NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 T 4.3105 8.1749 117.3726 63.0348 69.8938 173.4804 2 Q 3.8301 8.6569 125.6560 54.3135 29.0907 174.2129 3 D 4.9600 8.2970 122.2841 51.6188 43.6286 176.1333 4 C 4.5856 8.2965 116.4550 56.4754 45.8794 172.3723 5 S 5.1799 7.9917 119.4818 57.6305 65.7128 174.2354 6 F 4.7292 8.8117 119.2725 55.7607 41.1541 176.2578 7 Q 3.9577 9.1013 125.4106 58.7126 28.8305 176.4482 8 H 4.9016 7.8425 113.0128 53.3805 30.8705 174.3635 9 S 4.0395 8.6044 118.6981 57.9172 62.4478 172.3814 10 P 4.2678 0.0000 0.0000 64.3593 31.6681 176.4034 11 I 3.8318 6.6062 120.1256 60.7618 37.1896 176.1371 12 S 4.4995 8.4928 120.2874 57.8374 63.9074 174.2700 13 S 4.4122 8.5677 115.1579 59.9855 62.7940 174.0110 14 D 4.9510 7.5187 120.9023 53.8403 40.9162 178.1390 15 F 4.4903 7.9375 116.3671 59.6223 38.2602 176.1279 16 A 4.0494 6.7930 120.4019 54.1645 18.1100 179.5086 17 V 3.5693 7.2423 116.0228 65.9064 31.6128 178.3104 18 K 4.1484 8.0363 117.2974 58.8734 31.9527 178.8804 19 I 4.0428 7.5215 119.2842 63.4110 37.2016 178.1770 20 R 4.0383 7.7749 117.0049 58.9832 29.1888 178.7572 21 E 4.0258 8.0413 118.9069 58.9212 29.7996 178.6211 22 L 4.1654 7.8120 120.3508 58.2876 42.1547 178.9396 23 S 4.1573 8.2074 112.9556 61.3771 62.0269 175.5237 24 D 4.4862 7.7109 120.0604 55.9903 40.4936 176.3848 25 Y 4.7494 7.7644 115.2809 57.3348 39.0996 175.0402 26 L 4.6049 7.4060 119.7413 52.9652 43.8012 176.9246 27 L 4.3619 8.1838 122.2488 53.7173 40.7862 177.7346 28 Q 4.1085 8.6593 124.5087 58.0681 28.8945 177.9245 29 D 5.1870 7.7946 115.4509 52.2167 40.0353 175.5113 30 Y 4.1470 7.8055 122.1609 57.8313 39.8153 173.2949 31 P 4.7009 0.0000 0.0000 62.9183 32.3331 175.5991 32 V 3.8348 8.5375 119.0971 59.1664 35.5343 174.2243 33 T 5.3611 7.9651 109.5099 60.9420 72.2174 173.5457 34 V 4.8715 8.7138 113.8164 59.4705 36.4919 174.8013 35 A 4.3238 8.8622 125.7110 52.2314 18.2871 177.8444 36 S 4.3978 9.2680 117.2558 59.2630 64.7837 174.2496 37 N 5.1073 7.5477 117.8209 51.7476 36.4807 174.6006 38 L 4.5623 7.7386 118.0224 54.7440 43.0183 178.5021 39 Q 4.1059 8.7206 125.7540 56.6216 29.8853 176.2847 40 D 4.5408 8.7405 125.1212 54.3351 40.8881 176.2230 41 D 4.4941 8.3604 124.7127 52.0779 41.8017 175.1941 42 E 3.9209 8.6415 121.6329 57.2983 29.7321 177.6267 43 L 4.3995 7.5639 120.3749 56.1977 44.0509 176.8680 44 C 4.4503 7.7197 114.4760 57.8541 34.9214 175.3700 45 G 3.9129 8.0280 107.3509 48.6110 0.0000 175.8082 46 G 3.6684 7.8902 107.4560 46.7979 0.0000 175.1252 47 L 3.8901 7.7310 122.0918 57.7285 42.1477 178.9811 48 W 4.3844 8.4317 119.3381 60.0393 28.9580 178.8246 49 R 4.0839 8.0781 117.5260 59.1451 29.4737 179.1547 50 L 3.8144 8.1961 119.2258 57.5621 41.5592 179.6287 51 V 3.3141 7.6208 118.2740 65.8090 31.4994 178.1969 52 L 3.9959 7.8798 118.5312 57.7535 41.6335 179.2802 53 A 4.1666 8.6998 121.3717 55.1712 18.3102 179.4336 54 Q 3.8754 8.5071 118.3800 59.5108 28.7980 178.7873 55 R 3.9832 8.0124 118.9211 58.9854 29.9735 179.0845 56 W 4.1433 8.0801 118.5673 59.7649 28.9353 178.5162 57 M 4.1828 8.1134 118.5683 58.1747 31.0623 178.7459 58 E 3.9904 7.6428 116.8543 59.4619 29.9064 179.0396 59 R 4.0291 7.6273 117.7015 59.3145 29.9647 179.1913 60 L 4.2031 8.3342 118.8111 57.7020 41.4634 179.6320 61 K 4.0048 7.9652 118.9051 59.6101 31.7330 179.3814 62 T 4.0236 7.5570 107.7054 63.6641 68.6621 175.5633 63 V 4.3308 7.3639 113.0165 60.7952 32.3135 174.9690 64 A 4.6278 7.4552 122.9253 50.4538 20.6690 178.7966 65 G 3.8595 8.2998 107.2321 43.7435 0.0000 175.0923 66 S 4.0836 8.4865 116.2790 61.8125 62.8736 176.8542 67 K 4.0630 7.8834 121.3704 58.4322 32.0267 178.7803 68 M 4.0876 7.8575 118.0825 58.2394 32.1245 178.0110 69 Q 4.1004 8.4007 119.0621 58.8182 28.8299 178.9648 70 G 3.5468 7.7333 105.4505 47.6482 0.0000 175.9184 71 L 4.0834 7.7676 120.8488 57.3149 41.7373 179.4306 72 L 3.9769 8.0180 119.0105 57.8569 41.6157 178.8576 73 E 3.9620 8.3366 119.3894 59.6913 29.2864 179.1949 74 R 3.9464 7.9959 116.5508 58.5994 29.8458 178.4500 75 V 3.9675 7.4103 117.4126 64.8328 31.8382 177.4630 76 N 4.3693 8.5795 117.8627 56.7913 38.9472 176.9017 77 T 3.9450 8.2240 111.4213 64.9141 68.5362 176.2337 78 E 4.3483 7.8976 119.4419 57.9998 29.3557 177.5206 79 I 4.1069 7.4437 109.8692 59.8492 38.6868 176.4854 80 H 4.2192 7.9455 120.6297 58.4663 29.5107 176.8862 81 F 4.4556 7.9709 116.0444 60.1763 37.3342 177.3707 82 V 3.9564 6.6377 111.7794 63.7819 30.9976 177.3159 83 T 4.5285 7.6127 107.7243 62.1610 69.1709 175.7503 84 K 4.2513 8.5370 121.7587 58.4187 32.4977 176.2171 85 C 4.8768 7.6830 114.7787 54.8268 42.7337 174.9337 86 A 4.3315 8.1765 127.1095 51.8214 16.0488 177.1765 87 F 4.4422 7.8863 120.2307 56.8761 40.0649 177.0541 88 Q 4.4692 9.4629 123.4440 54.7845 29.4326 174.4495 89 P 4.4828 0.0000 0.0000 62.0705 32.1344 174.3836 90 P 4.2316 0.0000 0.0000 62.4745 32.0705 174.7136 91 P 4.5283 0.0000 0.0000 62.2993 32.1261 177.6041 92 S 4.2198 8.4693 115.4205 61.4475 62.8555 174.8700 93 C 4.3300 7.9627 113.4854 56.8447 41.9407 173.3642 94 L 4.0802 7.5379 123.5830 54.8288 41.8779 175.7530 95 R 4.5336 9.0268 126.0167 54.7200 32.1378 175.4868 96 F 5.4838 8.7756 121.4776 55.6925 41.9743 175.2924 97 V 4.5823 8.7326 120.9594 59.6194 34.5809 174.6399 98 Q 4.6349 8.8286 125.6580 56.7272 29.5219 174.9119 99 T 4.7644 9.0087 120.2669 60.1690 71.7177 172.7525 100 N 4.8259 8.6284 122.6384 53.0400 39.3395 176.4650 101 I 3.6277 8.3661 121.9258 63.7972 37.9455 178.6085 102 S 4.1091 7.8175 115.5972 61.1521 62.8660 176.5318 103 R 3.8267 8.0520 122.5810 59.1187 29.8517 178.1689 104 L 3.9350 7.7698 119.6627 58.2317 42.2021 178.8008 105 L 3.9931 8.1212 119.0908 57.6951 41.5306 179.3303 106 Q 3.9762 8.0963 119.5883 59.2360 29.0587 178.1117 107 E 4.0077 8.3251 119.6367 59.6876 29.4860 179.3246 108 T 3.8662 8.0933 115.8792 66.6481 68.4995 176.4657 109 S 4.2547 8.0547 114.6803 61.5863 62.4774 175.9116 110 E 4.0434 8.2537 121.1758 59.8306 29.2378 179.5643 111 Q 4.0307 8.6527 118.2030 58.8381 28.6906 178.8781 112 L 3.8342 7.8572 120.2551 57.4364 41.2668 179.6434 113 V 3.7185 7.7047 117.0971 66.1948 31.6697 177.8072 114 A 4.2306 8.0263 119.0384 54.8719 18.4129 178.8853 115 L 4.2551 8.0846 118.7146 57.2608 41.9431 178.6180 116 K 3.8018 7.9019 119.7258 59.1401 32.1941 176.4368 117 P 4.2564 0.0000 0.0000 64.1400 31.7816 177.0103 118 W 4.7316 8.0007 116.9791 56.6948 30.8093 176.8191 119 I 3.7928 7.9787 119.2707 63.6997 37.3110 176.1677 120 T 5.3873 7.8522 106.2439 60.8992 69.5411 174.9023 121 R 4.3995 8.1465 120.5276 56.7741 31.2573 176.3555 122 Q 4.3644 7.9757 115.6059 53.8968 30.6832 174.3319 123 N 4.5864 8.1039 119.0964 52.7100 39.5630 174.5937 124 F 4.8560 9.2537 124.7159 57.4240 39.8567 178.0948 125 S 4.1102 8.3793 121.2105 61.6595 62.6241 176.2714 126 R 4.3876 7.8632 113.2687 56.7457 29.5635 177.5256 127 C 4.8268 8.2908 116.8130 58.4975 39.2113 175.6382 128 L 3.5214 7.6325 119.2311 56.5979 41.3317 176.3144 129 E 4.8322 7.5805 118.3336 54.1122 30.2104 175.8375 130 L 2.9643 8.3462 124.6471 54.3154 42.4384 176.6102 131 Q 4.5662 6.0623 120.4027 54.2303 32.4834 175.2141 132 C 5.4401 8.5703 118.5510 55.3297 43.1897 172.8249 133 Q 4.9194 8.2106 118.0674 53.3378 31.3846 173.9745 134 P 4.3793 0.0000 0.0000 63.1845 31.4649 176.1962 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 T 8.17 4.31 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 1.20 0.00 0.00 2 Q 8.66 3.83 0.00 2.08 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.78 0.00 0.00 0.00 0.00 0.00 2.35 2.34 0.00 3 D 8.30 4.96 0.00 2.62 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 4 C 8.30 4.59 0.00 2.85 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 5 S 7.99 5.18 0.00 3.94 3.79 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 6 F 8.81 4.73 0.00 3.17 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 7 Q 9.10 3.96 0.00 2.02 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.63 6.72 0.00 0.00 0.00 0.00 0.00 2.36 2.43 0.00 8 H 7.84 4.90 0.00 3.16 3.19 0.00 5.71 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 S 8.60 4.04 0.00 3.77 3.74 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 10 P 0.00 4.27 0.00 1.36 1.88 0.00 3.24 0.00 0.00 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.44 0.00 11 I 6.61 3.83 1.75 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 -0.02 0.80 0.00 0.00 12 S 8.49 4.50 0.00 4.04 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 13 S 8.57 4.41 0.00 3.88 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 14 D 7.52 4.95 0.00 2.79 2.58 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 15 F 7.94 4.49 0.00 3.30 3.48 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 16 A 6.79 4.05 0.90 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 17 V 7.24 3.57 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 1.02 0.00 0.00 0.87 0.00 0.00 18 K 8.04 4.15 0.00 2.10 1.90 0.00 1.63 0.00 0.00 1.99 0.00 0.00 3.04 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.58 1.62 7.81 19 I 7.52 4.04 1.94 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.31 0.96 0.00 0.00 20 R 7.77 4.04 0.00 2.05 2.24 0.00 2.91 0.00 0.00 3.15 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.95 0.00 21 E 8.04 4.03 0.00 2.24 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 2.38 2.40 0.00 22 L 7.81 4.17 0.00 1.75 1.82 0.92 1.28 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 23 S 8.21 4.16 0.00 3.97 4.05 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 24 D 7.71 4.49 0.00 2.69 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 0.00 0.00 0.00 0.00 25 Y 7.76 4.75 0.00 2.93 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 26 L 7.41 4.60 0.00 1.74 1.57 0.88 1.31 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 27 L 8.18 4.36 0.00 1.79 1.70 0.98 0.85 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 28 Q 8.66 4.11 0.00 2.11 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.82 6.98 0.00 0.00 0.00 0.00 0.00 2.45 2.35 0.00 29 D 7.79 5.19 0.00 2.89 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 30 Y 7.81 4.15 0.00 3.24 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 31 P 0.00 4.70 0.00 1.95 1.90 0.00 2.60 0.00 0.00 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.75 0.00 32 V 8.54 3.83 0.67 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 -0.03 0.00 0.00 0.71 0.00 0.00 33 T 7.97 5.36 4.52 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 1.45 0.00 0.00 34 V 8.71 4.87 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 0.77 0.00 0.00 1.06 0.00 0.00 35 A 8.86 4.32 1.07 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 0.00 0.00 36 S 9.27 4.40 0.00 3.93 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 37 N 7.55 5.11 0.00 2.84 2.92 0.00 0.00 6.31 6.67 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 38 L 7.74 4.56 0.00 1.63 1.84 1.09 0.75 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 39 Q 8.72 4.11 0.00 2.17 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.77 6.95 0.00 0.00 0.00 0.00 0.00 2.58 2.47 0.00 40 D 8.74 4.54 0.00 2.75 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 41 D 8.36 4.49 0.00 2.69 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 0.00 0.00 0.00 0.00 42 E 8.64 3.92 0.00 1.97 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 2.18 2.15 0.00 43 L 7.56 4.40 0.00 1.42 1.68 0.64 0.78 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 44 C 7.72 4.45 0.00 1.44 1.56 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 45 G 8.03 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 0.00 0.00 0.00 46 G 7.89 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 47 L 7.73 3.89 0.00 1.67 1.78 0.84 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 48 W 8.43 4.38 0.00 3.61 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 49 R 8.08 4.08 0.00 2.08 2.11 0.00 3.19 0.00 0.00 3.33 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.91 0.00 50 L 8.20 3.81 0.00 1.74 1.47 0.84 0.81 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 51 V 7.62 3.31 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 -0.31 0.00 0.00 52 L 7.88 4.00 0.00 2.03 1.87 1.07 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 53 A 8.70 4.17 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 54 Q 8.51 3.88 0.00 2.12 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.73 0.00 0.00 0.00 0.00 0.00 2.25 2.47 0.00 55 R 8.01 3.98 0.00 1.90 1.78 0.00 3.24 0.00 0.00 3.09 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.74 0.00 56 W 8.08 4.14 0.00 3.59 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 57 M 8.11 4.18 0.00 2.09 2.38 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 2.64 2.95 0.00 58 E 7.64 3.99 0.00 2.11 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 2.47 2.48 0.00 59 R 7.63 4.03 0.00 1.87 1.88 0.00 2.50 0.00 0.00 2.68 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.39 0.00 60 L 8.33 4.20 0.00 1.91 1.68 0.80 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 61 K 7.97 4.00 0.00 1.94 1.86 0.00 1.67 0.00 0.00 1.78 0.00 0.00 2.98 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.45 1.59 7.81 62 T 7.56 4.02 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 1.24 0.00 0.00 63 V 7.36 4.33 2.15 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 0.77 0.00 0.00 1.05 0.00 0.00 64 A 7.46 4.63 1.26 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 0.00 0.00 65 G 8.30 3.86 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 0.00 0.00 0.00 66 S 8.49 4.08 0.00 4.00 4.04 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 67 K 7.88 4.06 0.00 1.66 1.67 0.00 1.55 0.00 0.00 1.62 0.00 0.00 2.90 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.43 1.41 7.81 68 M 7.86 4.09 0.00 2.15 1.98 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 2.60 2.62 0.00 69 Q 8.40 4.10 0.00 2.37 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.59 0.00 0.00 0.00 0.00 0.00 2.49 2.65 0.00 70 G 7.73 3.55 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 0.00 0.00 0.00 71 L 7.77 4.08 0.00 1.82 1.75 0.92 0.73 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 72 L 8.02 3.98 0.00 1.84 1.70 0.89 0.56 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 73 E 8.34 3.96 0.00 2.11 2.02 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 2.30 2.40 0.00 74 R 8.00 3.95 0.00 2.03 2.00 0.00 3.21 0.00 0.00 3.16 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.79 0.00 75 V 7.41 3.97 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 1.03 0.00 0.00 1.02 0.00 0.00 76 N 8.58 4.37 0.00 2.96 2.95 0.00 0.00 6.82 7.25 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 77 T 8.22 3.94 4.28 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 1.34 0.00 0.00 78 E 7.90 4.35 0.00 2.22 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 0.00 2.64 2.60 0.00 79 I 7.44 4.11 1.55 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.94 0.79 0.00 0.00 80 H 7.95 4.22 0.00 3.50 3.36 0.00 5.59 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 F 7.97 4.46 0.00 3.42 3.36 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 82 V 6.64 3.96 1.79 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 0.49 0.00 0.00 0.72 0.00 0.00 83 T 7.61 4.53 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 1.07 0.00 0.00 84 K 8.54 4.25 0.00 2.29 2.00 0.00 2.06 0.00 0.00 1.92 0.00 0.00 3.17 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.60 1.61 7.81 85 C 7.68 4.88 0.00 3.01 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 86 A 8.18 4.33 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 87 F 7.89 4.44 0.00 2.99 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 88 Q 9.46 4.47 0.00 2.05 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.89 0.00 0.00 0.00 0.00 0.00 2.43 2.48 0.00 89 P 0.00 4.48 0.00 2.08 2.06 0.00 3.82 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.01 0.00 90 P 0.00 4.23 0.00 2.20 2.18 0.00 3.69 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.19 0.00 91 P 0.00 4.53 0.00 2.14 2.10 0.00 3.57 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 1.92 2.03 0.00 92 S 8.47 4.22 0.00 3.86 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 93 C 7.96 4.33 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 94 L 7.54 4.08 0.00 1.48 1.42 0.69 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 95 R 9.03 4.53 0.00 1.64 1.75 0.00 3.11 0.00 0.00 3.14 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.51 0.00 96 F 8.78 5.48 0.00 2.96 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.73 4.58 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 0.80 0.00 0.00 0.96 0.00 0.00 98 Q 8.83 4.63 0.00 2.12 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.84 0.00 0.00 0.00 0.00 0.00 2.31 2.44 0.00 99 T 9.01 4.76 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 1.18 0.00 0.00 100 N 8.63 4.83 0.00 2.77 2.96 0.00 0.00 6.48 7.32 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 0.00 101 I 8.37 3.63 1.99 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.39 0.94 0.00 0.00 102 S 7.82 4.11 0.00 4.05 4.20 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 0.00 103 R 8.05 3.83 0.00 1.92 2.08 0.00 3.15 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 1.62 1.67 0.00 104 L 7.77 3.93 0.00 1.67 1.70 0.94 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 105 L 8.12 3.99 0.00 1.86 1.71 0.92 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 106 Q 8.10 3.98 0.00 2.28 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.81 0.00 0.00 0.00 0.00 0.00 2.37 2.46 0.00 107 E 8.33 4.01 0.00 2.29 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 0.00 2.35 2.36 0.00 108 T 8.09 3.87 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 1.18 0.00 0.00 109 S 8.05 4.25 0.00 4.17 4.09 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 0.00 110 E 8.25 4.04 0.00 2.30 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 2.38 2.59 0.00 111 Q 8.65 4.03 0.00 2.15 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.81 0.00 0.00 0.00 0.00 0.00 2.39 2.54 0.00 112 L 7.86 3.83 0.00 1.18 0.53 0.25 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 113 V 7.70 3.72 2.37 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 0.90 0.00 0.00 1.25 0.00 0.00 114 A 8.03 4.23 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 0.00 115 L 8.08 4.26 0.00 2.04 1.80 0.94 0.67 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 0.00 116 K 7.90 3.80 0.00 2.06 2.00 0.00 2.05 0.00 0.00 1.86 0.00 0.00 3.17 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.47 1.48 7.81 117 P 0.00 4.26 0.00 1.60 1.97 0.00 3.91 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.12 0.00 118 W 8.00 4.73 0.00 3.52 3.41 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 0.00 119 I 7.98 3.79 1.85 0.00 0.00 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.57 0.20 0.79 0.00 0.00 120 T 7.85 5.39 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 1.28 0.00 0.00 121 R 8.15 4.40 0.00 1.98 2.09 0.00 2.96 0.00 0.00 3.03 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.53 0.00 122 Q 7.98 4.36 0.00 0.93 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.84 0.00 0.00 0.00 0.00 0.00 2.63 2.28 0.00 123 N 8.10 4.59 0.00 2.59 2.60 0.00 0.00 6.93 7.02 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 0.00 124 F 9.25 4.86 0.00 3.38 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 0.00 125 S 8.38 4.11 0.00 3.89 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 0.00 126 R 7.86 4.39 0.00 1.98 2.06 0.00 3.05 0.00 0.00 3.22 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.66 0.00 127 C 8.29 4.83 0.00 3.34 3.36 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 0.00 128 L 7.63 3.52 0.00 1.78 1.77 0.87 -0.02 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 0.00 129 E 7.58 4.83 0.00 2.07 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 2.29 0.00 130 L 8.35 2.96 0.00 1.33 0.98 1.05 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 131 Q 6.06 4.57 0.00 2.01 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.76 0.00 0.00 0.00 0.00 0.00 2.28 2.44 0.00 132 C 8.57 5.44 0.00 2.74 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 0.00 133 Q 8.21 4.92 0.00 2.05 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.98 0.00 0.00 0.00 0.00 0.00 2.39 2.25 0.00 134 P 0.00 4.38 0.00 2.19 2.06 0.00 3.79 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00