NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4074 8.3044 120.3218 55.1406 32.9691 173.0857 2 K 4.0645 7.1377 121.7801 54.4092 34.2502 173.7419 3 K 5.1645 9.3887 127.6787 54.6285 36.2925 174.4990 4 I 4.6181 8.6151 125.4250 59.5674 39.8093 174.7391 5 L 4.8516 8.5602 128.8475 53.3443 43.1043 175.7510 6 F 5.0772 9.1081 124.2933 56.2225 40.9380 175.1432 7 I 5.1395 8.5724 124.1249 59.7749 39.4823 174.8947 8 C 4.8608 8.8327 124.1936 57.9101 31.0665 174.1242 9 L 3.8177 9.0410 127.0593 58.5218 42.0698 178.5768 10 G 3.6833 8.1272 106.4595 46.3810 0.0000 173.8729 11 N 4.4426 8.3906 114.7420 54.0373 37.6196 173.5720 12 I 4.6830 7.4604 107.6303 59.7809 38.1124 175.9214 13 C 4.9630 7.4449 115.1364 60.1406 35.4626 175.2424 14 R 4.0965 8.4239 122.1518 58.1765 31.2698 178.8549 15 S 4.0738 8.2430 112.5436 60.9600 63.1422 174.2133 16 P 4.2416 0.0000 0.0000 65.7330 31.1877 178.0344 17 M 4.0524 7.7091 115.3469 58.9611 32.1375 178.1898 18 A 4.0103 7.9230 120.1844 54.8516 18.4857 179.1386 19 E 3.7758 8.0509 118.2601 59.5011 29.7685 178.8967 20 F 4.3215 8.2466 120.3326 61.1323 39.4763 177.2194 21 I 3.3876 7.7102 119.3505 64.5438 36.9402 178.1388 22 M 3.8868 8.1350 119.5975 58.4944 31.6489 178.6583 23 K 3.9065 7.6029 117.9741 59.6737 32.0122 177.9811 24 D 4.2322 7.6028 117.9823 57.3559 41.1938 178.2961 25 L 3.9961 7.7299 119.3601 57.7235 41.5945 179.8546 26 V 3.5345 8.1997 112.9117 64.2386 31.1909 178.1853 27 K 3.9274 7.4335 117.4358 59.2388 31.8371 178.4867 28 K 4.0884 7.8629 119.0519 58.6964 32.2580 178.0441 29 A 4.6428 7.4964 118.6315 51.8510 20.1122 175.5996 30 N 3.8301 8.5930 115.6908 56.1162 41.1406 177.1678 31 L 3.9816 7.7107 118.9763 57.8381 42.6206 178.9782 32 E 3.8647 8.1143 117.3968 59.3987 29.4098 177.7837 33 K 4.2505 7.7568 114.4465 55.7371 32.4751 175.9933 34 E 3.4706 7.4801 120.1929 56.7258 27.3696 173.1972 35 F 4.6798 8.2673 119.2887 55.6898 42.0007 176.0082 36 F 5.3551 8.6451 118.8291 55.8085 42.7888 174.2458 37 I 5.5018 8.6841 115.0716 59.3173 40.8006 174.2607 38 N 5.1809 9.3511 121.4329 51.4586 40.8647 172.8673 39 S 5.5065 9.0654 116.8840 56.6044 64.7114 172.6438 40 A 4.7539 9.0419 127.6223 50.4275 23.4683 175.7428 41 G 4.6303 8.2992 106.0316 44.7723 0.0000 174.5600 42 T 4.0596 8.6084 113.4008 64.7244 67.8114 175.7402 43 S 4.6079 7.8510 113.6814 57.1043 64.2540 174.3289 44 G 4.1030 8.5095 107.1408 45.6750 0.0000 174.8037 45 E 4.1857 7.7647 119.5478 59.0316 29.5039 178.0961 46 H 4.7792 7.7814 109.3511 55.1990 31.8113 170.9202 47 D 5.2733 7.2373 120.1154 55.4105 40.4601 177.6683 48 G 4.9620 8.4013 126.4741 46.3041 0.0000 171.9834 49 E 2.5400 6.2670 118.5329 56.5394 30.3690 176.7796 50 G 4.0664 9.0621 107.9633 44.8719 0.0000 172.6027 51 M 4.3560 8.1074 111.3829 55.0517 35.0125 174.7916 52 H 4.6881 8.3606 121.9652 54.4638 33.4510 172.9487 53 Y 4.5534 8.1066 123.0257 61.8683 38.2688 179.3806 54 G 3.8527 8.3546 106.7000 47.7519 0.0000 175.6011 55 T 3.9737 7.9381 118.3860 66.0793 68.6538 176.7295 56 K 3.9715 8.5375 120.7479 59.5999 32.2515 178.7306 57 N 4.2742 8.3077 117.1566 56.6422 38.6171 176.5317 58 K 3.9551 7.9713 119.6043 59.8113 32.4663 178.4271 59 L 4.1795 8.3629 119.0759 57.6666 41.2813 179.3047 60 A 4.0229 8.2925 120.4778 55.0942 18.3041 179.1249 61 Q 4.1502 7.6818 116.0841 58.9739 28.8574 176.9365 62 L 4.7062 7.5356 115.9141 57.0812 47.5218 176.2154 63 N 4.6843 7.9526 115.1803 52.7638 39.3913 173.3836 64 I 4.3386 7.8832 119.2929 60.2470 38.8344 175.4452 65 E 4.0777 8.7363 124.6731 58.6736 29.4828 177.3597 66 H 4.6103 7.4112 112.5000 55.8769 29.8643 173.8547 67 K 4.3706 8.0413 115.4379 56.0471 32.5253 174.9656 68 N 5.0291 8.3079 114.1331 53.8194 39.8986 175.2773 69 F 4.4999 8.8009 121.9124 58.4708 39.2424 174.4615 70 T 4.5840 8.6428 117.6867 60.1015 71.2127 173.2228 71 S 4.5107 8.9141 122.5420 59.0055 63.0450 173.6229 72 K 4.8009 8.7285 124.6343 54.6280 35.8526 176.3420 73 K 4.6170 8.3767 121.1125 55.3630 33.6854 174.5550 74 L 4.1272 8.5787 129.4310 56.3538 42.7773 176.0202 75 T 5.0093 8.2912 116.0645 59.8179 72.2056 173.9575 76 Q 4.3639 8.8944 119.0584 59.5736 28.5485 178.5374 77 K 3.9785 8.0607 117.9364 60.0283 32.7685 178.7014 78 L 4.8068 7.8024 120.8893 57.3690 40.2320 178.7628 79 C 4.0405 8.2315 118.6212 62.4318 31.2189 175.0026 80 D 4.4577 8.1356 118.6251 56.6722 41.0379 177.8186 81 E 4.0954 8.1068 119.4628 58.3801 29.9477 176.8866 82 S 4.4068 6.8254 112.8254 58.8587 63.4639 174.2111 83 D 4.4750 8.6430 123.7851 55.7927 41.8454 176.3950 84 F 4.9060 8.0866 116.1313 55.2629 43.0669 173.8567 85 L 5.1613 8.8988 123.7628 53.3845 45.3682 175.1850 86 I 5.0689 8.5447 125.2768 60.2341 41.0356 174.7338 87 T 4.1783 9.0061 115.2074 63.1136 69.2081 175.3611 88 M 3.6815 8.3277 123.6767 55.2031 31.4207 177.8490 89 D 4.5636 7.6562 118.0864 53.4473 42.6705 176.7609 90 N 4.3494 8.4364 122.4582 56.8239 39.4489 176.7602 91 S 4.2890 7.8539 113.9189 61.1209 62.6670 175.2279 92 N 4.3321 7.6902 119.8790 56.5523 38.5115 176.4126 93 F 4.2146 7.8923 120.9394 61.2378 39.4369 177.0588 94 K 3.4111 8.0269 117.4150 59.2802 31.9324 178.6040 95 N 4.2895 8.0509 117.3120 56.7811 38.8762 177.3114 96 V 3.8872 8.1129 120.6702 64.5628 30.9727 177.9404 97 L 3.8576 7.2649 120.5278 57.9952 42.1375 178.3993 98 K 4.1203 7.5166 117.2451 57.8560 32.3808 177.4671 99 N 4.4771 8.0121 116.0298 54.7662 39.2013 173.6727 100 F 4.7422 7.4356 117.5788 55.0580 42.8196 174.5677 101 T 4.2534 8.1408 110.7304 61.6165 69.8376 175.1750 102 N 4.5089 8.6602 118.3260 55.0755 38.0915 175.3693 103 T 4.3251 7.8657 113.0138 62.0858 67.5581 175.9430 104 Q 4.1592 7.8689 118.4972 58.0365 28.9548 177.2958 105 N 4.4657 8.0269 115.8873 54.9979 37.6600 175.4931 106 K 4.3534 7.8331 118.9676 56.4215 32.3542 176.1690 107 V 5.2282 7.4518 119.3287 60.0824 32.9277 175.5282 108 L 4.7912 8.4221 121.5377 52.8063 45.3313 175.0677 109 K 4.6754 7.9026 121.7955 54.5789 35.0353 176.7667 110 I 3.8867 8.3560 125.4202 63.1613 38.4478 177.8683 111 T 3.9994 7.7138 110.1295 64.9226 68.4275 175.4530 112 D 4.4041 7.2776 119.4554 56.5940 40.9260 177.7430 113 F 4.8606 7.6071 117.6566 58.1950 39.7478 175.8650 114 S 4.1155 8.2553 113.3047 58.4906 63.2070 171.0318 115 P 4.2599 0.0000 0.0000 63.9842 31.0587 175.7178 116 S 4.6437 8.2942 112.0444 57.8391 63.8181 175.4458 117 L 3.9360 8.1869 124.2069 58.4090 42.3397 177.7321 118 N 4.1397 7.9776 113.3700 54.1781 35.9616 173.2364 119 Y 4.6440 7.7913 115.7434 56.0837 40.9527 175.8204 120 D 4.3346 7.8636 124.2083 54.3646 40.2624 178.1613 121 E 3.7799 8.1000 119.7798 55.0997 28.4949 172.3786 122 V 3.8902 8.1775 129.5958 61.5401 33.6653 171.3649 123 P 4.9631 0.0000 0.0000 60.6673 30.6850 175.7967 124 D 4.6193 9.0215 129.1553 53.5802 41.3670 172.7520 125 P 4.2301 0.0000 0.0000 65.1451 31.4833 178.3952 126 W 4.4161 8.4230 127.8782 59.4199 30.8066 175.7748 127 Y 4.6640 7.9421 114.1205 58.0359 39.6518 175.7764 128 S 4.4883 9.2606 113.4918 61.2833 65.0064 174.3891 129 G 3.5205 7.2794 106.9008 44.7225 0.0000 172.6172 130 N 4.9715 7.5790 118.4948 50.9412 42.4743 175.1725 131 F 4.1976 9.1038 123.3655 60.6090 39.2727 177.8903 132 D 4.5915 8.4261 118.1049 56.1689 38.8855 177.9159 133 E 3.9996 7.8869 120.8678 59.8713 29.4860 178.8477 134 T 3.9311 8.1999 115.5785 66.7023 68.4205 175.8253 135 Y 4.1777 8.2605 121.6872 60.5271 38.9234 177.8149 136 K 3.4784 8.1464 119.7925 59.6950 32.3949 178.3705 137 I 3.4753 7.8834 120.0600 64.1984 36.9771 178.2517 138 L 3.8512 8.0249 119.3140 57.9188 41.6717 179.5581 139 S 3.9223 7.8447 112.7838 61.2956 62.2803 175.9827 140 L 3.7443 7.5866 122.3820 58.0227 41.8231 178.5051 141 A 3.9386 8.1643 121.0070 55.6234 18.2474 179.4145 142 C 4.0030 8.3557 115.4567 62.8535 28.1293 176.0021 143 K 3.8407 7.9106 121.1733 59.5419 31.9149 178.4015 144 N 4.0773 8.2084 116.3870 56.3127 38.4761 177.2026 145 L 3.9815 8.1088 121.8271 58.1008 42.1679 178.8224 146 L 3.9512 8.0895 120.5996 57.8486 41.7221 179.0818 147 V 3.3742 7.2426 117.5200 65.9956 31.5964 177.5242 148 F 3.8922 7.6746 118.8212 61.1038 39.3307 176.6458 149 L 4.1116 8.2490 119.6544 57.2428 42.4144 177.4079 150 S 4.4832 7.8893 114.6456 58.1057 64.5283 174.6283 151 K 3.4493 7.7176 120.8549 58.5003 29.6947 173.1488 152 H 4.6384 7.6383 117.1324 55.2119 30.6713 173.0536 153 H 4.9836 7.2868 114.1874 53.4931 30.9247 171.0391 154 H 4.9256 8.4063 114.4149 54.4454 30.0251 173.9004 155 H 4.6990 8.8591 119.8015 55.0556 30.2507 174.8211 156 H 4.3063 8.2002 113.9136 56.2126 27.8164 173.4540 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 M 8.30 4.41 0.00 2.06 2.13 0.00 0.00 0.00 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.64 0.00 2 K 7.14 4.06 0.00 1.26 0.74 0.00 1.73 0.00 0.00 1.75 0.00 0.00 3.22 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.12 1.42 7.81 3 K 9.39 5.16 0.00 1.71 1.66 0.00 1.65 0.00 0.00 2.01 0.00 0.00 2.70 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.61 1.52 7.81 4 I 8.62 4.62 1.45 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 1.51 1.47 0.63 0.00 0.00 5 L 8.56 4.85 0.00 1.60 1.52 0.92 1.24 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 6 F 9.11 5.08 0.00 2.97 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 7 I 8.57 5.14 1.98 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.64 1.05 0.00 0.00 8 C 8.83 4.86 0.00 3.09 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 9 L 9.04 3.82 0.00 1.57 1.65 0.95 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 10 G 8.13 3.68 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 0.00 0.00 0.00 11 N 8.39 4.44 0.00 2.94 2.81 0.00 0.00 6.72 8.10 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 12 I 7.46 4.68 1.79 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.47 1.01 0.00 0.00 13 C 7.44 4.96 0.00 3.26 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 14 R 8.42 4.10 0.00 1.91 2.07 0.00 3.40 0.00 0.00 3.32 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.59 0.00 15 S 8.24 4.07 0.00 4.01 3.78 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 16 P 0.00 4.24 0.00 2.24 2.11 0.00 3.88 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.24 0.00 17 M 7.71 4.05 0.00 2.18 2.13 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.63 0.00 18 A 7.92 4.01 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 19 E 8.05 3.78 0.00 2.44 2.42 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 2.37 2.42 0.00 20 F 8.25 4.32 0.00 3.31 3.23 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 21 I 7.71 3.39 1.88 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.96 0.83 0.00 0.00 22 M 8.13 3.89 0.00 1.93 1.95 0.00 0.00 0.00 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.39 0.00 23 K 7.60 3.91 0.00 1.95 1.95 0.00 1.88 0.00 0.00 1.71 0.00 0.00 3.11 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.49 1.50 7.81 24 D 7.60 4.23 0.00 2.29 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 25 L 7.73 4.00 0.00 1.66 1.62 0.84 0.91 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 26 V 8.20 3.53 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 0.78 0.00 0.00 0.98 0.00 0.00 27 K 7.43 3.93 0.00 1.74 1.94 0.00 1.78 0.00 0.00 1.60 0.00 0.00 2.95 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.44 7.81 28 K 7.86 4.09 0.00 1.72 1.91 0.00 1.73 0.00 0.00 1.61 0.00 0.00 2.99 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.38 1.54 7.81 29 A 7.50 4.64 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 30 N 8.59 3.83 0.00 2.73 2.70 0.00 0.00 6.79 6.65 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 31 L 7.71 3.98 0.00 1.68 1.61 0.92 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 32 E 8.11 3.86 0.00 1.87 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 2.34 2.34 0.00 33 K 7.76 4.25 0.00 1.53 2.02 0.00 1.72 0.00 0.00 1.55 0.00 0.00 2.91 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.44 1.38 7.81 34 E 7.48 3.47 0.00 2.08 1.91 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 2.15 2.18 0.00 35 F 8.27 4.68 0.00 2.74 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 36 F 8.65 5.36 0.00 2.98 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 37 I 8.68 5.50 2.34 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.85 1.23 0.00 0.00 38 N 9.35 5.18 0.00 2.80 2.97 0.00 0.00 6.36 6.93 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 39 S 9.07 5.51 0.00 4.27 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 A 9.04 4.75 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 41 G 8.30 4.63 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 0.00 0.00 0.00 42 T 8.61 4.06 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 1.22 0.00 0.00 43 S 7.85 4.61 0.00 4.00 3.80 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 44 G 8.51 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 0.00 0.00 0.00 45 E 7.76 4.19 0.00 2.10 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 2.37 2.27 0.00 46 H 7.78 4.78 0.00 3.29 3.47 0.00 5.69 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 D 7.24 5.27 0.00 2.68 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 48 G 8.40 4.96 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 49 E 6.27 2.54 0.00 1.90 1.71 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 2.23 2.34 0.00 50 G 9.06 4.07 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 0.00 51 M 8.11 4.36 0.00 2.04 1.99 0.00 0.00 0.00 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.35 0.00 52 H 8.36 4.69 0.00 3.26 3.09 0.00 5.70 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 Y 8.11 4.55 0.00 3.01 3.26 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 54 G 8.35 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 0.00 0.00 0.00 55 T 7.94 3.97 4.33 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 1.30 0.00 0.00 56 K 8.54 3.97 0.00 2.19 1.96 0.00 1.74 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.72 1.51 7.81 57 N 8.31 4.27 0.00 2.91 3.12 0.00 0.00 7.00 5.99 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 58 K 7.97 3.96 0.00 2.21 2.03 0.00 2.13 0.00 0.00 1.84 0.00 0.00 3.20 0.00 0.00 3.32 0.00 0.00 0.00 0.00 1.58 1.82 7.81 59 L 8.36 4.18 0.00 1.93 1.81 1.11 1.06 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 60 A 8.29 4.02 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 61 Q 7.68 4.15 0.00 2.36 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.52 0.00 0.00 0.00 0.00 0.00 2.37 2.37 0.00 62 L 7.54 4.71 0.00 1.66 1.73 0.98 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 63 N 7.95 4.68 0.00 2.87 2.94 0.00 0.00 7.06 7.55 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 64 I 7.88 4.34 1.52 0.00 0.00 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.35 0.79 0.00 0.00 65 E 8.74 4.08 0.00 1.94 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 2.43 0.00 66 H 7.41 4.61 0.00 3.31 3.30 0.00 5.56 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 K 8.04 4.37 0.00 1.73 1.67 0.00 0.61 0.00 0.00 1.37 0.00 0.00 2.76 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.11 0.99 7.81 68 N 8.31 5.03 0.00 2.72 2.85 0.00 0.00 7.19 7.56 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 69 F 8.80 4.50 0.00 3.22 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 70 T 8.64 4.58 4.30 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 1.31 0.00 0.00 71 S 8.91 4.51 0.00 3.91 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 72 K 8.73 4.80 0.00 1.74 1.75 0.00 1.72 0.00 0.00 1.73 0.00 0.00 2.90 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.38 1.61 7.81 73 K 8.38 4.62 0.00 1.72 1.79 0.00 1.61 0.00 0.00 1.65 0.00 0.00 2.89 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.32 1.46 7.81 74 L 8.58 4.13 0.00 1.72 1.99 0.85 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 75 T 8.29 5.01 4.30 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 1.23 0.00 0.00 76 Q 8.89 4.36 0.00 2.11 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.85 7.04 0.00 0.00 0.00 0.00 0.00 2.29 2.28 0.00 77 K 8.06 3.98 0.00 1.91 1.96 0.00 1.59 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.56 7.81 78 L 7.80 4.81 0.00 1.98 1.77 0.98 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 79 C 8.23 4.04 0.00 2.80 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 80 D 8.14 4.46 0.00 2.79 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 81 E 8.11 4.10 0.00 2.16 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 2.29 2.64 0.00 82 S 6.83 4.41 0.00 3.78 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 83 D 8.64 4.47 0.00 2.61 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 84 F 8.09 4.91 0.00 2.95 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 85 L 8.90 5.16 0.00 1.68 1.46 0.79 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 86 I 8.54 5.07 2.00 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.67 1.07 0.00 0.00 87 T 9.01 4.18 4.33 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 1.29 0.00 0.00 88 M 8.33 3.68 0.00 2.36 2.44 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.62 0.00 89 D 7.66 4.56 0.00 2.84 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 90 N 8.44 4.35 0.00 2.54 2.75 0.00 0.00 6.94 7.57 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 91 S 7.85 4.29 0.00 4.18 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 92 N 7.69 4.33 0.00 2.86 2.95 0.00 0.00 6.87 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 93 F 7.89 4.21 0.00 3.17 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 K 8.03 3.41 0.00 1.81 1.77 0.00 1.71 0.00 0.00 1.79 0.00 0.00 2.93 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.50 1.65 7.81 95 N 8.05 4.29 0.00 2.93 2.81 0.00 0.00 6.98 7.73 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 96 V 8.11 3.89 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 0.84 0.00 0.00 0.89 0.00 0.00 97 L 7.26 3.86 0.00 1.45 1.60 0.37 0.53 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 98 K 7.52 4.12 0.00 1.69 1.76 0.00 1.81 0.00 0.00 1.59 0.00 0.00 2.94 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.41 1.40 7.81 99 N 8.01 4.48 0.00 3.02 2.89 0.00 0.00 7.11 6.78 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 0.00 100 F 7.44 4.74 0.00 3.04 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 0.00 101 T 8.14 4.25 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 0.00 102 N 8.66 4.51 0.00 2.74 2.89 0.00 0.00 6.69 7.54 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 0.00 103 T 7.87 4.33 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 0.00 104 Q 7.87 4.16 0.00 2.19 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.22 6.67 0.00 0.00 0.00 0.00 0.00 2.40 2.23 0.00 105 N 8.03 4.47 0.00 2.85 3.00 0.00 0.00 6.26 7.11 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 0.00 106 K 7.83 4.35 0.00 1.83 1.75 0.00 1.52 0.00 0.00 1.65 0.00 0.00 2.85 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.27 1.28 7.81 107 V 7.45 5.23 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 0.99 0.00 0.00 1.01 0.00 0.00 108 L 8.42 4.79 0.00 1.57 1.31 1.17 0.56 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 0.00 109 K 7.90 4.68 0.00 1.39 1.26 0.00 1.43 0.00 0.00 1.06 0.00 0.00 2.13 0.00 0.00 2.46 0.00 0.00 0.00 0.00 1.14 1.22 7.81 110 I 8.36 3.89 1.91 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 1.38 1.21 1.14 0.00 0.00 111 T 7.71 4.00 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 1.15 0.00 0.00 112 D 7.28 4.40 0.00 2.37 2.49 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 0.00 0.00 0.00 0.00 113 F 7.61 4.86 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 0.00 114 S 8.26 4.12 0.00 3.92 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 0.00 115 P 0.00 4.26 0.00 2.20 2.00 0.00 3.75 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 1.94 1.97 0.00 116 S 8.29 4.64 0.00 3.89 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 0.00 117 L 8.19 3.94 0.00 1.58 1.71 0.88 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 118 N 7.98 4.14 0.00 2.84 2.90 0.00 0.00 6.88 7.46 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 0.00 119 Y 7.79 4.64 0.00 3.25 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 0.00 120 D 7.86 4.33 0.00 2.52 2.25 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 0.00 121 E 8.10 3.78 0.00 1.69 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 2.13 2.02 0.00 122 V 8.18 3.89 1.80 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 1.09 0.00 0.00 0.92 0.00 0.00 123 P 0.00 4.96 0.00 2.21 1.72 0.00 4.08 0.00 0.00 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.12 0.00 124 D 9.02 4.62 0.00 2.87 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 0.00 125 P 0.00 4.23 0.00 2.02 1.71 0.00 3.60 0.00 0.00 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.44 0.00 126 W 8.42 4.42 0.00 3.18 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 0.00 127 Y 7.94 4.66 0.00 3.35 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 0.00 128 S 9.26 4.49 0.00 3.86 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 0.00 129 G 7.28 3.52 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 0.00 130 N 7.58 4.97 0.00 2.78 2.65 0.00 0.00 7.44 7.81 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 0.00 131 F 9.10 4.20 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 0.00 132 D 8.43 4.59 0.00 2.98 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 0.00 133 E 7.89 4.00 0.00 2.29 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 2.41 2.51 0.00 134 T 8.20 3.93 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 1.34 0.00 0.00 135 Y 8.26 4.18 0.00 3.10 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 0.00 136 K 8.15 3.48 0.00 2.01 1.79 0.00 1.72 0.00 0.00 1.87 0.00 0.00 3.32 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.53 1.54 7.81 137 I 7.88 3.48 1.80 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.79 0.33 0.00 0.00 138 L 8.02 3.85 0.00 2.02 1.69 0.91 0.71 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 0.00 139 S 7.84 3.92 0.00 3.60 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 0.00 140 L 7.59 3.74 0.00 1.92 1.52 0.84 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 141 A 8.16 3.94 1.22 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 0.00 142 C 8.36 4.00 0.00 3.18 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 0.00 143 K 7.91 3.84 0.00 2.04 1.68 0.00 1.60 0.00 0.00 1.56 0.00 0.00 2.86 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.36 1.55 7.81 144 N 8.21 4.08 0.00 2.67 2.40 0.00 0.00 6.71 6.02 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 0.00 145 L 8.11 3.98 0.00 1.90 1.90 1.16 0.90 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 0.00 146 L 8.09 3.95 0.00 2.02 1.60 0.88 1.11 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 0.00 147 V 7.24 3.37 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 0.41 0.00 0.00 0.83 0.00 0.00 148 F 7.67 3.89 0.00 2.86 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 0.00 149 L 8.25 4.11 0.00 1.74 2.09 1.10 1.11 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 0.00 150 S 7.89 4.48 0.00 3.99 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 0.00 151 K 7.72 3.45 0.00 1.85 1.74 0.00 1.79 0.00 0.00 1.65 0.00 0.00 2.84 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.21 1.22 7.81 152 H 7.64 4.64 0.00 2.83 2.57 0.00 5.92 0.00 0.00 0.00 0.00 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 H 7.29 4.98 0.00 3.04 3.08 0.00 5.73 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 H 8.41 4.93 0.00 3.29 3.35 0.00 5.52 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 0.00 155 H 8.86 4.70 0.00 3.30 3.38 0.00 5.57 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 H 8.20 4.31 0.00 3.18 3.27 0.00 5.75 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