NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 P 4.3313 0.0000 0.0000 62.6397 34.0904 178.2828 4 A 3.8172 7.6784 120.2062 54.5617 18.4292 177.6733 5 A 4.2448 8.8115 121.8027 54.9470 18.7225 178.3095 6 R 3.9491 7.7733 116.1353 59.0030 30.0604 178.8949 7 R 4.1557 7.9246 119.4781 58.9884 29.9645 178.3582 8 R 3.9376 8.3920 117.7283 59.3845 30.0982 178.7487 9 A 4.0469 8.3609 120.5709 55.4709 18.4097 179.9442 10 R 3.9683 8.6781 116.8384 59.3422 30.2484 179.1613 11 E 4.1061 8.5515 118.5901 59.8654 29.5796 179.3238 12 C 4.2054 8.4583 116.6870 62.6004 28.0547 176.0693 13 A 4.1275 8.1994 122.6754 54.7813 17.8652 179.8580 14 V 3.3992 7.7509 116.8687 66.1907 31.5146 178.1710 15 Q 3.8661 7.5728 116.9004 59.1192 28.6699 178.9387 16 A 4.1445 8.3228 121.9790 55.2127 18.3890 179.6990 17 L 4.0922 8.4462 117.9508 57.6988 41.7976 178.8582 18 Y 4.0043 8.5261 120.1842 60.8496 38.6685 178.1563 19 S 4.2571 8.5332 116.3189 61.8230 63.0282 176.8202 20 W 4.2066 8.4442 130.5626 60.5664 30.1980 178.0492 21 Q 3.4647 7.9937 117.2393 58.5861 28.1599 178.2998 22 L 3.9869 7.2866 118.9059 57.2208 41.8881 178.9392 23 S 4.2791 8.2206 113.2932 58.8715 63.5577 174.6044 24 Q 3.0107 7.9175 119.0050 56.2285 26.6661 173.6690 25 N 4.6235 7.9116 113.9154 52.8556 39.4304 175.5170 26 D 4.5703 8.5607 119.8663 54.6113 42.4876 177.7795 27 I 3.5909 8.4675 123.2164 63.9987 38.0143 177.9093 28 A 4.0087 7.9508 121.2514 55.4260 18.2427 179.2341 29 D 4.4077 8.0788 116.8344 57.2491 40.9769 178.9809 30 V 3.7036 7.9682 118.9261 65.9555 31.5369 177.5067 31 E 4.0148 8.6002 119.3987 59.6773 29.5020 178.1285 32 Y 3.9803 8.1002 119.3392 60.8773 38.7668 178.1676 33 Q 4.1538 8.5616 118.9738 58.8263 28.7606 178.2560 34 F 3.8438 8.4700 121.6941 61.5468 39.2789 177.3080 35 L 3.9760 8.2151 116.7494 57.5106 41.3869 178.9677 36 A 4.0746 7.7127 120.0675 53.9775 18.6833 178.4603 37 E 4.4078 8.2396 114.9887 55.8397 31.2190 176.3125 38 Q 4.1434 7.3783 117.6964 54.0046 30.4549 174.2791 39 D 4.5966 8.1756 118.7954 53.9260 41.3630 176.0669 40 V 4.4865 8.0513 119.4360 60.7993 33.0937 177.4787 41 K 3.8963 8.2457 124.4353 58.8985 31.6952 176.9048 42 D 4.9388 7.9812 117.0666 52.6778 39.9527 174.6076 43 V 4.3221 7.2553 118.5158 61.8391 33.3681 176.4839 44 D 4.6499 8.2904 125.6740 53.8085 39.5708 176.7033 45 V 3.7873 8.0976 125.3099 65.2301 31.8233 176.9699 46 L 3.9761 8.0127 119.8044 58.4544 42.0213 178.2549 47 Y 4.1335 8.8164 119.8096 60.3585 38.6953 177.2276 48 F 4.1384 8.7632 122.3164 61.4596 39.3747 176.8881 49 R 3.4734 8.2022 118.0446 59.4602 29.7759 177.9652 50 E 3.7660 8.0091 118.0544 59.5264 29.5018 179.4198 51 L 3.3486 7.4989 118.8046 57.5360 41.6125 179.5831 52 L 3.4731 7.2620 118.3005 57.7318 41.5707 179.5869 53 A 3.7661 7.7581 120.7415 54.6973 18.0109 179.9213 54 G 2.8555 7.4282 103.6748 47.6946 0.0000 175.8650 55 V 3.5754 7.0783 120.9655 65.4905 31.3465 178.0122 56 A 2.8118 7.2924 119.2804 53.9096 18.0468 178.5959 57 T 4.4730 7.2876 105.3511 61.6428 69.6161 174.5688 58 N 5.1982 7.8516 118.6811 52.9092 40.4996 176.6669 59 T 3.9172 8.4246 111.2537 65.1432 68.9271 175.4955 60 A 4.0005 8.1033 123.6296 54.7821 18.1991 178.8741 61 Y 4.0704 7.9600 116.5670 60.8289 39.2364 177.4961 62 L 3.9238 8.6100 120.2640 57.9518 41.7852 179.3065 63 D 4.5263 8.9429 119.2052 57.1754 40.4373 179.1187 64 G 3.5808 7.7350 105.4900 47.5247 0.0000 175.6017 65 L 4.0877 7.4171 119.9889 57.0382 41.8111 178.3505 66 M 4.3606 7.7044 117.5949 57.2781 32.7190 177.3604 67 K 3.7762 7.9273 120.2890 59.1999 32.1145 176.7404 68 P 4.1831 0.0000 0.0000 64.7874 30.8951 176.1250 69 Y 4.8227 7.2245 115.3864 57.8060 38.0371 175.9055 70 L 4.9375 7.7842 116.6637 54.4972 43.4525 177.4793 71 S 4.5716 8.0672 115.0221 59.2167 62.7904 174.5268 72 R 4.5487 7.9716 114.1801 55.8080 29.6373 175.2630 73 L 3.7462 8.1126 116.4752 56.3814 39.4539 173.7647 74 L 4.2770 7.6452 117.3114 52.8341 42.8873 176.6390 75 E 3.9901 8.9989 125.2167 58.1830 28.5083 176.5101 76 E 4.0440 9.0557 120.9630 55.3484 31.1202 170.8608 77 L 3.5170 7.3322 126.2129 54.8397 42.9052 174.7902 78 G 3.8893 8.1693 113.9354 44.1206 0.0000 173.3825 79 Q 4.0513 8.7636 121.8036 58.9079 28.8112 179.7553 80 V 3.7623 7.9242 118.6657 65.9464 31.2749 177.7033 81 E 4.0533 8.2443 117.8554 59.4418 29.4609 178.8085 82 K 3.9099 8.4783 119.7100 59.8386 32.2220 178.5198 83 A 4.1358 8.0559 120.5307 55.0579 18.2265 179.8709 84 V 3.5575 7.9189 116.7871 66.1826 31.6709 178.2261 85 L 4.0071 8.6235 119.0807 57.9716 41.3649 179.8052 86 R 4.0241 8.1685 117.9477 59.1588 29.9799 179.1458 87 I 3.6999 7.7846 119.2499 64.3044 37.0811 178.2270 88 A 4.0172 8.1730 121.5310 55.3800 18.2721 179.6746 89 L 3.9129 8.3834 117.8489 57.9352 41.5589 179.1823 90 Y 4.0048 8.4339 119.8226 60.7710 38.8184 178.0146 91 E 3.9720 8.4372 119.4209 59.4535 29.3789 179.3611 92 L 4.0109 7.9721 118.1851 57.6357 41.7838 179.1328 93 S 4.5011 8.0164 112.3633 59.3167 63.7291 174.9373 94 K 4.3684 7.9346 118.8755 55.9059 33.4912 176.6971 95 R 4.5828 7.6754 118.8409 53.5418 30.0972 176.0375 96 S 4.2903 8.2202 115.4440 60.4013 63.6027 176.4962 97 D 4.4030 8.0894 120.3909 55.7863 39.4117 176.8009 98 V 3.9440 7.5439 120.0068 61.1117 32.3770 174.4893 99 P 4.4975 0.0000 0.0000 62.1035 33.1469 176.3424 100 Y 4.1375 8.7796 122.4207 61.3864 38.6072 179.2648 101 K 3.9974 8.2124 118.4316 59.3838 32.2220 179.4671 102 V 3.5845 7.7956 117.9953 65.6474 31.3855 177.7418 103 A 3.9894 7.9977 120.5685 55.2384 18.2859 179.7483 104 I 3.5254 7.2472 118.1807 64.5339 37.2461 178.1476 105 N 4.2927 8.1700 117.8580 56.8376 38.4084 176.6859 106 E 3.9931 8.3562 119.6717 59.3249 29.6295 179.1189 107 A 4.0608 7.8274 120.7995 55.2500 18.5513 179.8178 108 I 3.7236 7.8940 118.2265 64.6763 37.1048 178.6002 109 E 4.0415 8.3548 119.4065 59.3016 29.2470 179.4330 110 L 4.1843 8.3589 119.1941 57.8024 41.6941 179.3827 111 A 4.2250 8.1739 120.4487 54.8029 18.0444 179.8877 112 K 4.0073 7.7331 116.4562 59.5914 32.1550 179.4643 113 S 4.1180 7.7876 114.3794 60.9822 63.0035 175.3354 114 F 4.5986 8.2291 117.2141 57.3139 39.9054 175.6224 115 G 4.2776 7.9664 108.7426 42.5958 0.0000 172.5851 116 A 4.3119 7.6358 119.6603 51.2563 19.2225 178.4538 117 E 3.9420 8.7942 118.4834 59.9432 29.3261 178.9576 118 N 4.8510 8.0059 113.2867 53.1284 39.0223 177.0922 119 S 4.2935 7.9583 117.3323 61.3824 63.0047 175.9838 120 H 4.3004 8.2375 118.8773 58.5734 28.2813 177.6581 121 K 3.9672 7.6652 120.7798 59.0163 31.9773 178.9012 122 F 4.1195 7.9874 120.9247 61.2276 39.3166 177.1964 123 V 3.4055 8.0932 117.9395 66.0517 31.3344 177.1906 124 N 4.2749 8.3020 116.8312 56.8349 38.2320 176.8490 125 G 3.5227 8.2905 107.2430 47.7987 0.0000 175.8641 126 V 3.2847 7.4630 120.6780 65.6522 31.5187 178.2352 127 L 3.9162 7.9438 118.7028 57.6140 41.1569 179.1533 128 D 4.4568 7.8192 118.2089 56.6809 40.7390 178.1963 129 K 3.9003 7.1205 117.6938 58.1178 32.5065 178.3764 130 A 3.9145 7.5520 120.4297 54.1564 18.9947 179.3788 131 A 3.9526 8.1025 119.7476 54.9568 18.3159 178.2136 132 P 4.5336 0.0000 0.0000 65.4981 31.1951 179.0386 133 V 3.6574 7.6727 116.2904 65.7021 31.5712 177.8400 134 I 4.1660 7.5324 118.6798 62.9905 38.1191 176.7654 135 R 4.5515 8.2647 122.4261 53.0953 30.3818 174.2492 136 P 4.4621 0.0000 0.0000 64.6136 30.3205 177.4322 137 N 4.4708 8.1153 113.0216 52.3828 37.7154 175.0788 138 K 2.6936 7.5145 117.2099 57.2663 30.3404 175.3230 139 K 4.1575 7.3623 122.3946 56.6113 32.5154 176.3190 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 P 0.00 4.33 0.00 2.18 2.05 0.00 3.56 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.07 0.00 4 A 7.68 3.82 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 5 A 8.81 4.24 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 6 R 7.77 3.95 0.00 1.92 1.83 0.00 2.85 0.00 0.00 2.40 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.47 0.00 7 R 7.92 4.16 0.00 1.94 2.20 0.00 3.33 0.00 0.00 3.43 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.81 0.00 8 R 8.39 3.94 0.00 2.05 2.00 0.00 3.37 0.00 0.00 3.58 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.82 0.00 9 A 8.36 4.05 1.72 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 10 R 8.68 3.97 0.00 2.12 2.08 0.00 3.44 0.00 0.00 3.27 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 2.04 0.00 11 E 8.55 4.11 0.00 2.30 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 2.58 2.66 0.00 12 C 8.46 4.21 0.00 2.68 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 A 8.20 4.13 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 14 V 7.75 3.40 1.74 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 0.65 0.00 0.00 0.91 0.00 0.00 15 Q 7.57 3.87 0.00 2.49 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.29 2.18 0.00 16 A 8.32 4.14 1.17 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 17 L 8.45 4.09 0.00 1.84 1.80 0.71 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 18 Y 8.53 4.00 0.00 3.14 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 19 S 8.53 4.26 0.00 4.22 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 W 8.44 4.21 0.00 3.37 3.38 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 21 Q 7.99 3.46 0.00 1.95 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 2.41 2.84 0.00 22 L 7.29 3.99 0.00 1.45 1.58 0.78 -0.21 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 23 S 8.22 4.28 0.00 3.99 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 24 Q 7.92 3.01 0.00 1.98 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.97 0.00 0.00 0.00 0.00 0.00 1.91 2.13 0.00 25 N 7.91 4.62 0.00 2.84 2.84 0.00 0.00 6.86 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 26 D 8.56 4.57 0.00 2.76 2.63 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 27 I 8.47 3.59 1.45 0.00 0.00 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.74 0.71 0.00 0.00 28 A 7.95 4.01 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 29 D 8.08 4.41 0.00 2.93 2.96 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 30 V 7.97 3.70 2.27 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 1.15 0.00 0.00 1.11 0.00 0.00 31 E 8.60 4.01 0.00 1.93 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 0.00 2.46 2.18 0.00 32 Y 8.10 3.98 0.00 3.32 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 33 Q 8.56 4.15 0.00 2.45 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.55 0.00 0.00 0.00 0.00 0.00 2.53 2.67 0.00 34 F 8.47 3.84 0.00 3.55 3.42 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 35 L 8.22 3.98 0.00 1.64 1.65 1.07 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 36 A 7.71 4.07 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 37 E 8.24 4.41 0.00 1.93 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 2.23 2.30 0.00 38 Q 7.38 4.14 0.00 1.43 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.80 0.00 0.00 0.00 0.00 0.00 1.38 1.16 0.00 39 D 8.18 4.60 0.00 2.58 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 40 V 8.05 4.49 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 0.74 0.00 0.00 0.89 0.00 0.00 41 K 8.25 3.90 0.00 2.01 1.85 0.00 1.75 0.00 0.00 1.75 0.00 0.00 2.91 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.44 1.53 7.81 42 D 7.98 4.94 0.00 2.81 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 43 V 7.26 4.32 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 0.68 0.00 0.00 0.87 0.00 0.00 44 D 8.29 4.65 0.00 2.80 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 45 V 8.10 3.79 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 1.17 0.00 0.00 0.98 0.00 0.00 46 L 8.01 3.98 0.00 1.86 1.81 1.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 47 Y 8.82 4.13 0.00 3.33 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 48 F 8.76 4.14 0.00 3.10 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 49 R 8.20 3.47 0.00 1.97 2.05 0.00 3.14 0.00 0.00 3.12 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.64 0.00 50 E 8.01 3.77 0.00 1.99 1.90 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 2.32 2.43 0.00 51 L 7.50 3.35 0.00 1.43 1.37 0.82 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 52 L 7.26 3.47 0.00 1.38 1.22 0.12 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 53 A 7.76 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 54 G 7.43 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 0.00 0.00 0.00 55 V 7.08 3.58 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 0.93 0.00 0.00 0.78 0.00 0.00 56 A 7.29 2.81 0.22 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 57 T 7.29 4.47 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 1.12 0.00 0.00 58 N 7.85 5.20 0.00 3.04 3.04 0.00 0.00 6.71 7.37 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 59 T 8.42 3.92 4.40 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 1.55 0.00 0.00 60 A 8.10 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 61 Y 7.96 4.07 0.00 3.00 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 62 L 8.61 3.92 0.00 1.73 1.73 1.09 1.22 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 63 D 8.94 4.53 0.00 2.79 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 64 G 7.73 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 65 L 7.42 4.09 0.00 1.60 1.70 0.64 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 66 M 7.70 4.36 0.00 2.17 2.19 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.64 0.00 67 K 7.93 3.78 0.00 2.04 1.72 0.00 1.67 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.39 1.45 7.81 68 P 0.00 4.18 0.00 1.30 1.81 0.00 3.48 0.00 0.00 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 1.67 0.00 69 Y 7.22 4.82 0.00 2.98 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 70 L 7.78 4.94 0.00 1.65 1.73 1.01 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 71 S 8.07 4.57 0.00 3.86 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 72 R 7.97 4.55 0.00 2.02 2.15 0.00 3.23 0.00 0.00 3.48 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.75 0.00 73 L 8.11 3.75 0.00 1.69 1.71 0.92 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 74 L 7.65 4.28 0.00 1.97 1.15 1.06 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 75 E 9.00 3.99 0.00 1.84 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 2.27 2.27 0.00 76 E 9.06 4.04 0.00 1.92 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 2.23 2.33 0.00 77 L 7.33 3.52 0.00 1.82 1.72 1.17 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 78 G 8.17 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 79 Q 8.76 4.05 0.00 2.30 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.86 0.00 0.00 0.00 0.00 0.00 2.45 2.27 0.00 80 V 7.92 3.76 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 1.19 0.00 0.00 0.95 0.00 0.00 81 E 8.24 4.05 0.00 2.37 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 2.47 2.59 0.00 82 K 8.48 3.91 0.00 1.96 2.06 0.00 1.67 0.00 0.00 1.68 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.50 1.54 7.81 83 A 8.06 4.14 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 84 V 7.92 3.56 2.27 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 1.19 0.00 0.00 1.02 0.00 0.00 85 L 8.62 4.01 0.00 1.75 1.74 0.99 0.98 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 86 R 8.17 4.02 0.00 2.12 2.02 0.00 3.32 0.00 0.00 3.27 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.83 0.00 87 I 7.78 3.70 2.05 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 1.39 0.72 0.96 0.00 0.00 88 A 8.17 4.02 1.37 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 89 L 8.38 3.91 0.00 1.86 1.73 0.96 0.70 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 90 Y 8.43 4.00 0.00 3.18 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 91 E 8.44 3.97 0.00 2.25 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 2.58 2.77 0.00 92 L 7.97 4.01 0.00 1.80 1.74 0.84 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 93 S 8.02 4.50 0.00 4.18 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 94 K 7.93 4.37 0.00 0.79 1.46 0.00 1.54 0.00 0.00 1.61 0.00 0.00 2.89 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.12 1.26 7.81 95 R 7.68 4.58 0.00 1.99 2.16 0.00 3.34 0.00 0.00 3.45 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.85 0.00 96 S 8.22 4.29 0.00 3.98 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 97 D 8.09 4.40 0.00 2.81 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 98 V 7.54 3.94 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 0.82 0.00 0.00 0.98 0.00 0.00 99 P 0.00 4.50 0.00 2.23 1.98 0.00 3.69 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 2.12 2.14 0.00 100 Y 8.78 4.14 0.00 2.99 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 0.00 101 K 8.21 4.00 0.00 1.89 1.88 0.00 1.78 0.00 0.00 1.79 0.00 0.00 2.96 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.66 1.67 7.81 102 V 7.80 3.58 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 1.05 0.00 0.00 0.94 0.00 0.00 103 A 8.00 3.99 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 0.00 104 I 7.25 3.53 1.70 0.00 0.00 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 1.15 0.49 0.82 0.00 0.00 105 N 8.17 4.29 0.00 2.85 2.88 0.00 0.00 7.31 7.26 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 0.00 106 E 8.36 3.99 0.00 2.12 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.51 0.00 107 A 7.83 4.06 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 I 7.89 3.72 2.01 0.00 0.00 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 1.72 1.09 0.95 0.00 0.00 109 E 8.35 4.04 0.00 2.02 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 2.52 2.50 0.00 110 L 8.36 4.18 0.00 1.96 1.87 0.99 1.02 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 0.00 111 A 8.17 4.22 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 0.00 0.00 0.00 0.00 0.00 112 K 7.73 4.01 0.00 1.99 1.85 0.00 1.65 0.00 0.00 1.64 0.00 0.00 2.85 0.00 0.00 2.57 0.00 0.00 0.00 0.00 1.35 1.41 7.81 113 S 7.79 4.12 0.00 3.63 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 0.00 114 F 8.23 4.60 0.00 3.24 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 0.00 115 G 7.97 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 0.00 0.00 0.00 0.00 116 A 7.64 4.31 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 0.00 117 E 8.79 3.94 0.00 1.98 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 2.34 2.33 0.00 118 N 8.01 4.85 0.00 2.81 2.79 0.00 0.00 6.77 8.13 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 0.00 119 S 7.96 4.29 0.00 4.15 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 0.00 120 H 8.24 4.30 0.00 3.40 3.65 0.00 5.46 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 K 7.67 3.97 0.00 1.93 1.89 0.00 1.64 0.00 0.00 1.74 0.00 0.00 2.95 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.48 1.15 7.81 122 F 7.99 4.12 0.00 3.12 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 0.00 123 V 8.09 3.41 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 1.02 0.00 0.00 1.11 0.00 0.00 124 N 8.30 4.27 0.00 2.98 2.96 0.00 0.00 7.18 7.47 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 0.00 125 G 8.29 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 0.00 126 V 7.46 3.28 1.78 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 0.96 0.00 0.00 0.26 0.00 0.00 127 L 7.94 3.92 0.00 1.61 1.56 0.85 0.87 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 0.00 128 D 7.82 4.46 0.00 2.58 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 0.00 129 K 7.12 3.90 0.00 1.12 0.85 0.00 1.69 0.00 0.00 1.82 0.00 0.00 3.03 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.32 1.30 7.81 130 A 7.55 3.91 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 0.00 131 A 8.10 3.95 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 0.00 132 P 0.00 4.53 0.00 2.17 2.11 0.00 3.55 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.25 0.00 133 V 7.67 3.66 2.28 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 0.95 0.00 0.00 1.03 0.00 0.00 134 I 7.53 4.17 2.04 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 1.54 0.86 0.99 0.00 0.00 135 R 8.26 4.55 0.00 1.97 1.88 0.00 3.19 0.00 0.00 3.35 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.68 0.00 136 P 0.00 4.46 0.00 2.01 2.11 0.00 3.72 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.05 0.00 137 N 8.12 4.47 0.00 2.88 3.00 0.00 0.00 6.34 7.20 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 0.00 138 K 7.51 2.69 0.00 1.55 1.21 0.00 1.46 0.00 0.00 1.54 0.00 0.00 2.96 0.00 0.00 2.93 0.00 0.00 0.00 0.00 0.62 1.08 7.81 139 K 7.36 4.16 0.00 1.74 1.64 0.00 1.69 0.00 0.00 1.71 0.00 0.00 3.05 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.28 1.45 7.81