NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 F 4.6947 8.3249 115.7997 57.2756 39.1288 175.1178 2 H 4.5710 8.5815 118.6468 53.8825 27.4676 171.3333 3 I 4.1207 8.1261 123.1639 59.4797 39.0152 174.7708 4 D 4.6856 8.5155 126.1763 52.2784 41.4191 174.9864 5 P 4.3975 0.0000 0.0000 64.6329 31.6409 176.2416 6 Y 4.3560 9.1032 116.9955 58.5710 38.9482 177.1229 7 K 3.9868 7.8059 118.9153 59.2798 32.7540 180.1453 8 E 3.6871 7.1131 118.4330 59.2932 29.8938 179.5538 9 F 4.6924 8.1637 115.3320 58.5313 39.7522 175.7854 10 G 4.0849 8.8598 106.3949 46.1927 0.0000 172.8900 11 A 4.8616 7.9764 119.2925 49.9760 23.1595 175.6108 12 T 4.8796 7.9062 108.2222 59.1736 73.0145 175.0916 13 V 3.1577 9.1546 123.8775 65.2247 31.0322 178.4566 14 E 3.7904 8.0559 117.6150 58.9510 29.2985 178.8682 15 L 4.2360 7.5140 119.4866 58.0774 42.4952 178.5106 16 L 4.0125 7.5927 118.3069 57.3401 42.0967 178.0601 17 S 3.8302 7.8046 113.0243 61.3975 61.9463 175.6267 18 F 4.0126 7.5615 123.1224 59.8746 39.3616 176.1196 19 L 3.2927 7.6432 121.1915 53.4806 41.2628 175.2489 20 P 4.5347 0.0000 0.0000 62.3597 32.2561 177.3331 21 S 4.2178 8.8186 116.5673 61.8031 62.9862 176.4735 22 D 4.5574 8.2843 120.3240 55.3070 39.2655 177.5179 23 F 4.0620 8.8810 122.2078 61.0028 39.4108 175.6091 24 F 4.1276 7.8856 117.0178 56.3120 39.2680 173.8671 25 P 4.6271 0.0000 0.0000 61.4055 32.8770 175.8001 26 S 4.1866 8.4045 112.3186 58.4451 63.5057 175.2853 27 V 3.3448 8.4798 122.4349 67.0019 30.9407 177.3631 28 R 3.8349 8.3111 116.8207 59.0883 29.5399 177.4276 29 D 4.0185 9.2921 119.7372 57.8565 41.2614 179.3955 30 L 4.0679 8.4563 119.8552 57.5565 41.6330 178.8753 31 L 3.9223 8.5114 118.8496 58.4940 41.7482 179.2556 32 D 4.4252 9.0703 119.1060 58.3760 40.9180 179.7488 33 T 3.9847 8.7055 115.8282 66.4682 68.4779 176.5719 34 A 4.1676 8.4744 122.9428 55.3876 18.3055 179.5758 35 A 3.9982 8.0826 117.6646 55.1918 18.4849 179.2798 36 A 4.1588 8.3666 119.2468 54.4088 18.7199 178.1001 37 L 4.4984 7.5440 117.0483 54.9490 40.7391 176.0267 38 Y 4.4882 8.0374 115.1135 57.8972 43.0851 175.9238 39 R 3.7547 7.6518 118.2080 60.2588 29.7169 177.9916 40 D 4.5136 7.6599 115.5003 57.4088 41.3262 178.6600 41 A 3.9974 8.1289 121.2008 55.4190 18.4791 178.9025 42 L 4.0729 8.8640 117.6423 58.0614 42.0406 179.7901 43 E 4.1048 9.2451 118.0841 59.1774 29.8335 177.1428 44 S 4.0234 7.5609 113.4140 55.6867 64.7496 172.4151 45 P 4.4944 0.0000 0.0000 63.1340 31.3780 175.5253 46 E 4.3681 8.5191 120.2880 55.1886 29.9163 175.9422 47 H 4.3003 8.5849 121.6611 56.5376 29.2572 175.1208 48 C 4.6002 8.2979 119.7197 59.6227 30.0373 174.1938 49 S 4.7251 7.5655 112.6030 55.7062 64.3736 175.8695 50 P 4.2965 0.0000 0.0000 66.9431 30.5177 178.0768 51 H 4.0528 8.5247 115.4624 58.8374 28.7021 176.6918 52 H 3.9649 8.4706 117.5789 60.1520 28.7318 177.2728 53 T 3.7717 8.5189 115.9920 66.9534 68.2841 175.7322 54 A 3.9681 8.3817 121.9225 55.4906 18.4624 179.0704 55 L 3.8614 7.7185 118.3205 59.0944 41.9802 178.9329 56 R 3.9809 8.2610 117.3975 59.3999 30.0113 178.8807 57 Q 3.9385 8.5519 116.9701 59.2317 28.8872 180.1325 58 A 4.0603 8.7926 121.7783 55.4733 18.4636 179.5837 59 I 3.7253 8.2855 117.3578 64.7610 37.4295 178.2506 60 L 4.2308 8.3882 119.9447 58.0102 41.7161 178.5717 61 C 4.0865 8.2596 118.6001 62.5278 31.3608 175.4742 62 W 3.8474 8.9505 129.9684 60.3111 30.2040 177.9610 63 G 3.5804 8.1475 105.5108 48.1538 0.0000 174.9937 64 D 4.3138 8.1830 121.1925 57.1689 40.6644 179.1652 65 L 3.7734 7.3138 118.6969 57.8547 41.4931 179.2286 66 M 3.5916 7.0465 118.5042 58.6214 31.8429 179.0999 67 T 3.8017 7.9439 115.8333 66.5350 68.6707 176.2973 68 L 3.8148 8.2065 122.4473 58.9485 41.8085 178.4597 69 A 4.0849 8.2435 120.8733 54.6990 18.3179 179.3158 70 T 3.8125 8.6428 113.7231 66.3587 68.4937 176.4348 71 W 4.2633 8.5933 129.6260 60.1218 31.2988 178.1846 72 V 4.2082 8.6120 118.1636 66.3724 30.6255 176.8954 73 G 3.7907 8.4878 106.4645 46.9836 0.0000 173.7073 74 T 4.2386 7.7456 118.1876 60.5678 67.7332 174.7100 75 N 4.5481 7.4233 117.4503 54.0139 45.7800 175.7354 76 L 4.0766 7.1820 118.6414 54.5481 42.9976 174.3442 77 E 3.9270 8.2699 123.9686 56.0335 29.9558 174.8503 78 D 4.3504 8.2623 127.7840 53.2104 41.2787 175.4335 79 P 4.1487 0.0000 0.0000 65.8565 31.2144 177.9224 80 A 3.9339 7.8955 118.1492 55.0854 18.4949 179.0963 81 S 4.3939 8.5930 112.6972 61.0084 63.3893 176.7697 82 R 3.9206 8.0385 119.4667 58.5202 28.7960 177.7837 83 D 4.4954 8.3871 119.8475 56.2529 41.3640 178.0935 84 L 3.9465 8.0415 121.3789 58.4900 41.9546 179.0788 85 V 3.6310 7.8070 117.3979 66.0575 31.5814 177.6939 86 V 3.5883 7.7079 117.4370 66.1143 31.2131 178.1836 87 S 4.2543 8.1792 113.7706 60.9305 63.1203 175.5949 88 Y 4.1337 7.8929 122.9053 61.2626 38.4692 177.7455 89 V 3.5066 8.2462 118.7312 66.4309 31.2516 177.2671 90 N 4.5463 8.5821 118.8422 56.4259 38.8244 174.6220 91 T 4.3844 8.4655 115.1330 63.9599 71.7729 175.7892 92 N 4.4670 7.9300 119.2614 57.1714 39.0766 177.0458 93 V 3.7673 7.3230 118.8852 66.2213 31.5500 178.4279 94 G 3.7257 8.0612 104.9147 47.8236 0.0000 174.9807 95 L 3.7768 8.7970 124.8502 57.8617 41.4582 179.0582 96 K 3.7178 8.0172 117.8140 59.6374 31.9402 178.9890 97 F 3.9626 8.4170 117.6825 61.0322 38.7717 178.1123 98 R 3.8442 8.2134 117.7027 59.8964 29.8126 178.3932 99 Q 4.0742 7.4176 115.9377 59.7073 28.6590 179.2946 100 L 3.9461 8.0810 118.7022 59.0593 42.2070 179.3653 101 L 4.0047 8.6367 118.6373 58.5003 41.6388 178.9066 102 W 4.3414 9.4487 129.1128 58.9896 30.5004 177.5977 103 F 3.5328 10.2140 120.6351 62.6285 39.1363 176.8937 104 H 4.2148 9.0506 116.5371 56.6560 28.0850 178.1168 105 I 3.2241 7.4128 125.1034 64.4488 37.6469 178.0247 106 S 4.0672 7.7428 116.2885 61.6038 62.5196 176.4353 107 C 3.7578 6.9253 119.1808 62.7879 27.6592 176.1560 108 L 4.0947 7.4709 118.5630 56.8665 41.1895 177.8931 109 T 4.5851 8.1880 113.1161 63.1971 70.0538 174.3972 110 F 4.5880 8.0524 116.1886 56.2395 42.9870 174.8304 111 G 3.8648 9.1474 110.4459 46.7057 0.0000 174.7040 112 R 3.7034 8.4144 124.4634 60.1150 30.6520 177.0823 113 E 4.0318 8.6499 117.3732 59.7676 29.1953 178.9428 114 T 3.9417 7.9843 114.7785 67.2247 68.9137 176.4255 115 V 3.4413 8.3203 119.8703 65.9482 31.4943 177.7808 116 L 4.1622 8.8591 119.7530 58.0956 41.5140 179.1094 117 E 4.0060 8.5205 118.6116 60.0488 29.4302 178.5023 118 Y 4.1229 8.2827 118.9523 61.0991 38.6867 178.0817 119 L 4.1543 8.8012 119.8231 58.2243 41.9528 179.9031 120 V 3.6126 8.1527 117.9647 66.3864 31.6141 178.3256 121 S 4.1518 8.3261 114.8968 61.2659 62.5072 176.4240 122 F 3.7944 8.6957 124.2318 61.4843 39.0690 176.6275 123 G 3.6592 8.8604 105.5171 47.5502 0.0000 176.4093 124 V 3.3575 7.5609 122.2430 64.1775 32.1866 177.5908 125 W 3.9289 8.2661 130.5137 58.4827 30.0921 176.9858 126 I 2.6231 8.4126 123.7696 63.9680 37.8388 177.2615 127 R 4.1742 7.9687 117.1425 55.9085 30.0621 175.4414 128 T 4.3868 7.5007 116.0609 61.2300 70.0180 172.8537 129 P 4.1669 0.0000 0.0000 62.5061 31.9315 175.0645 130 P 3.8803 0.0000 0.0000 65.6968 31.4023 178.1196 131 A 3.5727 7.4508 119.0056 54.6612 17.9765 177.3785 132 Y 4.7791 7.6509 109.8280 57.2492 39.9431 176.1153 133 R 3.7818 7.4983 121.1560 55.3874 30.5585 174.5863 134 P 4.4987 0.0000 0.0000 61.4859 31.5305 173.7872 135 P 4.0866 0.0000 0.0000 66.0263 31.3670 175.4252 136 N 4.8281 7.7621 117.9212 50.5680 40.2909 175.2554 137 A 2.5800 7.9835 124.4735 50.3385 19.0353 175.4866 138 P 4.2464 0.0000 0.0000 61.9952 31.4151 176.7211 139 I 4.4186 8.0935 117.3260 59.6032 39.0136 175.0580 140 L 4.2211 8.2141 124.6030 54.5842 42.2221 175.7111 141 S 5.0276 8.3356 119.4722 56.7244 65.8693 173.1499 142 T 4.2212 8.7307 111.1031 61.6287 69.1852 174.6943 143 L 4.0008 7.5734 126.5886 56.1847 42.2631 174.0508 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 F 8.32 4.69 0.00 3.04 3.18 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 0.00 0.00 0.00 0.00 2 H 8.58 4.57 0.00 3.26 3.33 0.00 5.88 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 I 8.13 4.12 1.86 0.00 0.00 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.23 0.84 0.00 0.00 4 D 8.52 4.69 0.00 2.71 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 5 P 0.00 4.40 0.00 1.77 2.05 0.00 3.92 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 2.07 2.02 0.00 6 Y 9.10 4.36 0.00 3.05 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 K 7.81 3.99 0.00 1.78 1.80 0.00 1.70 0.00 0.00 1.74 0.00 0.00 2.90 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.49 1.43 7.81 8 E 7.11 3.69 0.00 1.82 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 1.99 2.21 0.00 9 F 8.16 4.69 0.00 3.27 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 10 G 8.86 4.08 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 0.00 0.00 0.00 11 A 7.98 4.86 1.29 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 0.00 0.00 12 T 7.91 4.88 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 13 V 9.15 3.16 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 0.82 0.00 0.00 0.81 0.00 0.00 14 E 8.06 3.79 0.00 1.92 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 2.30 2.37 0.00 15 L 7.51 4.24 0.00 1.71 1.85 1.06 1.17 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 16 L 7.59 4.01 0.00 1.22 1.21 0.66 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 17 S 7.80 3.83 0.00 3.59 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 18 F 7.56 4.01 0.00 3.21 3.28 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 19 L 7.64 3.29 0.00 1.43 0.64 -0.90 -1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 20 P 0.00 4.53 0.00 2.61 2.33 0.00 3.31 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 2.29 2.31 0.00 21 S 8.82 4.22 0.00 4.09 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 0.00 22 D 8.28 4.56 0.00 2.88 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 23 F 8.88 4.06 0.00 2.78 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 24 F 7.89 4.13 0.00 3.09 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 P 0.00 4.63 0.00 2.19 2.06 0.00 3.92 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.99 0.00 26 S 8.40 4.19 0.00 4.02 4.05 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 27 V 8.48 3.34 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 -0.12 0.00 0.00 0.17 0.00 0.00 28 R 8.31 3.83 0.00 1.99 1.79 0.00 3.35 0.00 0.00 3.68 8.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.81 0.00 29 D 9.29 4.02 0.00 2.80 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 30 L 8.46 4.07 0.00 1.73 1.69 1.06 0.72 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 31 L 8.51 3.92 0.00 1.77 1.78 0.95 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 32 D 9.07 4.43 0.00 2.78 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 33 T 8.71 3.98 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 34 A 8.47 4.17 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 35 A 8.08 4.00 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 A 8.37 4.16 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 37 L 7.54 4.50 0.00 1.12 1.40 0.73 0.56 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 38 Y 8.04 4.49 0.00 3.12 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 39 R 7.65 3.75 0.00 1.90 1.87 0.00 3.22 0.00 0.00 3.34 8.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.78 0.00 40 D 7.66 4.51 0.00 2.74 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 41 A 8.13 4.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.86 4.07 0.00 1.83 1.82 1.01 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 43 E 9.25 4.10 0.00 1.96 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 2.37 2.37 0.00 44 S 7.56 4.02 0.00 3.97 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 45 P 0.00 4.49 0.00 2.18 2.18 0.00 3.75 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.98 0.00 46 E 8.52 4.37 0.00 1.94 1.94 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 2.29 2.41 0.00 47 H 8.58 4.30 0.00 3.10 3.23 0.00 5.86 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 48 C 8.30 4.60 0.00 2.83 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 49 S 7.57 4.73 0.00 4.11 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 50 P 0.00 4.30 0.00 1.99 2.23 0.00 3.74 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 2.17 1.99 0.00 51 H 8.52 4.05 0.00 3.29 3.29 0.00 5.65 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 52 H 8.47 3.96 0.00 3.41 3.40 0.00 5.68 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 53 T 8.52 3.77 4.46 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 1.25 0.00 0.00 54 A 8.38 3.97 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 55 L 7.72 3.86 0.00 1.64 1.81 0.91 0.66 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 56 R 8.26 3.98 0.00 2.00 1.95 0.00 3.35 0.00 0.00 3.21 7.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.84 0.00 57 Q 8.55 3.94 0.00 2.28 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.84 0.00 0.00 0.00 0.00 0.00 2.59 2.60 0.00 58 A 8.79 4.06 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 59 I 8.29 3.73 2.17 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.63 1.00 0.00 0.00 60 L 8.39 4.23 0.00 1.98 1.76 0.96 0.68 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 61 C 8.26 4.09 0.00 3.15 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 0.00 62 W 8.95 3.85 0.00 3.48 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 63 G 8.15 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 64 D 8.18 4.31 0.00 2.88 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 65 L 7.31 3.77 0.00 0.88 0.91 0.93 1.30 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 66 M 7.05 3.59 0.00 1.91 1.90 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.31 0.00 67 T 7.94 3.80 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 68 L 8.21 3.81 0.00 1.57 1.80 0.78 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 69 A 8.24 4.08 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 70 T 8.64 3.81 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 71 W 8.59 4.26 0.00 3.15 3.10 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 72 V 8.61 4.21 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 1.06 0.00 0.00 1.20 0.00 0.00 73 G 8.49 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 0.00 0.00 0.00 0.00 74 T 7.75 4.24 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 1.14 0.00 0.00 75 N 7.42 4.55 0.00 1.46 1.42 0.00 0.00 7.14 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 76 L 7.18 4.08 0.00 1.73 1.54 1.02 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 77 E 8.27 3.93 0.00 1.88 1.68 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 2.16 2.30 0.00 78 D 8.26 4.35 0.00 2.79 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 79 P 0.00 4.15 0.00 2.19 2.10 0.00 3.68 0.00 0.00 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.19 0.00 80 A 7.90 3.93 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 81 S 8.59 4.39 0.00 4.05 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 0.00 82 R 8.04 3.92 0.00 2.21 2.25 0.00 2.95 0.00 0.00 3.32 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.88 0.00 83 D 8.39 4.50 0.00 2.93 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 84 L 8.04 3.95 0.00 1.87 1.70 0.99 1.06 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 85 V 7.81 3.63 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 1.14 0.00 0.00 0.99 0.00 0.00 86 V 7.71 3.59 2.24 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 1.10 0.00 0.00 0.96 0.00 0.00 87 S 8.18 4.25 0.00 4.17 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 88 Y 7.89 4.13 0.00 3.16 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 89 V 8.25 3.51 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 0.81 0.00 0.00 0.93 0.00 0.00 90 N 8.58 4.55 0.00 3.00 2.96 0.00 0.00 7.02 7.14 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 91 T 8.47 4.38 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 1.22 0.00 0.00 92 N 7.93 4.47 0.00 1.99 2.70 0.00 0.00 6.46 7.68 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 93 V 7.32 3.77 2.36 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 1.74 0.00 0.00 0.78 0.00 0.00 94 G 8.06 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 0.00 0.00 0.00 95 L 8.80 3.78 0.00 1.52 1.77 0.84 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 96 K 8.02 3.72 0.00 1.98 1.65 0.00 1.72 0.00 0.00 1.59 0.00 0.00 2.95 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.38 1.41 7.81 97 F 8.42 3.96 0.00 2.83 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 98 R 8.21 3.84 0.00 1.63 1.88 0.00 3.34 0.00 0.00 3.12 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.64 0.00 99 Q 7.42 4.07 0.00 2.13 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.63 0.00 0.00 0.00 0.00 0.00 2.49 1.78 0.00 100 L 8.08 3.95 0.00 1.76 1.68 0.65 0.56 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 0.00 101 L 8.64 4.00 0.00 1.99 1.78 0.82 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 102 W 9.45 4.34 0.00 3.72 3.63 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 0.00 103 F 10.21 3.53 0.00 3.74 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 0.00 104 H 9.05 4.21 0.00 3.23 3.01 0.00 5.71 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 I 7.41 3.22 1.83 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 1.40 0.76 0.94 0.00 0.00 106 S 7.74 4.07 0.00 2.72 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 0.00 107 C 6.93 3.76 0.00 2.37 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 L 7.47 4.09 0.00 1.22 0.97 -0.28 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 109 T 8.19 4.59 4.43 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 1.01 0.00 0.00 110 F 8.05 4.59 0.00 2.74 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 0.00 111 G 9.15 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 0.00 112 R 8.41 3.70 0.00 2.03 2.02 0.00 3.40 0.00 0.00 3.82 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 2.07 0.00 113 E 8.65 4.03 0.00 2.06 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 2.45 2.41 0.00 114 T 7.98 3.94 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 1.35 0.00 0.00 115 V 8.32 3.44 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 0.92 0.00 0.00 0.52 0.00 0.00 116 L 8.86 4.16 0.00 1.88 1.86 1.14 1.33 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 0.00 117 E 8.52 4.01 0.00 2.23 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 0.00 2.40 2.41 0.00 118 Y 8.28 4.12 0.00 3.10 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 0.00 119 L 8.80 4.15 0.00 2.09 1.92 1.35 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 0.00 0.00 0.00 0.00 0.00 0.00 120 V 8.15 3.61 2.30 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 1.04 0.00 0.00 0.98 0.00 0.00 121 S 8.33 4.15 0.00 3.89 3.81 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 0.00 122 F 8.70 3.79 0.00 2.46 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 0.00 123 G 8.86 3.66 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 0.00 0.00 0.00 124 V 7.56 3.36 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 0.77 0.00 0.00 0.88 0.00 0.00 125 W 8.27 3.93 0.00 3.24 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 0.00 126 I 8.41 2.62 2.07 0.00 0.00 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 1.42 1.20 1.12 0.00 0.00 127 R 7.97 4.17 0.00 1.75 1.75 0.00 2.94 0.00 0.00 2.25 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.56 0.00 128 T 7.50 4.39 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 1.14 0.00 0.00 129 P 0.00 4.17 0.00 2.17 2.20 0.00 3.74 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 2.44 2.13 0.00 130 P 0.00 3.88 0.00 2.03 2.04 0.00 3.50 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.97 0.00 131 A 7.45 3.57 0.03 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 0.00 0.00 132 Y 7.65 4.78 0.00 2.89 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 R 7.50 3.78 0.00 1.53 1.70 0.00 2.21 0.00 0.00 2.25 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 1.32 0.00 134 P 0.00 4.50 0.00 2.26 2.05 0.00 4.00 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.15 0.00 135 P 0.00 4.09 0.00 2.22 2.17 0.00 3.81 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.07 0.00 136 N 7.76 4.83 0.00 2.74 2.75 0.00 0.00 6.86 7.35 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 0.00 137 A 7.98 2.58 -0.32 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 0.00 138 P 0.00 4.25 0.00 1.62 1.77 0.00 2.47 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.56 0.00 139 I 8.09 4.42 1.92 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 1.33 0.61 0.92 0.00 0.00 140 L 8.21 4.22 0.00 0.27 0.96 0.46 -1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 141 S 8.34 5.03 0.00 3.90 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 0.00 142 T 8.73 4.22 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 0.99 0.00 0.00 143 L 7.57 4.00 0.00 1.94 1.79 0.98 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 0.00 0.00 0.00 0.00 0.00 0.00