NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 A 4.3356 8.1227 123.5824 52.4403 19.9397 176.7677 4 C 4.8029 8.2349 120.9341 52.8868 43.6385 172.0901 5 A 4.2421 9.0456 127.3668 51.3794 21.2414 177.1431 6 M 3.9855 8.4248 119.6828 58.6062 32.1603 178.5231 7 L 3.9325 7.7530 118.8193 57.8932 42.0428 178.9092 8 E 3.8937 8.1749 117.9521 59.4449 29.2570 179.7498 9 R 3.6723 7.9204 117.7010 59.2110 30.2578 178.5199 10 A 3.9674 7.9984 120.6358 55.3200 18.2537 179.7083 11 K 3.8418 8.3395 118.0936 59.6254 32.2615 179.1575 12 V 3.0907 7.9064 118.8218 65.7304 31.1886 177.9773 13 K 3.9761 8.3345 118.4187 59.6387 32.0378 178.6085 14 D 4.5200 8.1703 118.9826 57.9446 40.8173 179.4812 15 E 4.0189 8.4185 118.4728 59.0588 29.3587 179.0097 16 W 4.6351 8.9112 128.6595 60.7177 30.6303 177.4645 17 A 4.1549 8.5980 120.8715 55.2735 17.5985 179.3535 18 K 3.8573 7.8887 115.9171 59.6578 32.3637 178.5947 19 A 4.0883 8.2541 119.9296 55.4448 18.8371 178.7963 20 Y 3.1258 7.7548 118.9945 59.0985 38.5114 177.5252 21 G 3.6968 7.3111 108.2269 44.9744 0.0000 172.0295 22 I 3.9952 8.0664 117.1772 62.2816 37.9442 176.2964 23 G 3.8339 7.0174 105.5274 46.1886 0.0000 173.9571 24 A 4.0019 7.9977 122.7482 53.8059 19.0702 179.5553 25 A 3.9757 7.8933 119.3700 55.1756 18.3621 179.8990 26 R 3.9853 7.4106 117.9291 58.8650 30.0575 178.9418 27 S 4.1364 8.0849 112.3849 61.3765 62.2948 175.6254 28 K 3.8277 7.9863 122.1435 59.6833 31.8847 178.0456 29 F 4.0904 8.6918 121.0517 61.3333 39.3269 177.0646 30 G 3.8891 8.7985 105.5436 48.3093 0.0000 175.1935 31 D 4.4827 8.5472 121.8738 56.7801 40.7660 178.9592 32 A 3.7690 8.0314 121.3763 54.9860 18.3542 178.9876 33 L 3.7160 7.6634 120.3764 57.5923 42.0185 179.4413 34 W 3.4907 7.9815 118.3440 59.2751 28.7671 178.5162 35 R 3.8955 7.8705 118.8495 59.4021 29.4117 178.3322 36 N 3.8583 7.7037 116.0908 56.0783 38.4973 177.1762 37 V 3.3108 7.1455 119.6677 66.2939 31.6265 177.8465 38 F 4.9253 8.1124 115.6267 59.4305 38.6237 176.8973 39 N 4.6836 7.6286 115.6032 55.3728 39.0055 176.5776 40 Y 4.6312 8.3820 117.9492 59.7616 39.3745 176.2014 41 A 4.7761 8.2169 122.6325 48.2733 19.1027 174.2057 42 P 4.8479 0.0000 0.0000 64.8348 31.4320 178.1902 43 N 4.5102 8.2313 115.1915 55.4082 38.5452 176.3182 44 A 4.3082 8.2446 121.6565 53.5829 18.4279 179.3811 45 R 2.8219 7.4691 117.0617 59.1148 29.9061 178.1089 46 D 4.3265 7.3607 116.5548 57.2875 40.7770 178.6607 47 I 3.7821 7.3159 119.9693 63.4102 37.2495 176.5615 48 F 4.8420 8.2827 118.0706 57.2381 39.4331 177.7474 49 E 4.1222 8.1624 121.2273 58.9055 29.7529 178.9566 50 S 4.2411 8.1432 115.0246 60.7769 62.9766 174.9677 51 V 4.3355 7.5464 113.3859 61.1631 32.6914 175.1840 52 N 4.1187 8.1199 114.4837 54.9159 37.3147 174.9169 53 S 3.7837 7.7054 110.1101 59.3787 64.2785 176.0661 54 K 3.8439 8.0347 120.9620 59.1416 31.9786 176.5805 55 D 4.6376 7.3573 120.8909 52.2859 40.3303 176.0731 56 M 3.9020 8.4477 124.5259 56.7745 32.3480 176.3133 57 A 4.7645 8.0471 119.3621 52.2599 20.1572 177.2938 58 S 4.3851 8.3230 113.9605 57.5558 65.0180 173.4487 59 P 4.2465 0.0000 0.0000 66.2000 30.7162 178.3324 60 E 3.9566 8.3008 117.7698 59.5160 29.4142 179.1205 61 F 4.2509 8.3396 120.2526 61.0896 39.4291 177.3875 62 K 3.8657 8.5410 118.3660 59.3443 31.8228 179.0628 63 A 3.9658 8.4089 121.4609 55.2848 18.2104 179.0585 64 H 3.9669 7.6855 116.6459 59.4808 29.8771 177.1753 65 I 3.2730 7.2854 121.6423 64.3799 36.9152 177.9253 66 A 4.0812 8.1841 121.5367 55.4282 18.1067 179.9631 67 R 3.9148 7.9579 116.4911 59.3758 30.2151 179.7037 68 V 3.7164 8.0629 119.3404 64.8837 31.3453 178.3362 69 L 4.2459 8.5914 120.3435 57.4999 41.4477 179.6318 70 G 3.8987 8.5296 105.8660 47.7424 0.0000 175.9136 71 G 3.6082 8.4246 108.2250 47.6443 0.0000 175.4347 72 L 3.8173 8.3248 122.7516 57.4933 41.5977 179.2574 73 D 4.0854 8.6273 117.9615 57.3736 41.1100 178.3823 74 R 3.9694 8.0424 115.6710 59.1838 29.4487 178.7626 75 V 3.6511 7.9328 119.0808 65.8275 31.5810 177.8038 76 I 3.4724 7.4874 119.7862 64.5352 36.7553 178.5797 77 S 4.1610 8.1117 113.4668 61.1999 62.8940 175.3673 78 M 4.3605 7.8027 120.6786 55.2762 31.7235 177.6466 79 L 4.0273 7.8962 121.3795 57.0141 41.7437 176.9508 80 D 4.8473 7.7283 116.9295 52.8644 40.2978 177.1161 81 N 4.9044 8.1281 117.0680 52.0936 41.0043 174.1567 82 Q 3.9065 8.5584 122.5099 59.6986 29.0994 178.0266 83 A 3.6855 8.2166 117.9340 56.7155 18.2984 179.4777 84 T 3.7991 7.7627 110.9328 66.1099 69.1124 176.2225 85 L 3.8330 7.9128 122.3218 58.5594 41.9855 178.7644 86 D 4.2631 8.5453 118.3594 57.3100 40.7310 178.5808 87 A 3.9436 7.6018 121.0753 55.4052 18.3287 179.1888 88 D 4.2577 8.4922 116.7298 57.4517 41.2071 178.3815 89 L 3.9186 8.4369 119.6792 57.6992 41.6295 179.2041 90 A 3.9402 8.5003 121.0105 55.3933 18.2866 179.0499 91 H 4.0521 8.4079 116.8214 59.6194 29.9887 177.3484 92 L 4.0226 8.2459 120.9931 57.6783 41.3926 179.4829 93 K 4.0587 8.1303 121.0594 59.1748 31.9309 178.8647 94 S 4.1443 7.7592 114.0079 61.9545 62.8015 176.5947 95 Q 4.1022 7.8638 119.5578 58.4737 28.7605 177.3929 96 H 4.6555 8.1281 116.4498 57.0239 29.5544 176.8641 97 D 4.4344 8.6397 121.7962 57.0419 40.5753 177.2236 98 P 4.4088 0.0000 0.0000 65.0158 31.3794 177.5046 99 R 4.1809 7.9193 116.7540 55.6091 31.6700 176.3261 100 T 3.4545 7.4174 106.4209 62.5000 67.6695 170.9157 101 I 4.3502 7.2814 124.0381 59.8847 39.4937 175.4464 102 D 4.4403 8.7044 124.9357 53.5924 41.4440 174.9425 103 P 4.4035 0.0000 0.0000 65.7335 31.4465 178.4777 104 V 3.7230 8.2874 118.8714 66.1284 31.2189 177.4647 105 N 4.4478 8.7712 116.6753 56.5069 38.4484 177.1822 106 F 4.1080 8.6069 118.6826 59.7474 38.8449 177.9047 107 V 3.8073 8.2539 118.9971 65.7738 31.3716 177.8203 108 V 3.6514 7.9966 117.6032 66.1708 31.1824 177.2208 109 F 3.7632 8.4111 120.1369 61.4030 39.0802 176.6772 110 R 3.0240 7.9155 117.8994 59.4767 29.6091 178.0396 111 K 3.8395 8.2233 117.6645 59.5652 32.0071 178.7562 112 A 3.5365 8.4380 120.9167 55.1510 18.1641 179.3966 113 L 3.4396 8.1010 119.4628 58.1882 42.0663 178.9953 114 I 3.3258 7.6605 119.6647 64.6373 37.0433 177.6589 115 A 3.7499 7.9357 121.2269 55.5998 18.0403 179.4619 116 T 3.4705 7.8559 113.0661 66.6518 68.5295 177.0947 117 V 3.6730 8.0642 119.7716 65.9195 31.4786 177.9171 118 A 3.4576 7.1405 120.8906 54.8903 17.8414 179.8142 119 G 3.4523 8.1896 103.2818 47.7801 0.0000 175.2141 120 T 4.2987 7.2895 116.1558 65.4570 69.2393 176.6551 121 F 4.2866 8.8294 123.0605 60.3381 39.8501 174.5892 122 G 3.9218 8.2402 103.7958 43.7267 0.0000 174.8809 123 V 3.7610 8.3979 112.2140 63.8137 31.5626 177.6968 124 C 4.4154 8.2422 116.4145 61.4219 28.4417 173.6277 125 F 3.9492 8.5459 121.7211 59.1395 39.2409 175.5301 126 D 4.5393 8.1943 127.3207 52.3650 39.9943 176.5857 127 V 3.7114 8.1141 124.9183 65.3077 31.5956 175.3510 128 P 4.2509 0.0000 0.0000 65.9976 31.1238 177.9723 129 A 4.5803 8.8001 122.4396 53.9598 18.2062 179.7287 130 W 3.7164 8.2273 117.2852 59.9725 29.2236 178.6833 131 Q 4.3058 8.5504 118.2454 59.1402 28.0237 179.1226 132 G 3.6955 8.3510 108.1526 47.7635 0.0000 175.2153 133 C 4.3147 8.3876 119.6081 59.0253 40.4669 175.6973 134 Y 4.0208 8.7214 121.9830 60.7106 38.3033 177.7103 135 N 4.2655 8.3456 117.4640 56.3398 38.6999 177.2219 136 I 3.3691 7.3939 121.2012 64.4503 37.1131 178.5882 137 I 3.5587 7.1428 119.1483 64.1113 36.9424 178.1330 138 A 3.7241 7.5367 121.7796 54.9339 18.0143 179.2448 139 K 3.7606 8.6580 119.1273 59.8875 32.0332 178.9751 140 G 3.6543 7.6320 104.4599 47.9442 0.0000 174.9640 141 I 3.9899 7.6886 121.5994 62.7600 37.8717 176.4615 142 T 4.4160 8.0231 109.8579 66.1760 68.4700 177.6464 143 G 3.8779 6.9423 109.9420 47.1094 0.0000 175.0404 144 S 4.6407 7.2628 123.1433 58.0871 62.1792 174.6947 145 D 4.3088 8.2949 115.8606 54.9075 39.1364 176.8294 146 A 4.4910 9.3259 121.3225 51.9906 22.8109 176.2187 147 A 4.1795 7.9409 125.4086 52.9595 19.1735 176.5614 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 A 8.12 4.34 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 4 C 8.23 4.80 0.00 2.86 2.89 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 5 A 9.05 4.24 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 6 M 8.42 3.99 0.00 2.11 2.04 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 2.64 2.67 0.00 7 L 7.75 3.93 0.00 1.70 1.67 0.91 0.96 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 8 E 8.17 3.89 0.00 2.12 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 2.36 2.40 0.00 9 R 7.92 3.67 0.00 1.94 1.86 0.00 3.09 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 1.53 1.90 0.00 10 A 8.00 3.97 1.33 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 0.00 0.00 11 K 8.34 3.84 0.00 1.87 1.89 0.00 1.63 0.00 0.00 1.62 0.00 0.00 3.06 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.37 1.43 7.81 12 V 7.91 3.09 1.63 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 -0.53 0.00 0.00 0.49 0.00 0.00 13 K 8.33 3.98 0.00 1.95 1.90 0.00 1.84 0.00 0.00 1.60 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.64 7.81 14 D 8.17 4.52 0.00 2.99 2.85 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 15 E 8.42 4.02 0.00 2.23 1.53 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 0.00 1.69 2.36 0.00 16 W 8.91 4.64 0.00 3.73 3.47 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 17 A 8.60 4.15 1.49 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 0.00 0.00 18 K 7.89 3.86 0.00 2.04 2.43 0.00 1.72 0.00 0.00 1.77 0.00 0.00 3.12 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.41 1.52 7.81 19 A 8.25 4.09 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 Y 7.75 3.13 0.00 1.43 2.06 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 21 G 7.31 3.70 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 0.00 0.00 0.00 22 I 8.07 4.00 1.79 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.56 0.84 0.00 0.00 23 G 7.02 3.83 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 0.00 0.00 0.00 24 A 8.00 4.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.89 3.98 1.25 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 0.00 0.00 26 R 7.41 3.99 0.00 1.81 1.78 0.00 2.21 0.00 0.00 2.66 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.41 0.00 27 S 8.08 4.14 0.00 3.91 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 28 K 7.99 3.83 0.00 1.90 2.06 0.00 1.71 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.46 1.48 7.81 29 F 8.69 4.09 0.00 3.26 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 30 G 8.80 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 0.00 0.00 0.00 31 D 8.55 4.48 0.00 2.90 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 A 8.03 3.77 1.14 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 0.00 0.00 0.00 33 L 7.66 3.72 0.00 0.95 1.47 0.07 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 34 W 7.98 3.49 0.00 3.38 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 35 R 7.87 3.90 0.00 1.94 1.99 0.00 3.04 0.00 0.00 3.13 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.67 0.00 36 N 7.70 3.86 0.00 2.48 1.89 0.00 0.00 6.65 7.76 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 37 V 7.15 3.31 1.65 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 1.05 0.00 0.00 -0.01 0.00 0.00 38 F 8.11 4.93 0.00 3.14 3.01 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 39 N 7.63 4.68 0.00 2.82 2.96 0.00 0.00 6.99 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 Y 8.38 4.63 0.00 3.02 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 41 A 8.22 4.78 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 42 P 0.00 4.85 0.00 2.29 2.39 0.00 3.94 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 1.98 0.00 43 N 8.23 4.51 0.00 2.88 2.93 0.00 0.00 7.06 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 44 A 8.24 4.31 1.70 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 0.00 0.00 45 R 7.47 2.82 0.00 1.32 1.58 0.00 2.77 0.00 0.00 2.91 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.50 0.00 46 D 7.36 4.33 0.00 2.79 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 47 I 7.32 3.78 1.77 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.53 0.36 0.00 0.00 48 F 8.28 4.84 0.00 3.24 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 49 E 8.16 4.12 0.00 2.13 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 0.00 2.34 2.32 0.00 50 S 8.14 4.24 0.00 3.88 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 51 V 7.55 4.34 2.17 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 0.68 0.00 0.00 1.20 0.00 0.00 52 N 8.12 4.12 0.00 2.92 2.83 0.00 0.00 7.02 7.04 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 53 S 7.71 3.78 0.00 3.68 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 K 8.03 3.84 0.00 1.72 1.87 0.00 1.68 0.00 0.00 1.56 0.00 0.00 2.88 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.39 1.34 7.81 55 D 7.36 4.64 0.00 2.72 2.55 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 56 M 8.45 3.90 0.00 2.03 2.03 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.72 0.00 57 A 8.05 4.76 1.33 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 0.00 0.00 58 S 8.32 4.39 0.00 4.24 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 59 P 0.00 4.25 0.00 2.30 2.38 0.00 3.75 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 2.10 2.09 0.00 60 E 8.30 3.96 0.00 2.14 2.13 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 0.00 2.44 2.48 0.00 61 F 8.34 4.25 0.00 3.37 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 62 K 8.54 3.87 0.00 1.84 1.85 0.00 1.75 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.49 1.53 7.81 63 A 8.41 3.97 1.42 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 0.00 0.00 0.00 64 H 7.69 3.97 0.00 3.06 2.97 0.00 5.81 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 65 I 7.29 3.27 1.83 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 0.20 -0.36 1.05 0.00 0.00 66 A 8.18 4.08 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 67 R 7.96 3.91 0.00 2.05 2.02 0.00 3.17 0.00 0.00 3.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.81 0.00 68 V 8.06 3.72 2.21 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 1.20 0.00 0.00 1.26 0.00 0.00 69 L 8.59 4.25 0.00 2.11 1.90 1.34 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 70 G 8.53 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 71 G 8.42 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 L 8.32 3.82 0.00 1.87 1.29 1.14 0.85 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 73 D 8.63 4.09 0.00 2.95 2.97 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 74 R 8.04 3.97 0.00 2.01 2.11 0.00 3.16 0.00 0.00 3.18 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.71 0.00 75 V 7.93 3.65 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 0.91 0.00 0.00 0.90 0.00 0.00 76 I 7.49 3.47 1.38 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.27 0.66 0.00 0.00 77 S 8.11 4.16 0.00 4.04 4.13 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 0.00 0.00 0.00 0.00 78 M 7.80 4.36 0.00 2.02 2.26 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 2.55 2.79 0.00 79 L 7.90 4.03 0.00 1.57 1.65 0.70 0.87 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 80 D 7.73 4.85 0.00 2.75 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 N 8.13 4.90 0.00 2.74 2.76 0.00 0.00 7.21 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 82 Q 8.56 3.91 0.00 2.07 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.47 0.00 0.00 0.00 0.00 0.00 2.43 2.39 0.00 83 A 8.22 3.69 1.27 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 0.00 0.00 0.00 84 T 7.76 3.80 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 1.19 0.00 0.00 85 L 7.91 3.83 0.00 1.95 1.87 0.87 1.09 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 86 D 8.55 4.26 0.00 2.86 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 87 A 7.60 3.94 1.33 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 0.00 0.00 88 D 8.49 4.26 0.00 2.83 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 89 L 8.44 3.92 0.00 1.86 1.63 0.85 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 90 A 8.50 3.94 1.35 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 0.00 0.00 0.00 91 H 8.41 4.05 0.00 3.33 3.56 0.00 5.80 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 92 L 8.25 4.02 0.00 1.89 1.73 0.92 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 93 K 8.13 4.06 0.00 1.99 1.97 0.00 1.63 0.00 0.00 1.70 0.00 0.00 2.88 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.65 1.50 7.81 94 S 7.76 4.14 0.00 4.04 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 95 Q 7.86 4.10 0.00 2.23 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.82 0.00 0.00 0.00 0.00 0.00 2.30 2.48 0.00 96 H 8.13 4.66 0.00 3.26 3.44 0.00 5.84 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 97 D 8.64 4.43 0.00 2.73 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 98 P 0.00 4.41 0.00 2.21 2.18 0.00 3.67 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 1.98 2.04 0.00 99 R 7.92 4.18 0.00 1.98 2.00 0.00 3.33 0.00 0.00 3.23 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.63 0.00 100 T 7.42 3.45 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 1.21 0.00 0.00 101 I 7.28 4.35 2.08 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.68 1.05 0.00 0.00 102 D 8.70 4.44 0.00 2.76 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 0.00 103 P 0.00 4.40 0.00 2.28 2.30 0.00 3.81 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 1.99 0.00 104 V 8.29 3.72 2.17 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 1.19 0.00 0.00 1.10 0.00 0.00 105 N 8.77 4.45 0.00 3.12 2.99 0.00 0.00 6.98 8.09 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 0.00 106 F 8.61 4.11 0.00 3.45 3.30 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 0.00 107 V 8.25 3.81 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 1.07 0.00 0.00 108 V 8.00 3.65 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 1.23 0.00 0.00 1.05 0.00 0.00 109 F 8.41 3.76 0.00 3.15 3.25 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 0.00 110 R 7.92 3.02 0.00 1.48 2.03 0.00 3.30 0.00 0.00 3.61 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.10 0.00 111 K 8.22 3.84 0.00 2.12 1.88 0.00 1.73 0.00 0.00 1.65 0.00 0.00 2.89 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.74 1.60 7.81 112 A 8.44 3.54 0.77 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 0.00 0.00 113 L 8.10 3.44 0.00 1.27 1.55 1.06 1.40 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 0.00 114 I 7.66 3.33 1.98 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 1.67 0.72 0.78 0.00 0.00 115 A 7.94 3.75 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 0.00 116 T 7.86 3.47 3.83 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 0.17 0.00 0.00 117 V 8.06 3.67 1.47 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 0.74 0.00 0.00 1.05 0.00 0.00 118 A 7.14 3.46 0.30 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 0.00 119 G 8.19 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 0.00 0.00 0.00 120 T 7.29 4.30 4.53 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 0.00 0.00 0.00 1.27 0.00 0.00 121 F 8.83 4.29 0.00 3.10 3.22 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 0.00 122 G 8.24 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 0.00 0.00 0.00 123 V 8.40 3.76 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 0.76 0.00 0.00 0.97 0.00 0.00 124 C 8.24 4.42 0.00 3.70 3.29 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 0.00 125 F 8.55 3.95 0.00 3.17 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 0.00 126 D 8.19 4.54 0.00 2.71 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 0.00 127 V 8.11 3.71 2.17 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 1.17 0.00 0.00 1.21 0.00 0.00 128 P 0.00 4.25 0.00 2.31 2.32 0.00 3.73 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.05 0.00 129 A 8.80 4.58 1.35 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 0.00 0.00 0.00 130 W 8.23 3.72 0.00 3.48 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 0.00 131 Q 8.55 4.31 0.00 2.19 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.52 2.82 0.00 132 G 8.35 3.70 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 0.00 0.00 0.00 133 C 8.39 4.31 0.00 2.73 2.94 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 0.00 0.00 0.00 134 Y 8.72 4.02 0.00 3.30 3.32 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 0.00 135 N 8.35 4.27 0.00 3.06 3.18 0.00 0.00 7.01 7.34 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 0.00 136 I 7.39 3.37 1.90 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.23 0.83 0.00 0.00 137 I 7.14 3.56 1.68 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 1.30 0.66 0.75 0.00 0.00 138 A 7.54 3.72 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 0.00 139 K 8.66 3.76 0.00 1.79 1.96 0.00 1.47 0.00 0.00 1.60 0.00 0.00 3.00 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.38 1.44 7.81 140 G 7.63 3.65 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 0.00 0.00 0.00 141 I 7.69 3.99 1.53 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 1.48 1.20 0.68 0.00 0.00 142 T 8.02 4.42 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 0.41 0.00 0.00 143 G 6.94 3.88 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 0.00 0.00 0.00 144 S 7.26 4.64 0.00 3.92 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 0.00 145 D 8.29 4.31 0.00 2.84 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 A 9.33 4.49 1.24 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 0.00 0.00 0.00 147 A 7.94 4.18 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