NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 S 4.2023 8.3344 115.2712 57.7323 64.1618 173.3337 5 V 3.9813 7.5817 120.8210 60.2315 32.0612 169.8754 6 V 4.2355 8.9643 128.3322 61.6374 34.0644 174.4319 7 K 4.7624 8.0517 122.3989 54.3041 35.7515 177.3850 8 S 4.1682 8.9485 118.0933 62.1340 62.7585 176.4161 9 E 4.5748 8.2149 113.5004 57.0920 29.3309 176.5303 10 D 4.6228 8.0279 118.8720 54.3249 41.3674 177.6277 11 Y 4.1046 7.5316 118.9508 60.0854 37.6922 177.7991 12 A 4.1212 6.7297 120.6329 53.0766 18.9163 176.8357 13 L 4.6797 7.3604 115.8165 51.8458 43.6791 174.8601 14 P 4.3937 0.0000 0.0000 63.1937 31.7733 175.6257 15 S 4.7819 8.1331 114.2646 56.6255 66.3585 172.4237 16 Y 4.4783 8.4826 121.5891 56.8373 39.2896 174.8970 17 V 4.1245 7.3472 119.0388 59.6654 35.4338 174.9267 18 D 4.5233 8.3293 124.3696 52.8344 40.5461 175.9339 19 R 4.4540 7.8246 122.6921 54.1228 34.0198 176.5625 20 R 3.5316 8.6066 122.4619 59.0786 30.1038 176.9494 21 D 4.8203 7.9573 113.4623 53.4537 40.4123 176.0611 22 Y 4.8424 8.2397 120.5249 55.3488 38.8583 172.4007 23 P 4.5545 0.0000 0.0000 65.2149 31.7776 177.1865 24 L 4.6618 7.2830 119.4433 51.4898 41.1678 174.0824 25 P 4.5832 0.0000 0.0000 62.4219 31.9301 176.7149 26 D 4.5764 8.7397 118.5035 56.9185 40.9164 176.6738 27 V 4.5085 7.4576 109.8299 59.5042 35.9219 173.9680 28 A 4.3477 8.1660 123.4500 51.4762 19.5154 176.9832 29 H 3.3953 7.9712 121.8834 58.2691 29.8310 175.7415 30 V 4.0813 7.5413 119.6758 60.8768 32.3369 174.8920 31 K 4.1567 8.5083 126.3058 57.0173 33.5599 175.9695 32 N 4.7396 7.9255 117.0155 51.5704 39.1598 173.9078 33 L 4.5103 8.1666 123.5845 53.3685 43.5854 177.7120 34 S 4.5653 8.1200 116.7246 57.0495 66.4564 174.5798 35 A 3.9593 8.4308 122.4392 55.7910 18.0308 179.9012 36 S 4.1180 8.0205 111.7892 61.5600 62.8979 176.6293 37 Q 3.9375 7.7046 120.5708 58.7903 28.3121 178.4189 38 K 3.8624 8.4440 119.7158 59.4494 32.0015 179.2070 39 A 4.0021 7.9448 120.7721 55.1355 18.3786 179.4308 40 L 3.9492 7.8521 118.8802 58.2929 41.9435 179.3279 41 K 4.0923 8.2391 117.5252 58.7693 32.1121 178.9872 42 E 4.1652 7.7659 119.2915 59.1875 29.6871 178.7981 43 K 3.9148 8.4419 119.9830 59.5038 31.9425 178.1648 44 E 4.3059 8.2268 118.4283 58.5615 29.6199 178.3495 45 K 4.2467 8.1821 117.2715 57.8935 32.3808 176.5854 46 A 4.4638 7.5322 122.0882 49.9253 20.9616 176.3749 47 S 3.9313 8.3979 112.6785 58.8353 62.5795 175.2385 48 W 4.7358 8.4138 126.5366 58.9868 29.2303 178.4303 49 S 4.3095 8.1294 114.6245 61.3530 62.3650 175.7914 50 S 4.3538 7.9321 115.3500 60.3130 62.9183 174.7135 51 L 4.3591 7.4451 120.9278 54.3422 41.9999 177.7087 52 S 4.5751 9.3972 118.8789 57.3559 65.6410 175.5926 53 I 3.6597 8.1232 121.7077 64.8187 36.8444 178.1172 54 D 4.4599 8.2203 119.0037 57.8539 40.5868 179.0245 55 E 4.0681 8.0769 118.3398 59.0982 29.5691 179.3380 56 K 3.9846 8.3491 119.0643 59.2108 31.9558 179.6797 57 V 3.6105 8.2246 119.1400 66.0440 31.3062 177.8199 58 E 3.9570 8.0023 117.8142 59.1947 29.1927 178.4609 59 L 4.0948 8.0201 119.3189 57.5413 41.0732 178.8509 60 Y 4.0272 7.8354 119.2614 60.7958 38.6738 178.0228 61 R 4.2720 8.2768 117.2629 58.5337 30.2921 178.3127 62 L 4.1629 7.3600 118.2665 56.8455 42.0068 178.7660 63 K 3.5165 7.4961 118.9995 57.2507 32.2045 176.3655 64 F 5.3278 7.1047 115.6516 55.4581 42.6498 174.8609 65 K 3.9320 9.8775 125.7595 58.5638 32.3881 176.9128 66 E 5.1156 7.9413 116.3694 54.0417 32.8508 176.6308 67 S 4.9173 9.0687 118.6029 57.1476 65.7058 175.4786 68 F 4.1906 9.1502 120.9848 60.6944 38.3592 177.8854 69 A 4.0507 8.0081 119.3201 55.1885 18.2483 179.1034 70 E 4.1070 7.9357 117.3215 59.7504 29.3816 179.5108 71 M 4.2087 8.4466 116.2686 57.7734 31.3555 177.2969 72 N 4.7371 7.7669 115.4803 51.9200 39.2251 175.4555 73 R 4.0971 6.9341 116.6496 56.2800 30.0728 176.2832 74 S 4.7107 8.3533 114.0305 57.2232 64.8159 173.1029 75 T 4.6710 8.1879 111.1404 60.2887 71.6623 173.1790 76 N 4.7801 8.3837 115.5252 53.3869 38.8411 177.1255 77 E 3.9960 8.0429 122.6800 58.9662 29.5323 178.6215 78 W 4.3456 8.4052 116.4426 59.6956 27.8332 178.0635 79 K 3.0422 6.1039 117.9054 59.2508 31.4244 179.3834 80 T 3.7456 7.4731 115.0985 66.6288 68.3909 176.5210 81 V 3.5976 7.9063 120.1821 66.0919 31.6612 178.0351 82 V 3.7651 8.7427 118.0994 66.1995 31.4152 178.2294 83 G 3.7227 8.3485 105.2589 47.8013 0.0000 175.4016 84 A 4.1725 8.2625 122.5408 54.8195 18.7162 179.2892 85 A 4.1397 8.4031 119.5563 55.9632 18.3355 179.8761 86 M 4.1141 8.1981 116.7877 58.4068 31.9737 178.7197 87 F 4.0312 8.0594 120.6417 61.3553 39.6803 177.2671 88 F 4.1281 8.7887 117.7221 60.3656 38.4733 177.8066 89 I 4.0416 7.8926 119.1734 64.0265 37.1846 178.2951 90 G 3.6137 8.3918 107.3200 47.5709 0.0000 175.6468 91 F 3.8946 8.0739 123.2304 61.2055 39.3503 177.2798 92 T 3.6862 7.8327 114.8981 66.5228 68.0808 176.2777 93 A 3.9747 7.6186 122.3149 55.0020 18.3450 179.6838 94 L 3.8448 7.6755 117.7352 57.6832 41.4952 179.7046 95 L 3.9058 7.2337 118.6346 57.6961 41.6476 179.3305 96 L 4.0494 8.0257 118.9965 57.6566 41.5154 179.5583 97 I 3.7139 8.0264 120.0609 64.1074 37.0046 178.1747 98 W 4.1907 8.3008 129.0844 60.4573 30.4675 177.1806 99 E 3.8922 8.7065 119.4708 59.5485 28.7970 178.8231 100 K 4.0811 7.9411 117.8267 59.8842 32.3194 177.8410 101 H 4.1093 7.9672 117.4984 58.0444 29.8621 175.6935 102 Y 4.4314 7.5382 115.3799 57.1290 39.2490 176.0139 103 V 3.9911 7.4395 118.3255 64.2327 33.2495 175.6615 104 Y 4.6373 7.5365 115.9699 57.6914 38.8074 175.8593 105 G 4.1667 8.3524 113.6381 43.9008 0.0000 171.3625 106 P 4.5007 0.0000 0.0000 61.9500 32.5136 175.6755 107 I 4.1484 7.7857 113.2298 58.7132 39.1703 173.4901 108 P 4.1884 0.0000 0.0000 63.1396 31.6921 177.3600 109 H 4.2803 8.5557 116.6548 57.8219 28.5573 176.8433 110 T 2.4800 6.9446 108.9500 62.5009 68.3732 174.5248 111 F 4.6759 7.3012 120.1057 57.3834 39.7245 176.3297 112 E 4.2078 8.0910 122.3837 55.8087 31.0671 176.9427 113 E 3.9721 9.0137 124.0546 59.7352 29.5920 179.1314 114 E 3.9273 8.2135 118.2747 59.0668 29.8200 178.0158 115 W 4.0375 8.3891 127.9605 60.6127 30.6478 177.7030 116 V 3.6997 8.3315 117.8188 66.1089 31.0299 177.5727 117 A 4.0540 8.0987 120.3532 55.3107 18.1352 179.8390 118 K 3.7946 7.9595 116.7013 59.6743 32.0979 179.4402 119 Q 3.8861 8.2395 120.1663 59.2916 28.8041 178.5644 120 T 3.9477 8.3787 117.2027 66.4445 68.5768 176.4544 121 K 3.6152 7.9378 121.4655 59.4048 32.1650 178.4952 122 R 3.7892 8.1919 119.2697 59.8776 29.8911 178.2588 123 M 3.9974 8.1317 118.2896 58.5050 32.0585 178.8228 124 L 4.1441 8.2300 119.2039 57.9394 41.4948 179.3075 125 D 4.4747 8.5090 118.5816 56.4694 40.8272 177.5305 126 M 4.3052 7.9057 115.2362 53.6624 32.9133 176.0124 127 K 4.2414 7.6122 117.2851 56.6776 30.1974 175.7288 128 V 3.5887 8.3394 119.1267 63.9607 33.2123 175.2082 129 A 3.7949 8.7662 129.3352 52.9097 15.5877 175.6632 130 P 4.6033 0.0000 0.0000 64.8954 32.6871 179.2034 131 I 4.0205 7.9524 119.1893 64.0664 37.4348 176.2293 132 Q 4.4572 8.1084 114.2813 57.4652 32.8872 175.9053 133 G 3.7501 7.7996 103.9789 48.2955 0.0000 173.1969 134 F 4.6667 8.4649 117.3225 58.9436 41.9386 178.0042 135 S 4.2739 9.3197 114.7167 61.5479 62.7059 176.6330 136 A 4.2570 8.2149 121.9235 54.1947 18.3255 177.9090 137 K 4.3878 7.9941 116.0703 55.8892 32.5332 175.5635 138 W 4.5780 7.9647 129.7457 55.2480 32.4118 174.8421 139 D 4.3442 7.3929 125.8154 52.8521 40.1578 176.5433 140 Y 4.4739 8.2669 125.6642 61.0912 38.1253 177.8042 141 D 4.4937 8.3040 119.4986 57.3754 41.1825 178.3896 142 K 3.7206 7.9459 115.3762 56.6749 32.7487 176.5035 143 N 4.0628 7.0462 116.7268 52.8865 37.4105 171.9051 144 E 3.7840 6.0576 115.7805 54.4757 33.9479 176.8612 145 W 4.3645 8.0366 120.8432 56.4269 29.7818 176.4416 146 K 3.8010 8.7161 124.4017 56.7515 32.1714 177.3189 147 K 4.1399 8.5400 122.9796 56.7510 32.0747 176.8509 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 4 S 8.33 4.20 0.00 3.75 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 5 V 7.58 3.98 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 0.82 0.00 0.00 0.93 0.00 0.00 6 V 8.96 4.24 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 0.91 0.00 0.00 0.98 0.00 0.00 7 K 8.05 4.76 0.00 1.85 1.75 0.00 1.88 0.00 0.00 1.82 0.00 0.00 2.87 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.41 1.42 7.81 8 S 8.95 4.17 0.00 3.93 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.21 4.57 0.00 2.09 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 2.26 2.28 0.00 10 D 8.03 4.62 0.00 3.03 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 11 Y 7.53 4.10 0.00 3.00 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 12 A 6.73 4.12 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 L 7.36 4.68 0.00 1.72 1.56 0.87 1.22 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 14 P 0.00 4.39 0.00 2.06 2.04 0.00 3.62 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 2.05 2.11 0.00 15 S 8.13 4.78 0.00 3.98 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 Y 8.48 4.48 0.00 2.99 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 17 V 7.35 4.12 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 0.72 0.00 0.00 0.93 0.00 0.00 18 D 8.33 4.52 0.00 2.57 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 R 7.82 4.45 0.00 1.83 1.92 0.00 3.09 0.00 0.00 3.25 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.55 0.00 20 R 8.61 3.53 0.00 1.74 2.04 0.00 3.27 0.00 0.00 3.22 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.47 0.00 21 D 7.96 4.82 0.00 2.84 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 22 Y 8.24 4.84 0.00 2.74 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 23 P 0.00 4.55 0.00 2.26 2.41 0.00 3.75 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.03 0.00 24 L 7.28 4.66 0.00 1.54 1.68 0.94 1.24 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 25 P 0.00 4.58 0.00 2.51 2.02 0.00 4.07 0.00 0.00 4.05 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 26 D 8.74 4.58 0.00 2.92 2.81 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 0.00 0.00 0.00 0.00 27 V 7.46 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 0.75 0.00 0.00 1.03 0.00 0.00 28 A 8.17 4.35 1.12 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 0.00 0.00 0.00 0.00 0.00 29 H 7.97 3.40 0.00 2.13 3.15 0.00 5.90 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 30 V 7.54 4.08 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 0.80 0.00 0.00 0.62 0.00 0.00 31 K 8.51 4.16 0.00 1.85 1.85 0.00 1.56 0.00 0.00 1.68 0.00 0.00 2.94 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.29 1.39 7.81 32 N 7.93 4.74 0.00 2.67 2.77 0.00 0.00 6.89 7.85 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 33 L 8.17 4.51 0.00 1.60 1.55 0.89 0.89 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 34 S 8.12 4.57 0.00 4.03 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.43 3.96 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 36 S 8.02 4.12 0.00 4.05 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 Q 7.70 3.94 0.00 2.41 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.79 0.00 0.00 0.00 0.00 0.00 2.51 2.38 0.00 38 K 8.44 3.86 0.00 1.93 1.86 0.00 1.66 0.00 0.00 1.64 0.00 0.00 3.12 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.72 7.81 39 A 7.94 4.00 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 40 L 7.85 3.95 0.00 1.90 1.89 0.93 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 41 K 8.24 4.09 0.00 1.89 1.86 0.00 1.82 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.63 1.59 7.81 42 E 7.77 4.17 0.00 2.23 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.46 0.00 43 K 8.44 3.91 0.00 1.81 2.00 0.00 1.66 0.00 0.00 1.69 0.00 0.00 2.92 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.50 1.50 7.81 44 E 8.23 4.31 0.00 2.13 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.40 0.00 45 K 8.18 4.25 0.00 1.88 1.88 0.00 1.76 0.00 0.00 1.74 0.00 0.00 3.39 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.53 1.62 7.81 46 A 7.53 4.46 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 47 S 8.40 3.93 0.00 3.80 3.76 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 48 W 8.41 4.74 0.00 3.48 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 49 S 8.13 4.31 0.00 3.90 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 50 S 7.93 4.35 0.00 4.12 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 51 L 7.45 4.36 0.00 1.91 1.63 1.00 1.50 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 52 S 9.40 4.58 0.00 4.00 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 53 I 8.12 3.66 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.87 0.90 0.00 0.00 54 D 8.22 4.46 0.00 2.72 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 E 8.08 4.07 0.00 2.29 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 2.33 2.35 0.00 56 K 8.35 3.98 0.00 1.97 1.82 0.00 1.68 0.00 0.00 1.57 0.00 0.00 2.92 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.42 1.64 7.81 57 V 8.22 3.61 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 1.11 0.00 0.00 0.92 0.00 0.00 58 E 8.00 3.96 0.00 2.03 1.97 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 2.32 2.36 0.00 59 L 8.02 4.09 0.00 1.89 1.63 0.84 0.79 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 60 Y 7.84 4.03 0.00 3.13 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 61 R 8.28 4.27 0.00 2.03 2.04 0.00 3.48 0.00 0.00 3.45 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.90 0.00 62 L 7.36 4.16 0.00 1.74 1.56 0.87 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 63 K 7.50 3.52 0.00 1.35 0.82 0.00 1.14 0.00 0.00 1.47 0.00 0.00 2.80 0.00 0.00 2.62 0.00 0.00 0.00 0.00 0.55 0.21 7.81 64 F 7.10 5.33 0.00 2.43 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 65 K 9.88 3.93 0.00 1.46 2.32 0.00 1.77 0.00 0.00 1.85 0.00 0.00 2.90 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.24 7.81 66 E 7.94 5.12 0.00 2.13 1.86 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 2.28 2.36 0.00 67 S 9.07 4.92 0.00 4.07 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 68 F 9.15 4.19 0.00 3.02 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 69 A 8.01 4.05 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 70 E 7.94 4.11 0.00 2.28 2.04 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 2.36 2.35 0.00 71 M 8.45 4.21 0.00 2.05 2.10 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 2.38 2.58 0.00 72 N 7.77 4.74 0.00 2.85 2.88 0.00 0.00 7.03 7.67 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 73 R 6.93 4.10 0.00 1.98 1.96 0.00 3.07 0.00 0.00 3.36 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.59 0.00 74 S 8.35 4.71 0.00 4.05 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 75 T 8.19 4.67 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 1.24 0.00 0.00 76 N 8.38 4.78 0.00 2.72 2.69 0.00 0.00 6.44 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 77 E 8.04 4.00 0.00 2.06 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 2.33 2.33 0.00 78 W 8.41 4.35 0.00 3.68 3.35 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 79 K 6.10 3.04 0.00 1.52 1.41 0.00 1.31 0.00 0.00 1.27 0.00 0.00 2.79 0.00 0.00 3.00 0.00 0.00 0.00 0.00 0.30 0.21 7.81 80 T 7.47 3.75 4.31 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 1.17 0.00 0.00 81 V 7.91 3.60 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 1.15 0.00 0.00 0.98 0.00 0.00 82 V 8.74 3.77 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 1.10 0.00 0.00 1.17 0.00 0.00 83 G 8.35 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.26 4.17 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 A 8.40 4.14 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 M 8.20 4.11 0.00 2.17 2.36 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.88 2.60 0.00 87 F 8.06 4.03 0.00 3.10 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 88 F 8.79 4.13 0.00 3.51 3.12 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 0.00 0.00 0.00 89 I 7.89 4.04 1.92 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 1.52 0.73 0.94 0.00 0.00 90 G 8.39 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 91 F 8.07 3.89 0.00 2.52 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 92 T 7.83 3.69 4.39 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 1.21 0.00 0.00 93 A 7.62 3.97 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 94 L 7.68 3.84 0.00 1.31 1.50 0.90 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 95 L 7.23 3.91 0.00 1.77 1.63 0.92 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 96 L 8.03 4.05 0.00 1.86 1.74 0.92 0.76 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 97 I 8.03 3.71 2.06 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 1.40 0.85 0.93 0.00 0.00 98 W 8.30 4.19 0.00 3.44 3.37 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 99 E 8.71 3.89 0.00 2.34 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 1.78 2.22 0.00 100 K 7.94 4.08 0.00 1.89 2.00 0.00 1.83 0.00 0.00 1.64 0.00 0.00 3.04 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.46 1.49 7.81 101 H 7.97 4.11 0.00 2.96 2.89 0.00 5.94 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 Y 7.54 4.43 0.00 1.43 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 V 7.44 3.99 1.81 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 0.54 0.00 0.00 0.67 0.00 0.00 104 Y 7.54 4.64 0.00 3.14 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 0.00 105 G 8.35 4.17 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 0.00 0.00 0.00 106 P 0.00 4.50 0.00 2.17 2.02 0.00 3.74 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.92 0.00 107 I 7.79 4.15 1.74 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.62 0.66 0.00 0.00 108 P 0.00 4.19 0.00 2.23 1.88 0.00 3.76 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 2.21 2.10 0.00 109 H 8.56 4.28 0.00 3.59 3.49 0.00 5.65 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 T 6.94 2.48 3.31 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 0.01 0.00 0.00 111 F 7.30 4.68 0.00 2.94 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 0.00 112 E 8.09 4.21 0.00 2.22 1.97 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 2.38 2.46 0.00 113 E 9.01 3.97 0.00 2.08 2.04 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 2.45 2.47 0.00 114 E 8.21 3.93 0.00 2.13 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.38 0.00 115 W 8.39 4.04 0.00 3.58 3.20 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 0.00 116 V 8.33 3.70 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 0.92 0.00 0.00 1.18 0.00 0.00 117 A 8.10 4.05 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 K 7.96 3.79 0.00 1.70 1.59 0.00 1.44 0.00 0.00 1.34 0.00 0.00 2.83 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.33 1.48 7.81 119 Q 8.24 3.89 0.00 2.19 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.81 0.00 0.00 0.00 0.00 0.00 2.35 2.42 0.00 120 T 8.38 3.95 4.51 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 121 K 7.94 3.62 0.00 1.69 1.82 0.00 1.55 0.00 0.00 1.49 0.00 0.00 2.84 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.53 1.26 7.81 122 R 8.19 3.79 0.00 1.77 2.01 0.00 3.06 0.00 0.00 3.08 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.62 0.00 123 M 8.13 4.00 0.00 1.77 2.15 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.42 0.00 124 L 8.23 4.14 0.00 1.65 1.41 -0.65 0.93 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 0.00 125 D 8.51 4.47 0.00 2.71 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 0.00 126 M 7.91 4.31 0.00 2.14 2.15 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.79 0.00 127 K 7.61 4.24 0.00 1.98 1.98 0.00 1.61 0.00 0.00 1.47 0.00 0.00 2.53 0.00 0.00 2.27 0.00 0.00 0.00 0.00 1.62 1.28 7.81 128 V 8.34 3.59 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 0.94 0.00 0.00 0.90 0.00 0.00 129 A 8.77 3.79 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 0.00 130 P 0.00 4.60 0.00 2.29 2.32 0.00 3.85 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 2.05 2.05 0.00 131 I 7.95 4.02 1.92 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.45 0.95 0.00 0.00 132 Q 8.11 4.46 0.00 2.02 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.00 0.00 0.00 0.00 0.00 0.00 2.29 2.38 0.00 133 G 7.80 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 F 8.46 4.67 0.00 3.22 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 0.00 135 S 9.32 4.27 0.00 4.15 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 0.00 136 A 8.21 4.26 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 0.00 137 K 7.99 4.39 0.00 2.04 1.89 0.00 1.58 0.00 0.00 1.51 0.00 0.00 2.85 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.42 1.40 7.81 138 W 7.96 4.58 0.00 2.86 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 0.00 139 D 7.39 4.34 0.00 2.31 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 0.00 0.00 0.00 140 Y 8.27 4.47 0.00 3.10 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 0.00 141 D 8.30 4.49 0.00 2.84 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 0.00 142 K 7.95 3.72 0.00 1.57 1.71 0.00 1.90 0.00 0.00 1.54 0.00 0.00 2.88 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.40 1.29 7.81 143 N 7.05 4.06 0.00 2.68 2.78 0.00 0.00 6.98 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 0.00 144 E 6.06 3.78 0.00 1.72 1.67 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 1.75 1.85 0.00 145 W 8.04 4.36 0.00 3.19 3.14 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 0.00 146 K 8.72 3.80 0.00 1.72 1.75 0.00 1.76 0.00 0.00 1.68 0.00 0.00 2.85 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.37 1.48 7.81 147 K 8.54 4.14 0.00 1.72 1.70 0.00 1.73 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.41 1.37 7.81