NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 M 4.5308 8.3044 120.2865 55.2782 33.9112 174.1503 3 V 4.1358 8.0334 121.0380 59.5504 33.0652 173.3317 4 W 4.4612 9.1177 135.0000 57.5881 31.9767 174.5703 5 T 4.1296 7.9486 121.9068 61.0651 67.2812 172.5299 6 P 4.5423 0.0000 0.0000 63.1827 32.1802 175.6091 7 V 4.0992 7.4674 119.8352 62.7003 32.8276 175.2686 8 N 4.1823 8.6107 125.2244 54.9676 36.1929 173.4804 9 N 5.0400 7.6112 109.0745 52.9285 39.9945 174.1965 10 K 4.1784 8.3315 116.4635 56.5365 32.8897 176.6293 11 M 5.0426 8.3637 120.5101 53.9265 35.2526 175.2488 12 F 4.5996 8.2637 116.5904 57.2682 41.1537 176.7378 13 E 3.5328 8.3948 121.1994 56.9730 27.4922 175.2610 14 T 3.8277 8.3944 121.9540 66.6829 68.8337 174.1726 15 F 4.5550 9.0730 124.3205 57.5771 36.7542 176.3667 16 S 4.4917 8.2350 114.6376 60.3202 62.9797 174.4213 17 Y 4.4531 8.3278 117.6178 58.0449 38.0726 174.9120 18 L 4.7848 7.6138 120.1904 51.9484 44.0043 174.5381 19 P 4.4215 0.0000 0.0000 61.9405 31.8006 175.0254 20 P 4.3382 0.0000 0.0000 62.7925 31.8213 176.2792 21 L 4.0327 8.2827 122.0274 54.5475 42.2703 178.0144 22 T 4.2140 8.1908 114.2960 61.3499 71.1431 175.1856 23 D 4.3942 8.4678 120.2543 57.2698 40.7750 178.6075 24 E 3.9825 8.0882 119.6485 59.2313 29.7764 178.7278 25 Q 3.9357 7.8968 117.8499 58.7205 28.6881 178.5714 26 I 3.7180 7.8953 120.6866 64.3426 37.1085 178.1915 27 A 4.0148 8.1179 121.3819 55.1907 18.1600 179.5257 28 A 3.9541 7.9998 119.1101 55.4726 18.4670 179.9017 29 Q 4.0894 8.0489 116.4045 59.1145 28.8125 179.1345 30 V 3.7438 8.2575 119.4531 66.2783 31.5108 177.7634 31 D 4.4435 8.5163 118.8093 57.5839 40.1730 178.2532 32 Y 4.1986 8.1501 120.1031 60.5714 38.8048 177.9443 33 I 3.9582 7.9973 120.8353 64.5719 37.4299 178.6434 34 V 3.5277 7.9410 118.6930 65.9482 31.1809 177.8011 35 A 3.9286 8.0741 119.7387 54.6580 18.2264 178.3443 36 N 4.0950 7.0575 111.6086 52.2061 38.7790 175.8111 37 G 3.7295 7.2282 108.1222 45.8506 0.0000 173.9148 38 W 4.9999 7.4868 118.7550 55.9751 30.7423 176.2060 39 I 4.4107 8.8614 123.2115 59.4994 38.0079 173.9721 40 P 4.9091 0.0000 0.0000 62.8695 32.7150 175.1658 41 C 5.0111 8.8949 121.7496 58.3166 35.7397 172.3713 42 L 5.2999 8.7709 123.7324 53.1682 44.3245 175.1971 43 E 5.6028 9.2357 121.5509 54.8054 33.7811 174.7898 44 F 5.6444 9.2394 116.4343 55.7792 42.1345 173.1200 45 A 4.5361 8.3601 120.6527 50.0585 22.6014 176.2277 46 E 4.2450 8.7103 119.1769 55.8281 30.5209 177.6612 47 A 4.2721 8.8147 123.1392 55.8961 18.3506 179.1112 48 D 4.5788 8.1544 113.1654 56.2999 41.0948 177.1696 49 K 4.6178 7.9554 117.4786 56.0477 32.5802 176.7355 50 A 3.9601 7.9218 123.9608 53.5178 19.4429 178.1025 51 Y 4.6132 7.4374 111.5162 55.6341 40.0026 175.7175 52 V 3.8194 8.3941 122.3685 63.9204 32.0318 175.3357 53 S 4.7682 8.8495 119.8243 57.4407 66.1666 173.6102 54 N 5.1960 8.5594 114.3515 52.6911 39.9371 176.1243 55 E 3.9651 8.3385 117.9899 59.5210 29.8315 179.4630 56 S 4.1084 8.6788 115.3200 60.7834 62.7047 176.0962 57 A 2.5800 7.7226 123.3478 53.7102 17.7164 179.0239 58 I 3.4914 6.8376 115.4601 63.9960 37.9876 177.2447 59 R 4.2054 7.5745 116.4590 56.0993 30.5806 176.4895 60 F 4.9579 7.3502 118.2587 56.1930 40.7918 178.1046 61 G 3.9653 8.2901 114.9090 46.0288 0.0000 175.2652 62 S 4.5986 8.4252 113.9565 58.2131 61.7474 174.3523 63 V 4.4416 7.2144 107.5510 61.1514 33.1966 177.5406 64 S 4.5257 8.1970 114.4869 59.2459 63.6233 173.2783 65 C 4.0474 8.0137 119.3595 61.4335 27.8751 173.1285 66 L 3.6482 8.4634 123.4535 55.6458 38.7707 173.2398 67 Y 4.4373 7.6397 119.7612 55.9496 39.9755 174.6335 68 Y 4.7895 7.1813 123.3486 56.1964 42.2812 174.8137 69 D 4.4426 8.7184 123.4762 55.4686 41.6404 176.8111 70 N 4.3966 8.8982 116.9150 54.2642 35.9251 176.1002 71 R 3.9234 7.9932 118.6298 59.3823 30.3390 177.1717 72 Y 4.3581 7.6722 114.5602 57.9921 38.3484 175.3250 73 W 5.1008 8.6698 124.4294 55.4876 32.6770 174.5086 74 T 4.3556 8.1251 116.9511 62.5543 69.7531 174.4003 75 M 4.6683 8.4584 126.3205 55.1554 33.1861 175.3166 76 W 4.7914 9.7324 135.0000 56.1457 31.0971 176.9446 77 K 3.4659 8.5478 129.5493 57.6002 30.2948 178.3264 78 L 4.9117 8.2355 125.2919 52.6560 44.9972 174.0604 79 P 4.3557 0.0000 0.0000 63.3728 32.0530 177.5973 80 M 4.3035 8.6793 123.1540 53.8267 30.3439 175.1631 81 F 4.4551 7.4336 118.8050 58.8486 39.9186 176.2429 82 G 3.9627 9.1851 113.2947 45.4678 0.0000 172.5400 83 C 4.3331 7.7995 120.4230 59.1498 31.6890 173.2660 84 R 4.4693 8.6736 124.3189 55.7134 30.9794 174.7830 85 D 4.8203 7.7892 118.9651 51.7855 42.1050 174.7560 86 P 4.3474 0.0000 0.0000 66.0119 31.3300 178.5378 87 M 4.1344 8.2294 117.0689 58.2735 31.7864 178.3740 88 Q 4.0037 8.0230 119.5040 58.9512 29.2160 178.4540 89 V 3.5855 7.7362 118.7779 66.1500 31.7657 177.6820 90 L 4.0195 7.9136 118.6991 58.1618 41.4366 179.9230 91 R 4.0108 8.2197 117.7757 59.1374 29.8779 178.9442 92 E 4.1376 8.0536 118.3324 59.0790 29.4706 179.1372 93 I 3.5249 7.8218 120.0170 64.3164 37.2269 178.3501 94 V 3.4634 7.7007 118.5608 66.1220 31.4014 177.7709 95 A 3.9514 8.0051 120.3086 55.2620 18.1877 179.2469 96 C 2.0000 7.7482 117.5525 62.1318 31.3790 176.0067 97 T 3.7500 7.6105 111.2330 64.3074 68.0008 176.4554 98 K 3.8202 7.6848 121.9181 59.2758 32.2953 178.4061 99 A 3.9686 7.4991 120.0371 53.4628 19.6988 177.6480 100 F 4.6836 7.7107 115.9461 54.9669 38.9906 174.0003 101 P 4.4402 0.0000 0.0000 64.1325 31.8996 177.8984 102 D 4.6611 8.0743 116.8705 53.8876 41.1658 175.4047 103 A 4.7775 7.2724 121.2887 50.3385 21.5199 176.8448 104 Y 4.2897 8.5649 117.5784 57.7544 39.6031 175.2388 105 V 5.2215 8.9918 122.9192 61.2604 35.3040 174.2131 106 R 5.0110 9.5024 123.8832 54.2793 33.0263 173.8136 107 L 4.8423 8.0428 123.2107 53.8419 43.9412 175.7153 108 V 4.8590 8.5510 118.2795 59.5473 36.3194 174.0970 109 A 4.9040 7.9307 121.7038 50.6173 22.8399 175.2490 110 F 5.2278 9.0268 119.5150 55.7156 42.6822 174.1187 111 D 5.3931 8.8629 122.6888 52.7650 42.3363 176.6433 112 N 4.7355 9.1655 123.1138 54.3301 38.4114 176.4275 113 Q 4.1836 8.4985 118.5017 58.9443 28.9699 177.6419 114 K 4.0244 8.3026 114.8528 57.1061 32.9589 176.5990 115 Q 3.4142 8.0252 118.2489 56.0721 27.0271 172.6548 116 V 4.5440 7.8163 117.5092 59.9172 35.0871 174.4594 117 Q 4.2861 8.6968 123.0408 56.4870 29.3364 175.5519 118 I 4.2142 7.9755 124.4370 61.0686 39.6688 174.3309 119 M 4.4209 6.5729 117.1875 54.4365 34.1830 173.7259 120 G 4.9484 8.2767 110.2760 47.2473 0.0000 172.0742 121 F 5.0930 7.0898 117.1062 55.2157 41.3069 172.9099 122 L 4.6151 8.8224 122.7989 55.6003 41.9887 176.7847 123 V 4.5148 9.0088 118.4223 61.5695 34.0413 175.7446 124 Q 4.6266 7.8453 121.1880 54.3763 32.4612 173.3303 125 R 4.3312 8.1372 121.6235 52.9591 32.6002 173.5600 126 P 4.2105 0.0000 0.0000 62.7017 31.7879 177.5881 127 K 4.1150 8.4233 119.5135 59.0324 32.1642 178.1404 128 T 4.1553 7.7392 106.9791 62.0774 69.4587 174.8212 129 A 4.2087 7.7066 126.3654 52.9155 18.5337 177.3333 130 R 4.5970 8.8280 120.4517 56.0377 31.5473 175.5896 131 D 4.9352 8.3606 117.3364 52.7236 39.7561 175.5508 132 F 5.3015 7.8284 112.9534 55.5471 40.9542 173.7741 133 Q 4.4139 8.3617 120.5694 53.1046 31.0202 174.1461 134 P 4.4817 0.0000 0.0000 62.4110 32.1289 177.1358 135 A 3.9435 8.8091 123.7927 55.6370 18.2423 179.2589 136 N 4.6244 8.0626 109.1269 53.7879 37.8857 175.5017 137 K 4.4279 7.9358 118.0767 56.3872 32.7511 177.4098 138 R 3.5272 7.6258 121.2880 57.8606 30.0735 176.7946 139 S 5.1448 7.4993 109.7764 56.3210 65.8936 174.2395 140 V 3.9886 8.4790 114.2243 61.7117 32.0910 175.7318 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 2 M 8.30 4.53 0.00 1.98 2.15 0.00 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.58 0.00 3 V 8.03 4.14 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 1.11 0.00 0.00 0.97 0.00 0.00 4 W 9.12 4.46 0.00 3.43 3.04 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 0.00 0.00 0.00 5 T 7.95 4.13 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 0.98 0.00 0.00 6 P 0.00 4.54 0.00 2.23 2.19 0.00 3.78 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.96 0.00 7 V 7.47 4.10 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 0.77 0.00 0.00 0.91 0.00 0.00 8 N 8.61 4.18 0.00 2.88 2.89 0.00 0.00 6.81 8.00 0.00 0.00 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 N 7.61 5.04 0.00 2.64 2.70 0.00 0.00 7.30 6.68 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 10 K 8.33 4.18 0.00 1.95 1.55 0.00 0.61 0.00 0.00 1.25 0.00 0.00 2.56 0.00 0.00 2.55 0.00 0.00 0.00 0.00 1.35 1.36 7.81 11 M 8.36 5.04 0.00 2.13 2.13 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 2.54 2.67 0.00 12 F 8.26 4.60 0.00 3.14 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 13 E 8.39 3.53 0.00 2.14 1.75 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 2.18 2.13 0.00 14 T 8.39 3.83 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 0.04 0.00 0.00 15 F 9.07 4.56 0.00 3.29 3.15 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 16 S 8.23 4.49 0.00 4.16 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 0.00 17 Y 8.33 4.45 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 18 L 7.61 4.78 0.00 1.84 1.59 0.87 1.09 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 19 P 0.00 4.42 0.00 2.03 2.00 0.00 3.70 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.13 0.00 20 P 0.00 4.34 0.00 2.04 2.01 0.00 3.70 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.17 0.00 21 L 8.28 4.03 0.00 1.61 1.51 0.35 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 22 T 8.19 4.21 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 1.18 0.00 0.00 23 D 8.47 4.39 0.00 2.71 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 24 E 8.09 3.98 0.00 2.02 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 2.39 0.00 25 Q 7.90 3.94 0.00 2.31 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.58 0.00 0.00 0.00 0.00 0.00 2.25 2.32 0.00 26 I 7.90 3.72 2.05 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.71 1.07 0.00 0.00 27 A 8.12 4.01 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 28 A 8.00 3.95 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 29 Q 8.05 4.09 0.00 2.47 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.75 0.00 0.00 0.00 0.00 0.00 2.34 1.91 0.00 30 V 8.26 3.74 2.32 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 1.10 0.00 0.00 1.08 0.00 0.00 31 D 8.52 4.44 0.00 2.98 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 32 Y 8.15 4.20 0.00 3.11 3.34 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 33 I 8.00 3.96 2.18 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.03 1.09 0.00 0.00 34 V 7.94 3.53 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 1.03 0.00 0.00 0.96 0.00 0.00 35 A 8.07 3.93 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 36 N 7.06 4.09 0.00 1.44 1.42 0.00 0.00 7.06 7.53 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 37 G 7.23 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 0.00 0.00 0.00 38 W 7.49 5.00 0.00 3.38 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 39 I 8.86 4.41 2.13 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.00 0.83 0.00 0.00 40 P 0.00 4.91 0.00 2.10 1.99 0.00 3.80 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.14 0.00 41 C 8.89 5.01 0.00 3.12 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 42 L 8.77 5.30 0.00 1.88 1.65 0.88 0.79 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 43 E 9.24 5.60 0.00 2.04 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 2.35 2.33 0.00 44 F 9.24 5.64 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 45 A 8.36 4.54 -0.22 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 0.00 0.00 0.00 46 E 8.71 4.25 0.00 2.18 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 2.31 2.28 0.00 47 A 8.81 4.27 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 48 D 8.15 4.58 0.00 2.70 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 49 K 7.96 4.62 0.00 1.52 1.69 0.00 1.70 0.00 0.00 1.86 0.00 0.00 2.99 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.34 1.43 7.81 50 A 7.92 3.96 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.44 4.61 0.00 2.93 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 52 V 8.39 3.82 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 0.67 0.00 0.00 0.80 0.00 0.00 53 S 8.85 4.77 0.00 4.07 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 54 N 8.56 5.20 0.00 2.76 2.84 0.00 0.00 6.58 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 55 E 8.34 3.97 0.00 2.11 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 2.39 2.31 0.00 56 S 8.68 4.11 0.00 4.11 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 57 A 7.72 2.58 1.16 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 0.00 0.00 58 I 6.84 3.49 1.79 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 1.48 0.81 0.88 0.00 0.00 59 R 7.57 4.21 0.00 1.90 2.01 0.00 3.20 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 1.61 1.67 0.00 60 F 7.35 4.96 0.00 2.99 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 61 G 8.29 3.97 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 0.00 0.00 0.00 62 S 8.43 4.60 0.00 3.86 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 63 V 7.21 4.44 1.83 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 0.65 0.00 0.00 0.44 0.00 0.00 64 S 8.20 4.53 0.00 4.12 4.29 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 0.00 0.00 0.00 65 C 8.01 4.05 0.00 2.97 2.95 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 66 L 8.46 3.65 0.00 1.80 1.80 0.94 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 67 Y 7.64 4.44 0.00 2.93 3.03 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 68 Y 7.18 4.79 0.00 2.78 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 69 D 8.72 4.44 0.00 2.78 2.65 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 0.00 0.00 0.00 0.00 70 N 8.90 4.40 0.00 3.06 3.23 0.00 0.00 6.99 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 71 R 7.99 3.92 0.00 1.49 1.67 0.00 3.07 0.00 0.00 3.24 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.55 0.00 72 Y 7.67 4.36 0.00 3.06 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 73 W 8.67 5.10 0.00 3.07 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 74 T 8.13 4.36 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 0.91 0.00 0.00 75 M 8.46 4.67 0.00 2.07 2.02 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 2.69 2.78 0.00 76 W 9.73 4.79 0.00 3.68 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 77 K 8.55 3.47 0.00 1.66 0.82 0.00 1.54 0.00 0.00 1.54 0.00 0.00 2.78 0.00 0.00 2.49 0.00 0.00 0.00 0.00 0.84 0.21 7.81 78 L 8.24 4.91 0.00 1.59 1.56 1.00 1.02 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 79 P 0.00 4.36 0.00 0.69 1.81 0.00 3.61 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 2.10 0.00 80 M 8.68 4.30 0.00 2.05 2.02 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.54 0.00 81 F 7.43 4.46 0.00 3.12 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 82 G 9.19 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 83 C 7.80 4.33 0.00 2.97 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 84 R 8.67 4.47 0.00 1.81 1.89 0.00 3.23 0.00 0.00 3.16 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.59 0.00 85 D 7.79 4.82 0.00 2.74 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 86 P 0.00 4.35 0.00 2.22 2.21 0.00 3.67 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.21 0.00 87 M 8.23 4.13 0.00 2.04 2.25 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 2.70 2.56 0.00 88 Q 8.02 4.00 0.00 2.25 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.81 0.00 0.00 0.00 0.00 0.00 2.40 2.40 0.00 89 V 7.74 3.59 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 1.05 0.00 0.00 0.98 0.00 0.00 90 L 7.91 4.02 0.00 1.91 1.73 0.95 1.06 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 91 R 8.22 4.01 0.00 2.06 2.01 0.00 3.14 0.00 0.00 3.18 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.89 0.00 92 E 8.05 4.14 0.00 2.20 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 0.00 2.60 2.65 0.00 93 I 7.82 3.52 2.00 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 1.36 0.79 0.86 0.00 0.00 94 V 7.70 3.46 2.19 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 0.97 0.00 0.00 0.94 0.00 0.00 95 A 8.01 3.95 1.52 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 0.00 0.00 96 C 7.75 2.00 0.00 1.36 2.43 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 97 T 7.61 3.75 4.35 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 1.13 0.00 0.00 98 K 7.68 3.82 0.00 1.79 1.96 0.00 1.75 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.37 1.38 7.81 99 A 7.50 3.97 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 0.00 100 F 7.71 4.68 0.00 2.81 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 0.00 101 P 0.00 4.44 0.00 2.12 2.10 0.00 3.26 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.87 0.00 102 D 8.07 4.66 0.00 2.68 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 0.00 103 A 7.27 4.78 1.29 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 0.00 0.00 0.00 0.00 0.00 104 Y 8.56 4.29 0.00 2.53 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 0.00 105 V 8.99 5.22 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 0.88 0.00 0.00 0.90 0.00 0.00 106 R 9.50 5.01 0.00 1.83 1.95 0.00 2.29 0.00 0.00 2.25 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.36 0.00 107 L 8.04 4.84 0.00 1.51 0.72 0.89 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 108 V 8.55 4.86 1.64 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 0.52 0.00 0.00 0.51 0.00 0.00 109 A 7.93 4.90 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 0.00 110 F 9.03 5.23 0.00 3.01 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 0.00 111 D 8.86 5.39 0.00 2.42 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 0.00 112 N 9.17 4.74 0.00 2.94 3.06 0.00 0.00 6.33 7.39 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 0.00 113 Q 8.50 4.18 0.00 2.31 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 7.05 0.00 0.00 0.00 0.00 0.00 2.46 2.54 0.00 114 K 8.30 4.02 0.00 1.76 1.87 0.00 2.11 0.00 0.00 1.62 0.00 0.00 2.95 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.47 1.47 7.81 115 Q 8.03 3.41 0.00 2.12 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.72 0.00 0.00 0.00 0.00 0.00 2.26 2.31 0.00 116 V 7.82 4.54 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 0.51 0.00 0.00 0.91 0.00 0.00 117 Q 8.70 4.29 0.00 2.11 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.86 0.00 0.00 0.00 0.00 0.00 2.17 1.93 0.00 118 I 7.98 4.21 1.20 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.23 0.26 -0.47 0.00 0.00 119 M 6.57 4.42 0.00 2.11 2.22 0.00 0.00 0.00 0.00 0.00 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.66 0.00 120 G 8.28 4.95 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 0.00 0.00 0.00 121 F 7.09 5.09 0.00 3.23 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 0.00 122 L 8.82 4.62 0.00 1.70 1.66 0.92 0.33 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 0.00 123 V 9.01 4.51 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 0.70 0.00 0.00 0.93 0.00 0.00 124 Q 7.85 4.63 0.00 2.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.83 0.00 0.00 0.00 0.00 0.00 2.27 2.23 0.00 125 R 8.14 4.33 0.00 1.22 1.49 0.00 2.27 0.00 0.00 2.92 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.24 0.00 126 P 0.00 4.21 0.00 2.10 2.16 0.00 2.20 0.00 0.00 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.58 0.00 127 K 8.42 4.11 0.00 1.74 1.91 0.00 1.72 0.00 0.00 1.74 0.00 0.00 2.99 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.43 1.38 7.81 128 T 7.74 4.16 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 1.22 0.00 0.00 129 A 7.71 4.21 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 0.00 130 R 8.83 4.60 0.00 1.80 1.90 0.00 3.37 0.00 0.00 3.27 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.54 0.00 131 D 8.36 4.94 0.00 2.91 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 0.00 132 F 7.83 5.30 0.00 3.20 3.15 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 0.00 133 Q 8.36 4.41 0.00 1.88 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 7.04 0.00 0.00 0.00 0.00 0.00 2.31 2.04 0.00 134 P 0.00 4.48 0.00 2.20 2.18 0.00 3.55 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.87 0.00 135 A 8.81 3.94 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 0.00 136 N 8.06 4.62 0.00 2.83 2.94 0.00 0.00 5.88 7.13 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 0.00 137 K 7.94 4.43 0.00 1.59 1.71 0.00 1.61 0.00 0.00 1.64 0.00 0.00 2.91 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.31 1.29 7.81 138 R 7.63 3.53 0.00 1.77 0.66 0.00 3.11 0.00 0.00 3.18 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.18 0.00 139 S 7.50 5.14 0.00 4.01 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 0.00 140 V 8.48 3.99 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 0.61 0.00 0.00 0.94 0.00 0.00