4.1114 8.1835 117.9390 58.5720 32.1647 178.2805 73 I 3.8353 8.0774 119.9911 64.3583 37.2548 178.2595 74 A 4.1318 8.2935 121.9149 55.1568 18.1045 179.5553 75 I 3.7054 8.3076 117.6850 64.0976 37.9787 178.2977 76 S 4.1631 8.2065 115.9950 61.5059 62.6819 176.5465 77 A 3.7972 8.0688 123.3411 55.2008 18.1324 179.9291 78 K 3.9300 8.3041 117.2205 59.3957 32.0610 179.9280 79 V 3.5641 8.2255 118.7944 65.9376 31.5118 177.8696 80 A 4.3114 8.4059 120.9897 55.2431 17.8834 179.6758 81 R 4.1070 7.6581 117.6219 59.1786 30.4482 178.0897 82 D 4.5283 8.2901 118.1052 56.3575 40.8028 178.5691 83 I 3.6780 8.2241 119.1724 61.2752 38.4153 176.9244 84 G 4.0845 7.2481 103.1909 45.5207 0.0000 174.2676 85 E 4.1287 8.4381 118.6356 58.6317 30.0074 178.6091 86 R 4.0306 7.9344 117.7230 58.4803 30.4072 177.1282 87 S 4.0757 7.5770 114.3044 59.3342 63.0676 175.1085 88 E 4.3542 8.4638 126.1806 54.6361 27.9576 174.2495 89 I 4.1378 7.3087 121.4392 59.2041 39.8297 177.6613 90 R 4.1912 7.7506 124.4550 54.1682 27.8587 176.8524 91 W 3.9359 8.0313 123.2583 59.6710 29.3827 177.2425 92 E 4.2888 8.3582 116.7189 59.5249 28.6343 179.1451 93 E 3.9652 8.2936 119.9919 59.3914 29.5618 179.3716 94 S 4.0405 7.6936 114.6886 61.5389 62.8851 176.4399 95 F 4.1331 8.0390 120.7808 60.8269 38.6422 177.8028 96 T 4.0010 8.0688 115.2236 66.7495 68.4000 176.7831 97 I 3.6876 7.5285 121.5718 64.3440 37.2271 177.7408 98 L 3.9337 8.3060 121.4072 58.8697 41.7340 179.2741 99 F 4.7321 8.3207 117.4746 60.5931 38.6320 177.7246 100 R 3.9459 7.9157 117.7757 59.3322 29.8910 177.8081 101 M 4.3770 7.8981 117.3416 56.3493 32.7190 177.3751 102 I 4.6731 7.9392 111.2207 60.3802 38.9496 177.1446 103 E 2.0000 8.0837 120.9221 59.4227 28.8273 179.0424 104 T 3.4115 7.6626 111.9418 64.1379 67.4084 174.0891 105 Y 4.5709 7.8693 117.4648 57.7806 38.1466 177.0206 106 F 4.6547 8.6930 122.2933 61.1133 38.9383 177.2559 107 D 4.4352 8.2436 117.6339 57.7407 40.7653 178.6252 108 D 4.4563 8.1981 118.5848 57.0855 40.8493 178.7168 109 L 4.0804 8.2004 120.0021 57.7043 41.6413 178.9866 110 M 4.2115 8.2611 118.4577 58.7692 32.1617 178.4088 111 I 3.8486 7.7661 113.2025 64.0728 37.5983 177.6690 112 D 4.3372 8.1505 118.8493 56.1894 41.0755 177.1701 113 L 4.3159 7.6710 117.6743 54.6253 42.8885 176.4553 114 Y 4.8750 8.1664 116.0466 57.4983 39.0612 175.7678 115 G 3.7568 7.9575 114.6837 45.7719 0.0000 173.4947 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 R 8.24 4.16 0.00 1.85 1.92 0.00 3.20 0.00 0.00 3.22 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.21 0.00 -2 G 8.41 4.41 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 0.00 -1 S 8.57 4.35 0.00 4.07 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 0 H 7.91 4.41 0.00 3.07 3.23 0.00 5.64 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1 M 7.51 3.83 0.00 1.14 0.88 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 2.66 2.52 0.00 2 R 6.64 2.89 0.00 1.59 1.66 0.00 3.05 0.00 0.00 3.13 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.66 0.00 3 T 7.54 3.79 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 1.16 0.00 0.00 4 L 7.60 3.98 0.00 1.86 1.78 0.95 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 5 L 8.37 4.30 0.00 1.99 2.03 1.17 1.03 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 6 I 7.73 2.92 1.86 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 0.29 0.74 0.69 0.00 0.00 7 R 8.06 3.95 0.00 2.25 2.36 0.00 3.16 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.78 0.00 8 Y 8.54 2.92 0.00 2.82 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 9 I 7.84 3.28 2.01 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.93 0.61 0.00 0.00 10 L 7.72 3.45 0.00 1.59 1.50 0.93 0.25 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 11 W 8.21 4.30 0.00 3.54 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 12 R 7.71 3.37 0.00 1.56 1.69 0.00 2.96 0.00 0.00 2.81 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.97 0.00 13 N 7.58 4.90 0.00 2.28 2.67 0.00 0.00 6.98 8.11 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 14 D 7.53 4.71 0.00 3.01 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 15 N 8.05 3.39 0.00 2.39 2.71 0.00 0.00 7.08 8.37 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 16 D 8.23 4.69 0.00 2.95 2.96 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 17 Q 9.09 4.23 0.00 2.26 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.25 6.60 0.00 0.00 0.00 0.00 0.00 2.46 2.52 0.00 18 T 8.32 3.71 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 0.49 0.00 0.00 19 Y 8.09 4.67 0.00 3.30 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 20 Y 7.94 3.75 0.00 2.98 2.93 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 21 N 5.77 4.03 0.00 1.79 1.42 0.00 0.00 6.99 8.49 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 22 D 8.39 4.21 0.00 2.49 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 23 D 8.17 4.44 0.00 2.42 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 24 F 7.94 4.17 0.00 2.61 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 25 K 7.91 4.01 0.00 1.85 1.97 0.00 1.77 0.00 0.00 1.78 0.00 0.00 3.15 0.00 0.00 3.26 0.00 0.00 0.00 0.00 1.65 1.74 7.81 26 K 8.08 4.06 0.00 1.71 1.53 0.00 1.61 0.00 0.00 1.74 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.56 1.46 7.81 27 L 7.39 3.85 0.00 1.06 0.61 0.64 0.79 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 28 M 8.23 4.53 0.00 2.26 2.44 0.00 0.00 0.00 0.00 0.00 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.26 2.95 0.00 29 L 7.85 4.06 0.00 1.81 1.72 0.90 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 30 L 7.88 4.24 0.00 2.03 1.75 0.95 0.77 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 31 D 8.34 4.49 0.00 2.80 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 32 E 7.64 4.20 0.00 2.25 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 0.00 2.51 2.36 0.00 33 L 8.02 4.14 0.00 1.78 1.78 0.92 0.76 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 34 V 6.75 4.42 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 0.69 0.00 0.00 0.99 0.00 0.00 35 D 8.50 4.46 0.00 2.76 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 36 D 8.97 4.58 0.00 2.81 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 37 G 8.20 3.59 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 0.00 38 D 8.03 4.40 0.00 2.98 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 39 V 7.71 3.57 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 1.15 0.00 0.00 1.00 0.00 0.00 40 C 7.89 4.09 0.00 3.13 3.08 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 41 T 7.95 3.87 4.39 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 1.20 0.00 0.00 42 L 8.05 3.94 0.00 1.92 1.74 0.92 0.99 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 43 I 8.11 3.70 2.01 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 1.75 0.69 0.90 0.00 0.00 44 K 8.09 3.93 0.00 1.98 1.84 0.00 1.66 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.77 7.81 45 N 8.19 4.38 0.00 2.87 2.84 0.00 0.00 7.09 7.77 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 46 M 8.02 4.10 0.00 2.08 2.22 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.51 0.00 47 R 8.19 3.91 0.00 1.97 1.95 0.00 3.26 0.00 0.00 3.19 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.79 0.00 48 M 7.98 4.12 0.00 2.17 2.17 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 2.57 2.75 0.00 49 T 7.74 4.04 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 1.26 0.00 0.00 50 L 7.27 3.55 0.00 1.73 1.64 0.89 0.77 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 51 S 7.79 4.41 0.00 3.88 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 52 D 8.24 4.59 0.00 2.71 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 53 G 7.67 3.82 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 0.00 0.00 0.00 54 P 0.00 4.35 0.00 2.13 2.08 0.00 3.66 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.10 0.00 55 L 7.72 3.93 0.00 1.62 1.69 0.84 0.67 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 56 L 8.10 3.95 0.00 1.82 1.66 0.89 1.17 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 57 D 8.09 4.30 0.00 2.78 2.71 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 58 R 7.98 4.03 0.00 1.93 2.09 0.00 3.29 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 1.63 1.73 0.00 59 L 7.91 4.13 0.00 1.79 1.72 0.90 1.09 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 60 N 7.76 4.60 0.00 2.96 2.86 0.00 0.00 7.03 7.65 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 61 Q 7.23 4.19 0.00 2.10 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.90 0.00 0.00 0.00 0.00 0.00 2.40 2.51 0.00 62 P 0.00 4.39 0.00 2.19 2.07 0.00 3.71 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.97 0.00 63 V 8.20 4.31 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 0.78 0.00 0.00 0.96 0.00 0.00 64 N 8.88 4.95 0.00 2.77 2.86 0.00 0.00 6.84 7.28 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 65 N 7.50 5.01 0.00 2.88 2.87 0.00 0.00 5.91 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 66 I 8.01 3.31 1.89 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.31 0.89 0.00 0.00 67 E 8.11 4.02 0.00 2.18 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 2.36 2.32 0.00 68 D 8.93 4.31 0.00 2.68 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 69 A 7.52 3.95 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 70 K 7.96 3.89 0.00 1.95 1.89 0.00 1.82 0.00 0.00 1.55 0.00 0.00 2.98 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.75 7.81 71 R 7.79 3.86 0.00 2.13 2.04 0.00 3.10 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 72 M 8.18 4.11 0.00 2.20 2.21 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.62 0.00 73 I 8.08 3.84 2.14 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.75 1.10 0.00 0.00 74 A 8.29 4.13 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 75 I 8.31 3.71 1.90 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 1.54 1.62 1.03 0.00 0.00 76 S 8.21 4.16 0.00 4.18 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 77 A 8.07 3.80 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 78 K 8.30 3.93 0.00 1.88 1.88 0.00 1.70 0.00 0.00 1.59 0.00 0.00 2.92 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.48 1.65 7.81 79 V 8.23 3.56 2.34 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 1.05 0.00 0.00 1.01 0.00 0.00 80 A 8.41 4.31 1.15 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 0.00 0.00 81 R 7.66 4.11 0.00 1.72 2.08 0.00 3.05 0.00 0.00 3.01 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.39 0.00 82 D 8.29 4.53 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 83 I 8.22 3.68 2.00 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 1.40 0.60 1.14 0.00 0.00 84 G 7.25 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 0.00 0.00 0.00 85 E 8.44 4.13 0.00 2.11 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 0.00 2.27 2.34 0.00 86 R 7.93 4.03 0.00 1.83 2.04 0.00 3.40 0.00 0.00 3.23 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.60 0.00 87 S 7.58 4.08 0.00 3.96 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 88 E 8.46 4.35 0.00 1.89 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.48 0.00 89 I 7.31 4.14 0.59 0.00 0.00 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.24 -0.33 0.00 0.00 90 R 7.75 4.19 0.00 1.71 1.93 0.00 3.07 0.00 0.00 3.28 7.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.60 0.00 91 W 8.03 3.94 0.00 3.27 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 92 E 8.36 4.29 0.00 2.32 2.40 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 2.40 2.42 0.00 93 E 8.29 3.97 0.00 2.21 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 2.27 2.36 0.00 94 S 7.69 4.04 0.00 3.75 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 95 F 8.04 4.13 0.00 3.21 2.79 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 96 T 8.07 4.00 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 1.27 0.00 0.00 97 I 7.53 3.69 1.97 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 1.41 1.28 0.96 0.00 0.00 98 L 8.31 3.93 0.00 1.80 1.51 0.93 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 99 F 8.32 4.73 0.00 3.26 3.08 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 0.00 100 R 7.92 3.95 0.00 2.10 2.17 0.00 3.27 0.00 0.00 3.26 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.71 0.00 101 M 7.90 4.38 0.00 2.13 2.28 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 2.82 2.94 0.00 102 I 7.94 4.67 2.08 0.00 0.00 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 2.11 1.60 1.04 0.00 0.00 103 E 8.08 2.00 0.00 1.28 1.88 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 2.20 2.07 0.00 104 T 7.66 3.41 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 0.59 0.00 0.00 105 Y 7.87 4.57 0.00 3.20 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 0.00 106 F 8.69 4.65 0.00 3.01 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 0.00 107 D 8.24 4.44 0.00 2.73 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 0.00 108 D 8.20 4.46 0.00 2.85 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 0.00 109 L 8.20 4.08 0.00 2.03 1.79 1.19 0.71 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 0.00 110 M 8.26 4.21 0.00 2.28 2.18 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 2.69 2.64 0.00 111 I 7.77 3.85 1.89 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.66 0.98 0.00 0.00 112 D 8.15 4.34 0.00 2.80 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 0.00 113 L 7.67 4.32 0.00 1.20 0.44 0.84 0.46 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 0.00 114 Y 8.17 4.87 0.00 3.03 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 G 7.96 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