NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 D 4.5779 8.3649 120.1953 54.2224 42.1715 175.0320 4 L 4.0348 8.6785 125.2641 53.2828 41.1006 173.0669 5 V 3.2203 7.0571 115.3536 62.2683 33.6817 171.2445 6 D 4.8274 7.3774 117.6041 52.5399 43.3872 176.7975 7 T 3.9533 8.3385 124.1578 66.6426 68.6180 176.4698 8 T 3.7896 7.7887 116.9294 67.2174 68.2654 176.2030 9 E 4.0906 8.2566 119.6582 59.4378 29.4282 179.0968 10 M 4.2829 8.4916 118.9703 57.8841 32.3363 178.2029 11 Y 4.1334 8.0750 116.7012 60.5939 38.0115 178.1488 12 L 4.0455 8.1423 120.2382 57.9209 41.9149 179.2714 13 R 3.9700 7.9966 118.5437 59.6957 29.7944 178.7661 14 T 3.8566 8.1000 115.4990 66.6972 68.6382 176.6582 15 I 3.6708 7.7254 121.7198 64.7508 37.0431 177.9464 16 Y 4.0423 8.5499 120.4338 60.4784 38.3068 177.8172 17 E 4.1045 8.0269 119.0588 58.8823 29.8496 178.6637 18 L 4.1101 8.1192 119.4940 57.6638 41.6853 179.2560 19 E 3.8252 7.9364 118.1645 59.5794 29.2554 178.8607 20 E 4.0162 7.2932 117.9996 58.5374 29.4484 177.8307 21 E 4.5659 7.6023 114.7925 55.8720 30.1507 176.8400 22 G 4.0058 8.4989 110.3671 45.9644 0.0000 175.0517 23 V 3.5898 7.4095 118.1891 63.2997 31.9840 175.3162 24 T 4.3009 8.2659 122.7806 62.0284 69.1543 172.6116 25 P 4.3158 0.0000 0.0000 63.2996 32.3707 175.2738 26 L 5.0640 8.2596 123.8333 52.0135 45.6739 177.8473 27 R 3.8568 8.9882 121.1797 59.8159 30.1286 178.9178 28 A 4.0850 8.0701 119.5910 55.2884 18.2447 179.8288 29 R 3.9963 8.3765 116.7575 59.5650 30.1078 179.3187 30 I 3.5436 7.5513 118.8570 64.1907 37.1831 178.0578 31 A 3.9601 8.3609 122.0176 55.2834 18.3057 179.6437 32 E 3.9188 7.9610 116.5484 59.5583 29.3535 179.8284 33 R 4.0011 7.8382 116.9615 59.0627 30.3265 178.4521 34 L 4.2770 8.0460 115.7809 54.1349 42.0900 176.5389 35 E 3.8210 7.6566 116.4626 57.6505 27.5232 174.2143 36 Q 4.7637 7.6313 115.6909 53.5869 31.7829 176.7057 37 S 4.4634 8.4148 115.3659 58.1953 64.9928 175.8339 38 G 3.5708 8.4882 109.0964 47.7920 0.0000 174.3696 39 P 4.3243 0.0000 0.0000 65.0939 31.2816 178.5882 40 T 3.8715 8.0182 114.7523 66.9579 68.4436 176.4053 41 V 4.2902 7.8901 121.0032 65.8351 31.2209 178.3499 42 S 4.1912 8.2230 114.7656 61.5633 62.5310 176.3537 43 Q 4.0315 8.5463 122.5852 59.1059 28.8748 178.1961 44 T 3.8430 8.2357 117.2933 66.4668 68.4780 177.0115 45 V 3.7844 8.1000 119.9131 65.5120 31.4274 178.0630 46 A 3.9630 7.6519 120.7458 55.1210 18.1834 179.5517 47 R 3.8456 7.6330 116.6527 59.9717 30.1316 179.0815 48 M 3.8114 7.8560 117.6720 58.3680 31.9026 178.6166 49 E 4.4634 8.0486 120.6329 58.7784 29.7039 178.4664 50 R 3.9184 8.0393 117.7176 59.7964 30.1251 177.8946 51 D 4.6966 8.7109 114.8401 53.4433 41.0234 176.4754 52 G 4.0768 8.1950 107.3110 46.8214 0.0000 174.6476 53 L 4.5637 8.7510 120.2739 55.7832 44.2511 178.4371 54 V 4.9750 7.5107 110.4801 59.8215 36.0760 174.3490 55 V 4.4655 9.6292 125.5800 61.5962 33.8290 175.1784 56 V 4.4793 8.6046 127.5876 60.9773 30.8914 175.4378 57 A 4.2202 8.6879 130.6688 51.6736 19.1685 178.6820 58 S 4.1146 8.8152 115.9145 62.0188 63.0667 176.3406 59 D 4.3986 8.0471 115.4863 54.0385 38.7433 177.4572 60 R 3.9219 8.1853 117.8463 56.7468 28.6174 176.4248 61 S 4.6756 7.3734 112.9787 58.0768 64.8745 173.1139 62 L 4.8526 8.3372 121.6076 53.9650 42.3525 176.4859 63 Q 4.5211 9.7094 125.2022 54.0579 30.3908 175.0594 64 M 4.7650 8.6049 124.9084 55.6251 32.5802 177.0194 65 T 4.3265 8.8323 114.6061 60.3422 70.5735 173.8452 66 P 4.2045 0.0000 0.0000 66.8939 30.7744 178.3283 67 T 3.9269 8.0098 114.9180 66.0968 68.3965 176.2475 68 G 3.9023 7.9585 106.9473 48.1153 0.0000 175.1929 69 R 3.9565 8.7248 121.5632 59.6571 29.9235 178.3828 70 T 3.8590 8.0092 114.2924 67.0117 68.6375 176.1322 71 L 4.0522 8.2358 120.3424 57.6005 41.7504 179.0127 72 A 3.9072 8.3807 121.1747 55.8651 18.2612 179.8766 73 T 3.4102 8.1032 107.8780 64.4416 68.7625 176.8350 74 A 3.8647 8.0696 123.8441 54.9309 18.3577 179.4120 75 V 3.4710 7.7421 116.1884 66.4813 31.3843 177.3616 76 M 4.1117 7.6800 117.5635 58.8071 31.8614 177.8014 77 R 3.8586 7.9537 118.4396 59.6427 30.2253 178.4080 78 K 3.9257 8.3612 118.2756 59.6802 32.0812 178.5287 79 H 3.9832 9.1034 119.5215 59.5011 29.7368 177.2878 80 R 3.9269 8.3161 119.7442 59.3557 29.9822 178.9623 81 L 3.9575 8.2437 118.7547 57.8352 41.5750 179.5831 82 A 3.9949 8.5731 120.7999 55.2142 18.3609 179.3023 83 E 3.7248 8.0930 117.0904 59.7460 29.4692 179.9121 84 R 3.8358 7.9479 117.7847 59.0587 30.1395 178.4520 85 L 3.8814 7.8548 120.0153 58.5643 42.0096 179.0766 86 L 3.8057 7.8886 118.4085 58.4262 41.5572 179.2929 87 T 3.8112 7.9554 115.4313 67.3192 68.1972 175.9456 88 D 4.3301 8.7755 121.1486 58.2534 41.3733 179.0577 89 I 3.9576 7.4844 119.3919 64.2324 37.5375 178.4808 90 I 3.7600 8.2743 121.6122 62.5162 37.2049 176.7878 91 G 4.4749 7.5167 106.3817 45.7472 0.0000 173.6536 92 L 4.0272 7.6457 119.8904 53.8372 42.8604 175.9141 93 D 4.2811 8.5836 122.2971 54.4988 41.5125 176.8263 94 I 3.7152 8.6151 127.6562 64.2378 37.9876 177.1206 95 N 4.4985 8.2912 115.9869 55.0569 38.3470 176.1806 96 K 4.4351 8.2848 116.5499 56.1054 32.6483 178.2031 97 V 3.4879 7.2439 119.6117 66.0999 31.3359 177.3811 98 H 4.0397 8.0693 117.4638 59.3846 29.7244 176.6305 99 D 4.4573 8.0134 117.6738 56.0101 40.9588 177.7464 100 E 4.1839 7.6422 118.4485 58.6982 29.9658 178.1560 101 A 3.7451 7.7534 120.9097 55.2538 18.1608 178.9552 102 D 4.5263 8.3414 115.6522 57.0769 41.2104 178.1505 103 R 4.5385 8.2466 118.0633 58.1197 31.1549 178.5664 104 W 4.2608 8.5674 118.2530 59.4782 28.7381 178.0807 105 E 3.9821 8.0454 117.3114 59.7206 28.9781 178.4993 106 H 4.7467 7.9918 116.9347 56.1371 29.0871 176.2467 107 V 4.1915 7.4838 117.8200 61.4665 32.7163 175.5970 108 M 4.1937 7.9976 121.5063 55.0988 32.8616 176.2687 109 S 4.6550 8.2122 120.2977 57.2881 66.2978 175.1561 110 D 4.2997 8.3826 121.6740 57.2342 40.5429 178.3109 111 E 4.0596 8.2155 119.4728 59.6529 29.5835 179.1247 112 V 3.6082 7.5040 117.5523 66.2750 31.5331 176.7604 113 E 3.9310 8.4274 119.4448 59.1981 29.1514 178.6485 114 R 3.9643 9.0101 120.9163 59.5115 30.6628 179.3056 115 R 4.0549 8.0804 117.6757 59.2982 30.2321 178.8934 116 L 4.0601 8.4631 120.5350 57.7542 41.7583 179.0640 117 V 3.6599 7.6358 118.8013 65.2913 31.0964 177.2558 118 K 4.1833 8.0024 117.9887 56.6874 32.1418 178.5418 119 V 3.5823 7.3388 121.4371 66.0714 32.4002 176.1705 120 L 4.1267 7.7931 124.6450 55.4597 41.8018 176.4378 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 D 8.36 4.58 0.00 2.65 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 4 L 8.68 4.03 0.00 1.74 1.65 0.97 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 5 V 7.06 3.22 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 0.72 0.00 0.00 0.99 0.00 0.00 6 D 7.38 4.83 0.00 2.62 2.44 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 7 T 8.34 3.95 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 0.73 0.00 0.00 8 T 7.79 3.79 4.32 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 1.21 0.00 0.00 9 E 8.26 4.09 0.00 2.02 2.12 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 2.37 2.49 0.00 10 M 8.49 4.28 0.00 2.10 2.31 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.78 0.00 11 Y 8.08 4.13 0.00 3.16 3.05 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 12 L 8.14 4.05 0.00 2.05 1.75 1.00 0.80 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 13 R 8.00 3.97 0.00 1.92 1.98 0.00 3.02 0.00 0.00 3.25 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.66 0.00 14 T 8.10 3.86 4.32 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 1.14 0.00 0.00 15 I 7.73 3.67 2.05 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 1.39 1.37 0.93 0.00 0.00 16 Y 8.55 4.04 0.00 3.01 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 17 E 8.03 4.10 0.00 2.26 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 2.44 2.69 0.00 18 L 8.12 4.11 0.00 1.82 1.68 0.88 1.14 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 19 E 7.94 3.83 0.00 1.95 1.85 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 2.27 2.48 0.00 20 E 7.29 4.02 0.00 1.91 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 2.26 2.12 0.00 21 E 7.60 4.57 0.00 2.07 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 2.43 2.41 0.00 22 G 8.50 4.01 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 0.00 0.00 0.00 0.00 0.00 0.00 23 V 7.41 3.59 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 0.81 0.00 0.00 0.96 0.00 0.00 24 T 8.27 4.30 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 1.20 0.00 0.00 25 P 0.00 4.32 0.00 2.10 2.20 0.00 3.61 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.98 0.00 26 L 8.26 5.06 0.00 1.54 1.52 0.91 0.98 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 27 R 8.99 3.86 0.00 1.84 2.01 0.00 3.16 0.00 0.00 3.37 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.73 0.00 28 A 8.07 4.08 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 29 R 8.38 4.00 0.00 2.06 1.94 0.00 3.16 0.00 0.00 3.34 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.68 0.00 30 I 7.55 3.54 1.78 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.55 0.15 0.00 0.00 31 A 8.36 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 32 E 7.96 3.92 0.00 2.13 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 2.31 2.61 0.00 33 R 7.84 4.00 0.00 1.74 1.97 0.00 3.30 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.78 0.00 34 L 8.05 4.28 0.00 1.73 1.77 1.15 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 35 E 7.66 3.82 0.00 2.24 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 2.25 2.27 0.00 36 Q 7.63 4.76 0.00 2.12 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.93 0.00 0.00 0.00 0.00 0.00 2.35 2.50 0.00 37 S 8.41 4.46 0.00 4.06 4.02 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 38 G 8.49 3.57 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 0.00 0.00 0.00 39 P 0.00 4.32 0.00 2.18 2.12 0.00 3.64 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.18 0.00 40 T 8.02 3.87 4.45 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 1.25 0.00 0.00 41 V 7.89 4.29 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 1.41 0.00 0.00 1.03 0.00 0.00 42 S 8.22 4.19 0.00 4.07 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 43 Q 8.55 4.03 0.00 2.11 2.38 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 2.34 2.39 0.00 44 T 8.24 3.84 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 0.39 0.00 0.00 45 V 8.10 3.78 2.30 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 1.07 0.00 0.00 1.18 0.00 0.00 46 A 7.65 3.96 1.40 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 0.00 0.00 47 R 7.63 3.85 0.00 1.97 1.97 0.00 3.09 0.00 0.00 3.13 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.67 0.00 48 M 7.86 3.81 0.00 2.11 2.29 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 2.85 2.53 0.00 49 E 8.05 4.46 0.00 2.22 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 2.32 2.29 0.00 50 R 8.04 3.92 0.00 1.81 2.17 0.00 3.31 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 51 D 8.71 4.70 0.00 2.64 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 52 G 8.19 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 53 L 8.75 4.56 0.00 1.69 1.73 0.93 -0.21 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 54 V 7.51 4.97 2.12 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 0.95 0.00 0.00 0.98 0.00 0.00 55 V 9.63 4.47 2.09 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 0.93 0.00 0.00 0.94 0.00 0.00 56 V 8.60 4.48 2.09 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 0.80 0.00 0.00 1.05 0.00 0.00 57 A 8.69 4.22 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 58 S 8.82 4.11 0.00 3.87 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 59 D 8.05 4.40 0.00 2.89 2.90 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 60 R 8.19 3.92 0.00 1.98 2.13 0.00 3.16 0.00 0.00 3.27 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.74 0.00 61 S 7.37 4.68 0.00 4.03 3.98 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 62 L 8.34 4.85 0.00 1.57 1.67 0.94 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 63 Q 9.71 4.52 0.00 1.89 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.56 6.99 0.00 0.00 0.00 0.00 0.00 2.28 2.46 0.00 64 M 8.60 4.77 0.00 1.96 2.07 0.00 0.00 0.00 0.00 0.00 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.61 0.00 65 T 8.83 4.33 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 1.29 0.00 0.00 66 P 0.00 4.20 0.00 2.29 2.40 0.00 3.71 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.10 0.00 67 T 8.01 3.93 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 1.22 0.00 0.00 68 G 7.96 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 69 R 8.72 3.96 0.00 1.99 2.17 0.00 3.18 0.00 0.00 3.24 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.82 0.00 70 T 8.01 3.86 4.42 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 0.00 0.00 0.00 1.21 0.00 0.00 71 L 8.24 4.05 0.00 1.93 1.71 0.93 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 72 A 8.38 3.91 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 73 T 8.10 3.41 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 1.20 0.00 0.00 74 A 8.07 3.86 1.37 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 0.00 0.00 0.00 75 V 7.74 3.47 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 1.08 0.00 0.00 1.01 0.00 0.00 76 M 7.68 4.11 0.00 2.04 1.86 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.44 0.00 77 R 7.95 3.86 0.00 2.19 1.90 0.00 3.33 0.00 0.00 3.16 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 78 K 8.36 3.93 0.00 1.99 1.87 0.00 1.76 0.00 0.00 1.79 0.00 0.00 2.91 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.47 1.45 7.81 79 H 9.10 3.98 0.00 3.36 3.52 0.00 5.79 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 R 8.32 3.93 0.00 1.89 1.99 0.00 3.22 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.85 0.00 81 L 8.24 3.96 0.00 1.92 1.75 0.93 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 82 A 8.57 3.99 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 83 E 8.09 3.72 0.00 2.14 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 0.00 2.22 2.12 0.00 84 R 7.95 3.84 0.00 2.01 1.95 0.00 3.16 0.00 0.00 3.09 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.82 0.00 85 L 7.85 3.88 0.00 1.79 1.95 0.98 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 86 L 7.89 3.81 0.00 1.69 1.47 0.42 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 87 T 7.96 3.81 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 1.18 0.00 0.00 88 D 8.78 4.33 0.00 2.70 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 89 I 7.48 3.96 1.98 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.85 0.93 0.00 0.00 90 I 8.27 3.76 1.90 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.69 0.92 0.00 0.00 91 G 7.52 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 92 L 7.65 4.03 0.00 1.54 1.48 0.88 0.83 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 93 D 8.58 4.28 0.00 2.77 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 94 I 8.62 3.72 1.85 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 1.39 1.43 0.89 0.00 0.00 95 N 8.29 4.50 0.00 2.74 2.85 0.00 0.00 6.81 7.61 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 96 K 8.28 4.44 0.00 1.70 1.78 0.00 1.66 0.00 0.00 1.57 0.00 0.00 3.09 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.35 1.51 7.81 97 V 7.24 3.49 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 0.98 0.00 0.00 0.89 0.00 0.00 98 H 8.07 4.04 0.00 3.28 3.30 0.00 5.92 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 D 8.01 4.46 0.00 2.67 2.73 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 0.00 100 E 7.64 4.18 0.00 1.98 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 2.22 2.30 0.00 101 A 7.75 3.75 1.10 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 0.00 0.00 102 D 8.34 4.53 0.00 2.79 2.90 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 0.00 103 R 8.25 4.54 0.00 2.22 2.16 0.00 3.31 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.74 0.00 104 W 8.57 4.26 0.00 3.31 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 0.00 105 E 8.05 3.98 0.00 2.02 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 0.00 2.55 2.12 0.00 106 H 7.99 4.75 0.00 3.14 3.42 0.00 5.58 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 V 7.48 4.19 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 0.52 0.00 0.00 0.87 0.00 0.00 108 M 8.00 4.19 0.00 2.04 2.12 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.49 0.00 109 S 8.21 4.66 0.00 4.07 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 0.00 110 D 8.38 4.30 0.00 2.70 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 0.00 111 E 8.22 4.06 0.00 1.99 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 2.38 2.32 0.00 112 V 7.50 3.61 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 0.91 0.00 0.00 0.92 0.00 0.00 113 E 8.43 3.93 0.00 2.28 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 2.36 0.00 114 R 9.01 3.96 0.00 1.90 2.01 0.00 3.38 0.00 0.00 3.23 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.84 0.00 115 R 8.08 4.05 0.00 2.13 1.98 0.00 3.30 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.78 0.00 116 L 8.46 4.06 0.00 1.98 1.68 0.96 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 117 V 7.64 3.66 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 0.88 0.00 0.00 0.94 0.00 0.00 118 K 8.00 4.18 0.00 1.86 1.78 0.00 1.74 0.00 0.00 1.63 0.00 0.00 2.99 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.43 1.61 7.81 119 V 7.34 3.58 2.09 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 0.76 0.00 0.00 1.00 0.00 0.00 120 L 7.79 4.13 0.00 1.88 1.55 0.92 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00