NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.4731 8.1814 115.4195 57.9898 64.2842 173.7509 3 G 3.6520 8.4515 108.5532 46.8992 0.0000 173.3918 4 L 4.6086 9.1732 121.6023 56.7393 43.1935 177.0152 5 D 4.4670 7.8931 118.6584 57.4308 40.4217 178.6676 6 K 3.6585 7.7867 118.3490 59.7996 32.1674 177.8470 7 Y 4.3991 7.2815 114.8351 59.1440 39.6519 175.7887 8 L 4.7805 8.4347 119.4923 51.7081 41.9018 173.3102 9 P 4.6168 0.0000 0.0000 63.5851 31.7294 178.0553 10 G 3.8880 8.9461 111.7147 45.3243 0.0000 173.0317 11 I 3.9573 7.7405 120.9033 61.3805 36.7582 175.4419 12 E 4.4814 8.7537 125.6623 57.4282 30.8958 176.3102 13 K 5.1975 7.9884 116.4417 54.6806 36.6457 175.4197 14 L 5.0354 8.9363 120.8890 52.8750 46.0845 176.5087 15 R 4.7452 8.8289 120.1864 56.4615 31.7677 176.1728 16 R 4.8547 8.6611 122.5382 54.5496 33.1207 174.9055 17 G 3.7238 8.9584 117.4037 47.4864 0.0000 173.1664 18 D 5.0058 8.9764 123.4751 53.6687 41.6349 176.2600 19 G 4.5325 8.1453 111.4481 44.5862 0.0000 172.3352 20 E 5.2980 8.4188 117.0876 55.4260 32.6512 175.0972 21 V 4.6953 8.9938 113.7374 59.7472 36.7241 174.5900 22 E 4.7146 8.6465 121.5096 55.7511 30.7123 178.1049 23 V 3.6734 9.2238 123.2402 66.1718 31.6898 178.7328 24 K 4.0491 8.2016 118.0639 59.2814 31.6974 178.5384 25 S 4.4305 7.8936 112.2420 59.8818 63.1071 175.2150 26 L 4.3810 8.2219 122.8422 53.9934 41.8231 176.1927 27 A 4.3309 7.1717 122.6205 53.7189 18.7386 178.4964 28 G 3.9994 9.1072 110.1235 45.0178 0.0000 173.6435 29 K 4.7461 7.7015 119.0872 54.7067 35.1201 175.2021 30 L 4.5484 8.4182 124.2440 54.4564 43.7523 175.5265 31 V 4.6764 8.5994 126.0327 61.1151 34.3086 173.9303 32 F 4.9508 8.9942 127.5488 56.2155 40.8633 174.9775 33 F 4.9435 9.2202 123.9643 56.7890 40.3598 174.1737 34 Y 5.0626 8.8979 126.5993 56.1045 40.5854 174.3191 35 F 5.4225 9.1336 127.1868 55.8206 40.6239 175.2609 36 S 4.4767 8.2019 116.7404 57.8641 66.2134 172.4837 37 A 5.0898 7.7449 121.8622 50.5154 21.5452 177.7485 38 S 3.0473 8.8627 115.2367 60.3440 63.0457 175.6580 39 W 4.4278 6.7747 113.7586 56.8872 28.5511 175.3065 40 C 4.4733 7.2965 121.2022 55.3350 40.0203 171.8911 41 P 4.3358 0.0000 0.0000 65.2882 31.0850 176.8373 42 P 4.3850 0.0000 0.0000 65.3913 31.3717 178.8992 43 C 4.4729 7.9293 117.0209 59.8052 39.8213 175.6919 44 R 4.0254 7.7119 120.0955 59.1459 29.7225 178.2162 45 G 3.8638 8.0877 104.4099 46.5261 0.0000 175.4677 46 F 4.3119 7.8620 122.6116 61.1689 39.3112 177.2294 47 T 3.8916 8.2646 115.8733 66.3856 68.2915 174.4453 48 P 4.1604 0.0000 0.0000 66.1767 31.0661 178.3247 49 Q 3.8833 7.2985 117.3079 58.5692 28.4796 178.3621 50 L 3.8641 7.2582 121.3727 57.7125 42.0163 178.8950 51 I 3.8838 8.1533 120.4276 64.4920 37.1789 177.9491 52 E 3.9696 8.5324 120.4084 59.0576 29.3849 178.5938 53 F 4.2395 8.3499 120.7025 61.5031 39.5428 176.1391 54 Y 4.4066 8.7373 119.4591 61.3588 38.4081 178.1360 55 D 4.4138 8.7095 118.2982 57.1223 40.9087 178.8316 56 K 3.7120 7.5050 117.8276 58.7478 32.2399 178.0417 57 F 4.8501 7.8076 114.2776 56.1695 40.2140 177.0528 58 H 2.5800 7.7438 118.8985 57.5871 28.3610 177.8652 59 E 3.6287 7.2917 119.7100 59.0124 29.6606 179.0866 60 S 4.0775 7.7434 113.0649 60.9641 63.3965 175.5010 61 K 4.1221 8.3116 117.9236 55.4221 32.7215 175.8471 62 N 4.0678 7.5837 116.4506 54.5367 37.2005 172.0268 63 F 5.6613 8.0116 112.5186 55.4118 42.1678 175.0816 64 E 5.1704 9.8003 119.5960 54.6274 33.7473 174.1380 65 V 4.9201 9.3597 123.1133 61.0558 35.1449 174.5550 66 V 4.7446 8.7620 126.6060 60.8628 34.6633 174.2569 67 F 5.0319 9.8171 132.2763 58.8449 40.6663 173.6831 68 C 4.9297 9.3449 124.5461 57.8136 29.7886 173.0392 69 T 4.3262 7.8766 118.2607 61.6252 67.7875 173.7804 70 W 5.1597 8.9791 126.6957 56.6913 30.0715 176.1742 71 D 5.0888 9.0638 121.6060 54.7898 40.7446 176.1609 72 E 4.7066 9.1757 121.3087 56.4169 31.4872 175.9747 73 E 4.6112 8.1746 120.2924 54.6043 31.4892 175.9560 74 E 2.7664 8.4581 126.7479 58.9875 29.7142 178.5107 75 D 4.5220 8.0810 118.8843 56.8976 40.9411 178.7198 76 G 3.7020 8.1001 105.9526 47.7576 0.0000 175.2181 77 F 4.5645 8.4529 123.5048 61.0471 39.4116 176.9339 78 A 4.1784 8.7288 120.8598 55.2534 17.9778 179.8308 79 G 3.5819 8.0640 103.0491 48.1769 0.0000 175.0271 80 Y 4.3682 8.1795 122.0252 60.3161 38.7619 177.5431 81 F 4.0512 8.5360 121.9480 60.9125 39.1648 176.9540 82 A 3.7171 8.0231 120.1514 54.5261 18.1766 178.2785 83 K 3.9470 7.2879 114.2316 57.0903 32.5709 176.6383 84 M 3.5845 7.1548 119.5230 52.6676 33.5913 174.1415 85 P 4.3514 0.0000 0.0000 62.1407 32.7354 175.4518 86 W 4.9824 6.2040 117.2990 56.0149 31.0309 174.6689 87 L 5.3417 8.8822 118.9589 54.0597 44.3689 175.3355 88 A 5.3020 8.9026 120.4352 50.2577 22.9960 175.8717 89 V 3.9520 8.3922 120.8500 62.0607 32.1774 174.5760 90 P 4.3502 0.0000 0.0000 62.6749 32.0027 176.9044 91 F 3.3346 8.5956 123.4371 61.0840 39.2408 177.1734 92 A 4.0282 8.0496 121.7325 54.2958 18.7101 177.4187 93 Q 4.6433 7.8122 116.2803 55.5685 29.5473 178.2498 94 S 3.9865 7.4361 116.6154 61.3928 62.8130 175.6840 95 E 3.8355 8.0272 121.6487 59.1721 29.2982 178.5217 96 A 3.9862 7.8657 120.4465 55.0689 18.3412 179.8353 97 V 3.6132 7.5602 116.3925 66.2560 31.7174 178.0966 98 Q 3.9606 8.4753 118.2748 58.8994 28.3963 179.0921 99 K 3.9828 8.2044 119.6012 59.2712 32.0629 179.2316 100 L 3.9039 8.2715 121.0647 58.0991 41.9023 179.0227 101 S 3.9693 8.9842 115.6856 61.6040 62.7232 176.7050 102 K 3.9226 8.0627 122.2399 59.4399 31.6794 178.2120 103 H 3.9633 8.0898 118.0805 59.1523 29.8004 176.3513 104 F 4.7784 7.8730 115.9171 56.2390 39.4679 175.3327 105 N 4.0610 8.2309 115.2334 54.1465 36.4060 175.6828 106 V 3.6539 8.0385 117.7970 63.1565 31.3432 175.1889 107 E 4.4810 8.5927 127.2058 57.1777 30.1567 176.2121 108 S 4.7661 7.3371 110.9892 57.6314 65.1461 174.4235 109 I 4.3227 7.8001 113.9911 57.8450 40.1175 173.4184 110 P 4.5942 0.0000 0.0000 63.4186 32.3669 175.6088 111 T 4.6695 8.5642 116.8641 62.0694 73.3575 172.5157 112 L 5.4845 8.5597 126.3610 53.4246 45.1920 175.3953 113 I 4.6902 8.9954 126.3519 59.4401 40.6726 174.5299 114 G 4.0112 9.5013 114.4656 44.3181 0.0000 172.5034 115 V 4.9290 8.4921 116.0732 58.9837 36.6194 174.2938 116 D 4.6952 9.0789 123.4996 54.1763 41.6652 177.0701 117 A 4.0268 8.9304 128.5724 55.5695 18.8649 179.3479 118 D 4.3839 8.4216 115.3305 57.6120 41.1132 179.3041 119 S 4.3109 8.9768 111.1914 58.3696 63.7142 175.3687 120 G 4.1588 8.4806 108.7976 45.7882 0.0000 173.4152 121 D 4.7291 8.0241 119.7912 53.9235 42.3687 175.7723 122 V 4.0802 8.4237 121.3671 63.0130 31.5667 175.5541 123 V 4.0705 9.0264 128.7983 64.8126 33.3004 175.5428 124 T 5.1199 7.4823 113.2296 60.9718 70.5944 174.0774 125 T 4.6328 9.5377 117.1550 61.3243 69.5822 174.3514 126 R 4.5052 7.7459 117.7603 55.7778 30.1696 177.5638 127 A 3.7196 8.0311 124.6461 55.1468 18.0611 180.0971 128 R 3.5572 7.7800 115.7659 59.4299 30.0474 178.1107 129 A 4.0068 7.5060 119.2890 55.0700 19.0585 179.2011 130 T 3.7261 7.6412 108.3245 64.1844 68.8782 176.8407 131 L 3.2461 7.0212 123.2645 57.9177 41.7875 179.4471 132 V 3.6279 7.5547 110.5344 63.9179 31.6586 176.9127 133 K 4.3759 7.6053 116.2109 56.5911 32.7636 176.8716 134 D 4.8915 7.9031 119.1520 51.9147 41.3956 173.7197 135 P 4.4689 0.0000 0.0000 65.2739 31.8968 178.1394 136 E 4.6026 8.4491 116.1858 56.1729 29.7144 176.0904 137 G 4.0385 8.6789 107.6237 46.7630 0.0000 175.9677 138 E 4.0373 9.4136 121.8222 58.2894 29.8675 178.2487 139 Q 4.4718 8.9403 116.5388 55.1427 29.2907 175.2297 140 F 2.5056 6.9951 119.9885 57.3627 39.6253 172.6400 141 P 2.9700 0.0000 0.0000 61.6434 31.3895 176.0634 142 W 3.5855 7.4045 115.8263 57.7048 26.7920 175.0105 143 K 4.1250 7.8952 115.5362 57.1340 32.4356 178.1913 144 D 4.5462 8.8381 123.8261 54.0564 41.6153 176.2177 145 A 4.2617 8.5093 124.5896 51.1289 18.8546 175.9756 146 P 4.3010 0.0000 0.0000 63.7009 32.0872 176.2906 147 L 3.6955 8.6037 116.2647 55.2832 38.8595 173.7378 148 E 4.7566 7.8122 117.6372 54.8641 33.0253 174.2260 149 H 5.0508 8.3065 115.2865 55.1120 31.3297 174.3775 150 H 4.4020 8.5166 118.2494 56.4815 29.5705 173.5689 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 2 S 8.18 4.47 0.00 4.37 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 G 8.45 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 4 L 9.17 4.61 0.00 1.87 2.00 1.02 1.44 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 5 D 7.89 4.47 0.00 2.78 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 6 K 7.79 3.66 0.00 1.42 1.04 0.00 1.44 0.00 0.00 0.78 0.00 0.00 3.05 0.00 0.00 2.90 0.00 0.00 0.00 0.00 0.74 1.22 7.81 7 Y 7.28 4.40 0.00 3.35 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 8 L 8.43 4.78 0.00 1.74 1.64 1.13 0.92 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 9 P 0.00 4.62 0.00 2.15 2.04 0.00 3.45 0.00 0.00 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.88 0.00 10 G 8.95 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 11 I 7.74 3.96 1.99 0.00 0.00 0.87 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 0.91 0.99 0.00 0.00 12 E 8.75 4.48 0.00 1.95 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 2.38 2.56 0.00 13 K 7.99 5.20 0.00 1.62 1.76 0.00 1.72 0.00 0.00 1.75 0.00 0.00 2.98 0.00 0.00 3.29 0.00 0.00 0.00 0.00 1.41 1.56 7.81 14 L 8.94 5.04 0.00 1.64 1.75 1.06 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 15 R 8.83 4.75 0.00 1.87 2.12 0.00 3.22 0.00 0.00 3.26 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.67 0.00 16 R 8.66 4.85 0.00 2.02 1.85 0.00 3.33 0.00 0.00 3.24 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.69 0.00 17 G 8.96 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 18 D 8.98 5.01 0.00 2.67 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 19 G 8.15 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 0.00 0.00 0.00 0.00 20 E 8.42 5.30 0.00 2.00 1.95 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 2.23 2.40 0.00 21 V 8.99 4.70 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 0.84 0.00 0.00 1.11 0.00 0.00 22 E 8.65 4.71 0.00 1.93 1.89 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 2.41 2.28 0.00 23 V 9.22 3.67 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 1.19 0.00 0.00 1.09 0.00 0.00 24 K 8.20 4.05 0.00 1.87 1.89 0.00 1.75 0.00 0.00 1.89 0.00 0.00 3.03 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.56 1.54 7.81 25 S 7.89 4.43 0.00 4.09 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 26 L 8.22 4.38 0.00 1.82 1.77 0.99 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 27 A 7.17 4.33 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 28 G 9.11 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 0.00 0.00 0.00 29 K 7.70 4.75 0.00 1.93 1.79 0.00 1.71 0.00 0.00 1.62 0.00 0.00 2.82 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.62 1.54 7.81 30 L 8.42 4.55 0.00 1.75 1.60 0.63 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 31 V 8.60 4.68 1.85 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 0.42 0.00 0.00 0.89 0.00 0.00 32 F 8.99 4.95 0.00 3.08 2.82 0.00 0.00 0.00 0.00 0.00 0.00 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 F 9.22 4.94 0.00 2.94 2.33 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 34 Y 8.90 5.06 0.00 2.66 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 35 F 9.13 5.42 0.00 2.71 2.39 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 36 S 8.20 4.48 0.00 2.72 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 A 7.74 5.09 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 S 8.86 3.05 0.00 3.75 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 39 W 6.77 4.43 0.00 3.48 3.27 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 40 C 7.30 4.47 0.00 1.95 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 41 P 0.00 4.34 0.00 2.25 2.13 0.00 3.77 0.00 0.00 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.25 0.00 42 P 0.00 4.39 0.00 2.23 2.30 0.00 3.61 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 2.14 2.04 0.00 43 C 7.93 4.47 0.00 3.09 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 44 R 7.71 4.03 0.00 1.81 2.01 0.00 3.28 0.00 0.00 3.26 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.70 0.00 45 G 8.09 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 46 F 7.86 4.31 0.00 3.26 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 47 T 8.26 3.89 4.36 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 1.08 0.00 0.00 48 P 0.00 4.16 0.00 2.21 2.27 0.00 3.66 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 2.22 2.06 0.00 49 Q 7.30 3.88 0.00 1.95 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.86 0.00 0.00 0.00 0.00 0.00 2.33 2.30 0.00 50 L 7.26 3.86 0.00 0.86 1.33 0.54 -0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 51 I 8.15 3.88 1.94 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 0.33 0.73 0.00 0.00 52 E 8.53 3.97 0.00 2.01 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 2.35 2.30 0.00 53 F 8.35 4.24 0.00 3.41 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 54 Y 8.74 4.41 0.00 3.65 3.39 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 55 D 8.71 4.41 0.00 2.61 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 56 K 7.50 3.71 0.00 0.96 0.74 0.00 1.06 0.00 0.00 1.29 0.00 0.00 2.90 0.00 0.00 2.96 0.00 0.00 0.00 0.00 0.98 1.25 7.81 57 F 7.81 4.85 0.00 2.68 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 58 H 7.74 2.58 0.00 2.26 1.95 0.00 5.26 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 E 7.29 3.63 0.00 1.76 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 0.00 2.11 1.56 0.00 60 S 7.74 4.08 0.00 3.95 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 61 K 8.31 4.12 0.00 1.69 1.41 0.00 0.63 0.00 0.00 0.69 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.11 1.04 7.81 62 N 7.58 4.07 0.00 2.99 2.85 0.00 0.00 6.65 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 F 8.01 5.66 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 64 E 9.80 5.17 0.00 2.17 1.89 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 2.34 2.46 0.00 65 V 9.36 4.92 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 1.01 0.00 0.00 66 V 8.76 4.74 2.22 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 1.15 0.00 0.00 0.99 0.00 0.00 67 F 9.82 5.03 0.00 3.55 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 68 C 9.34 4.93 0.00 2.28 2.72 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 69 T 7.88 4.33 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 1.27 0.00 0.00 70 W 8.98 5.16 0.00 3.18 3.57 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 71 D 9.06 5.09 0.00 3.15 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 72 E 9.18 4.71 0.00 2.04 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.42 0.00 73 E 8.17 4.61 0.00 2.11 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 2.43 2.36 0.00 74 E 8.46 2.77 0.00 1.17 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 0.00 2.17 1.53 0.00 75 D 8.08 4.52 0.00 2.75 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 76 G 8.10 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 77 F 8.45 4.56 0.00 3.43 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 78 A 8.73 4.18 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 79 G 8.06 3.58 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 0.00 0.00 0.00 80 Y 8.18 4.37 0.00 3.15 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 81 F 8.54 4.05 0.00 2.58 2.72 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 82 A 8.02 3.72 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 83 K 7.29 3.95 0.00 1.49 1.60 0.00 1.65 0.00 0.00 1.61 0.00 0.00 2.99 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.35 1.43 7.81 84 M 7.15 3.58 0.00 0.51 1.27 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.59 0.00 85 P 0.00 4.35 0.00 2.04 1.85 0.00 2.20 0.00 0.00 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 1.50 0.00 86 W 6.20 4.98 0.00 3.36 1.98 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 87 L 8.88 5.34 0.00 1.86 1.90 1.08 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 88 A 8.90 5.30 0.85 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 89 V 8.39 3.95 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.99 0.00 0.00 90 P 0.00 4.35 0.00 2.20 2.01 0.00 3.67 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.14 0.00 91 F 8.60 3.33 0.00 1.63 2.72 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 92 A 8.05 4.03 1.30 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 93 Q 7.81 4.64 0.00 1.99 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.00 6.74 0.00 0.00 0.00 0.00 0.00 2.23 2.42 0.00 94 S 7.44 3.99 0.00 3.39 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 95 E 8.03 3.84 0.00 1.94 1.87 0.00 0.00 0.00 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 2.32 0.00 96 A 7.87 3.99 1.34 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 0.00 0.00 97 V 7.56 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 1.39 0.00 0.00 0.90 0.00 0.00 98 Q 8.48 3.96 0.00 2.17 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.59 0.00 0.00 0.00 0.00 0.00 2.24 2.57 0.00 99 K 8.20 3.98 0.00 1.93 1.81 0.00 1.63 0.00 0.00 1.54 0.00 0.00 2.86 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.48 7.81 100 L 8.27 3.90 0.00 1.84 1.96 0.74 0.38 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 0.00 101 S 8.98 3.97 0.00 4.08 4.15 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 0.00 102 K 8.06 3.92 0.00 1.80 1.89 0.00 1.60 0.00 0.00 1.54 0.00 0.00 2.88 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.40 1.41 7.81 103 H 8.09 3.96 0.00 3.07 3.16 0.00 5.99 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 F 7.87 4.78 0.00 3.01 2.92 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 0.00 105 N 8.23 4.06 0.00 2.87 2.88 0.00 0.00 6.84 8.51 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 0.00 106 V 8.04 3.65 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 0.47 0.00 0.00 0.31 0.00 0.00 107 E 8.59 4.48 0.00 2.04 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 2.49 2.25 0.00 108 S 7.34 4.77 0.00 3.93 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 0.00 109 I 7.80 4.32 1.44 0.00 0.00 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.43 -0.53 0.00 0.00 110 P 0.00 4.59 0.00 1.91 2.15 0.00 3.60 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.79 0.00 111 T 8.56 4.67 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 1.20 0.00 0.00 112 L 8.56 5.48 0.00 1.60 1.52 0.80 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 113 I 9.00 4.69 1.91 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.64 0.08 0.00 0.00 114 G 9.50 4.01 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 0.00 0.00 0.00 115 V 8.49 4.93 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 0.56 0.00 0.00 0.90 0.00 0.00 116 D 9.08 4.70 0.00 2.76 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 0.00 117 A 8.93 4.03 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 0.00 118 D 8.42 4.38 0.00 2.64 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 0.00 119 S 8.98 4.31 0.00 4.13 4.01 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 0.00 120 G 8.48 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 D 8.02 4.73 0.00 2.68 2.66 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 0.00 0.00 0.00 0.00 122 V 8.42 4.08 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 1.26 0.00 0.00 123 V 9.03 4.07 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 0.77 0.00 0.00 0.83 0.00 0.00 124 T 7.48 5.12 4.41 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 1.37 0.00 0.00 125 T 9.54 4.63 4.19 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 1.14 0.00 0.00 126 R 7.75 4.51 0.00 1.86 2.06 0.00 2.75 0.00 0.00 3.16 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.47 0.00 127 A 8.03 3.72 1.30 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 0.00 128 R 7.78 3.56 0.00 1.44 1.69 0.00 3.11 0.00 0.00 2.90 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.95 0.00 129 A 7.51 4.01 1.20 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 0.00 0.00 130 T 7.64 3.73 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 1.07 0.00 0.00 131 L 7.02 3.25 0.00 0.91 1.42 0.24 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 132 V 7.55 3.63 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 0.91 0.00 0.00 0.95 0.00 0.00 133 K 7.61 4.38 0.00 1.71 1.83 0.00 1.64 0.00 0.00 1.61 0.00 0.00 2.88 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.39 1.29 7.81 134 D 7.90 4.89 0.00 2.86 2.84 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 0.00 135 P 0.00 4.47 0.00 2.37 2.28 0.00 3.89 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.06 0.00 136 E 8.45 4.60 0.00 2.11 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.36 0.00 137 G 8.68 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 0.00 0.00 0.00 138 E 9.41 4.04 0.00 2.13 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 2.35 2.30 0.00 139 Q 8.94 4.47 0.00 2.42 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.87 6.93 0.00 0.00 0.00 0.00 0.00 2.34 2.36 0.00 140 F 7.00 2.51 0.00 2.24 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 0.00 141 P 0.00 2.97 0.00 1.56 0.74 0.00 3.65 0.00 0.00 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.59 0.00 142 W 7.40 3.59 0.00 3.55 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 0.00 143 K 7.90 4.12 0.00 1.59 1.72 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.86 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.35 1.35 7.81 144 D 8.84 4.55 0.00 2.43 2.41 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 0.00 145 A 8.51 4.26 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 0.00 146 P 0.00 4.30 0.00 2.19 2.08 0.00 3.88 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 1.99 1.99 0.00 147 L 8.60 3.70 0.00 1.83 1.84 0.92 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 148 E 7.81 4.76 0.00 1.89 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 0.00 2.35 2.23 0.00 149 H 8.31 5.05 0.00 3.04 3.16 0.00 5.91 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 0.00 150 H 8.52 4.40 0.00 3.11 3.17 0.00 5.93 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