NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.4346 8.1927 115.4120 57.7903 64.7405 173.6921 3 S 3.7595 8.6245 113.4682 61.0843 61.9344 174.5156 4 S 4.1296 8.7858 116.7599 61.1654 62.5596 175.6344 5 I 3.6869 7.3716 121.7562 64.5676 36.8569 178.4942 6 R 3.8943 8.7973 119.7509 59.4162 29.8600 179.0129 7 E 3.9913 8.1998 118.2982 59.4155 29.4309 179.0408 8 E 3.9575 8.1319 119.0488 58.9803 29.5787 178.9392 9 V 3.5289 8.0028 118.7251 66.5619 31.7051 177.9071 10 H 4.2189 8.3967 116.0298 58.6336 28.4114 177.9000 11 R 3.9241 8.2041 120.8926 59.4147 29.9009 177.9796 12 H 4.0933 8.5695 118.4818 59.4714 29.7312 177.1097 13 L 4.0762 8.0560 119.6316 57.8964 41.1624 179.5824 14 G 3.7391 8.0109 105.0519 47.9149 0.0000 176.1331 15 T 3.9648 8.1266 118.1803 66.3907 68.4398 177.2422 16 V 3.6738 7.8669 113.9092 63.8150 31.5322 178.3401 17 A 4.0289 7.6768 120.1433 55.0097 17.9246 179.5624 18 L 4.0315 7.7370 116.5977 57.4906 41.6705 178.5246 19 M 4.5278 7.4212 116.2973 53.6964 32.2310 175.7212 20 Q 3.9384 7.3367 121.4408 55.6841 29.4026 174.8315 21 P 4.3539 0.0000 0.0000 63.1395 31.9810 175.1104 22 A 4.3975 8.0006 121.8232 51.8167 21.7318 176.4137 23 L 4.3623 8.2618 120.0182 53.5417 41.2604 176.0280 24 H 4.4307 8.5621 124.0545 54.8053 29.4792 174.7466 25 Q 4.4189 8.1818 129.4613 54.0308 28.8785 175.0584 26 Q 4.0939 8.4506 124.7031 55.8149 29.4857 176.0468 27 T 4.5457 8.1868 111.2190 60.4030 70.7212 174.5712 28 H 4.6763 8.3509 122.9592 54.9555 29.3999 173.1867 29 A 3.6907 8.0415 126.3707 52.1970 16.0473 175.3776 30 P 4.3826 0.0000 0.0000 61.7293 32.7902 177.1263 31 A 4.2450 8.2424 121.8560 51.2774 19.2872 176.8737 32 P 4.3744 0.0000 0.0000 65.9872 31.4606 178.7948 33 T 4.1152 7.8692 105.7987 63.2802 68.8313 174.5085 34 E 4.3240 8.3634 121.2992 56.5079 30.1273 175.7604 35 I 4.3117 7.4186 121.1985 59.9742 37.6465 176.3916 36 T 4.4020 8.2144 116.8100 60.8635 71.4204 174.9407 37 H 4.2057 8.6470 119.6885 59.6160 29.8145 177.0159 38 T 3.8269 7.9478 117.1113 66.8002 68.3005 176.4100 39 L 3.9931 8.0553 120.8096 57.5077 41.6191 179.3266 40 F 4.1510 8.5616 121.0542 61.3794 39.3070 177.2186 41 R 3.9037 8.3785 118.2808 59.3440 29.6375 178.3369 42 A 3.8627 7.6933 119.7381 55.3228 18.3989 178.9269 43 Y 4.2442 7.9144 114.7578 60.5252 38.0157 177.2905 44 T 4.3352 7.3190 108.5955 60.5089 69.3319 174.9401 45 R 4.0570 6.8130 117.9586 56.4053 30.3962 176.1416 46 V 4.0640 7.9429 111.6587 59.1860 32.4061 175.3287 47 P 4.0390 0.0000 0.0000 65.8857 31.1631 177.3071 48 H 4.3525 6.9728 111.4374 56.7022 28.6722 175.7168 49 D 4.5467 7.7471 121.1708 53.1012 39.4166 175.7034 50 V 4.5256 7.2269 113.9111 59.3031 33.2744 176.1873 51 G 3.8637 7.9878 109.8070 47.3528 0.0000 173.8428 52 G 4.0063 8.9588 113.2937 45.1718 0.0000 173.6049 53 E 4.0819 8.0382 119.9460 55.7620 30.0859 176.3479 54 A 4.1535 8.3309 125.8769 52.4565 19.0926 176.1683 55 D 4.6391 8.1575 119.5860 53.2604 44.3893 174.7270 56 V 4.1826 7.8978 115.8033 59.2523 33.2276 174.0614 57 P 4.5030 0.0000 0.0000 62.0046 31.9462 176.2073 58 I 4.4067 7.3973 114.7297 58.5423 40.4983 174.7429 59 E 3.9148 8.4715 123.2753 55.7080 29.1475 176.1428 60 Y 4.3486 8.1163 124.8912 58.4137 38.5615 175.4939 61 H 5.0289 8.2367 117.5870 53.8229 31.8296 172.6241 62 E 4.5008 8.4911 119.8924 55.3238 30.9953 175.6775 63 K 4.5749 7.9451 119.8476 54.7644 35.2347 175.6124 64 E 4.0725 8.5788 125.3977 56.1832 30.1139 176.0919 65 E 4.2236 8.3596 123.1961 55.6398 30.7239 176.8051 66 E 4.1984 9.2086 125.9940 55.7443 31.6935 178.1669 67 I 3.7249 8.3314 123.1109 64.3943 37.3228 178.8436 68 W 4.9898 8.1945 118.1437 58.7977 27.9267 178.2936 69 E 2.8888 6.9415 119.4167 58.7721 28.9001 178.5593 70 L 3.7687 7.4113 120.3132 58.2977 42.0685 178.8463 71 N 4.4691 8.3036 116.3557 56.4834 38.4634 177.6635 72 T 4.0592 8.0457 117.3907 66.4796 68.6044 176.5079 73 F 4.2590 8.4148 122.7646 61.3706 39.3558 176.9914 74 A 3.9187 8.2006 120.3192 55.4335 18.0703 179.7169 75 T 3.8798 8.2381 114.2872 67.0877 68.4419 176.6826 76 C 4.6182 8.4499 118.5922 63.1379 28.2546 176.1174 77 E 4.1017 8.3256 120.1921 59.5094 28.9420 179.2023 78 C 4.6054 8.6026 117.2525 62.8721 28.2245 176.0490 79 L 3.9644 8.4910 120.7099 57.6073 41.1027 179.4923 80 A 5.2581 8.2140 122.0479 54.3086 18.2931 179.1750 81 W 4.4682 8.7067 126.2477 60.8452 30.7582 177.5286 82 R 4.3541 8.2091 115.4203 55.7154 29.6099 177.0255 83 G 3.9866 8.0530 105.8559 46.3629 0.0000 175.7510 84 V 3.7224 8.3934 122.2863 64.9447 31.8117 175.7408 85 W 4.9124 7.8820 114.5843 55.0474 30.4272 173.0147 86 T 4.8080 8.4319 109.8026 60.0523 71.5000 175.4882 87 A 3.5982 8.2568 123.1805 55.3121 18.2966 179.9199 88 E 3.8024 7.9611 116.6371 59.4277 29.5650 179.2052 89 E 3.9092 7.7612 118.3513 59.2119 29.4943 179.2427 90 R 3.1034 7.0969 118.3527 59.1721 29.9060 178.6020 91 R 3.5985 7.7176 117.9964 59.2265 29.9889 178.9680 92 R 3.7568 7.7509 118.2334 59.4406 29.6427 178.7702 93 K 4.2208 7.9401 119.5632 58.8136 31.8183 179.2880 94 Q 4.1872 8.5904 121.5184 58.1425 28.7811 176.9128 95 N 4.9957 8.5061 115.3434 53.3328 39.1794 175.3784 96 C 4.1674 7.4779 115.9753 61.3847 30.8104 176.0779 97 D 4.4248 8.2417 119.1754 57.2016 40.5326 179.3805 98 V 3.6854 7.1063 111.6026 62.4676 31.8528 177.6102 99 G 4.1147 8.1136 104.5631 45.7559 0.0000 173.9378 100 Q 4.0245 8.8290 120.6283 59.6978 28.7658 179.4829 101 T 3.9431 7.9189 115.6264 66.8825 68.6354 176.7364 102 V 3.6186 7.8071 119.5449 65.9908 31.4960 176.9083 103 Y 4.1953 8.3890 119.7111 60.4524 38.3564 177.6729 104 L 4.4586 7.6828 117.0497 55.2015 43.0053 178.5036 105 G 3.7906 8.2757 105.4258 45.9579 0.0000 173.8504 106 M 4.6003 7.3435 119.2846 52.8609 34.1526 174.1239 107 P 4.5450 0.0000 0.0000 62.3098 32.2444 176.3502 108 Y 4.1304 8.5827 120.2648 62.3510 38.4539 178.5220 109 Y 4.4127 8.2536 116.8867 60.4119 38.1854 178.5241 110 G 3.9180 8.5263 107.5154 47.9256 0.0000 176.0661 111 R 4.1389 8.2502 119.9166 58.6698 30.1050 179.0486 112 W 4.4355 8.4007 119.7962 59.1638 29.2005 178.0898 113 L 4.2193 8.7010 120.3135 58.3712 41.6602 178.8927 114 L 4.0754 8.2466 118.9258 58.3577 41.6955 179.7742 115 T 4.1075 8.3319 115.3440 66.3133 68.0500 176.8835 116 A 3.9928 8.3670 122.8829 55.0988 18.0907 179.5728 117 A 4.0359 8.1426 119.3835 55.0457 18.4294 179.8606 118 R 3.8522 8.0486 117.4143 59.7010 30.2070 178.6785 119 I 3.8609 7.9567 118.4910 63.8980 37.8326 177.8235 120 L 4.1076 7.4913 118.8325 57.5619 41.4148 179.6320 121 V 3.9021 7.4020 119.0541 65.4137 31.4088 177.9007 122 D 4.4132 8.4446 117.6197 56.6346 40.6102 177.9190 123 K 4.2307 7.6581 116.5724 54.9793 32.4374 176.2246 124 Q 3.3853 7.6187 116.3060 56.9336 26.7986 175.2207 125 F 4.5208 7.9146 117.3813 59.5785 39.3639 176.5571 126 V 4.6810 7.3139 112.7732 58.8970 35.7669 174.3814 127 T 4.2060 8.8541 114.0475 60.9395 71.1613 175.9055 128 L 3.9115 8.2592 122.8133 58.3740 41.9860 179.1934 129 T 3.8245 7.7991 115.4600 66.7046 68.3569 176.1711 130 E 3.9482 8.2561 120.5030 59.1109 29.4589 179.2070 131 L 3.9292 7.7545 119.8799 58.5095 42.2334 178.7025 132 H 4.2633 8.3675 116.3465 59.1605 28.5894 177.6225 133 N 4.3905 8.5046 118.4772 56.1514 38.3371 177.4392 134 K 3.9623 8.3803 121.4847 59.3441 32.2221 179.0709 135 I 3.7064 7.7849 120.3023 64.3088 36.9869 178.4863 136 V 3.5710 7.8102 119.1198 65.8328 31.2803 177.5036 137 E 3.9061 8.4692 119.3568 59.7770 29.5501 178.7654 138 M 4.0719 8.1411 118.5104 58.4252 31.8973 179.0503 139 R 3.9219 8.0164 118.1818 59.3850 30.1997 179.0095 140 E 3.9487 8.4211 118.5548 59.2856 29.4284 179.2633 141 R 3.8772 8.1907 118.9599 59.3869 30.0690 178.8669 142 V 3.5716 7.7287 117.2208 66.0233 31.4304 177.9851 143 A 4.0607 8.0357 119.5459 54.9644 18.2608 179.2607 144 S 4.3226 8.3098 111.9627 59.5799 63.5518 175.4994 145 G 3.9288 8.0000 111.1713 45.7822 0.0000 174.8240 146 Q 4.0334 7.9627 117.8530 55.9652 29.0186 177.3505 147 G 3.9960 8.2880 103.0459 45.2901 0.0000 173.2851 148 L 4.5617 8.5593 120.1738 53.3163 43.5715 176.9719 149 G 3.6744 8.4262 119.5527 46.7076 0.0000 172.0663 150 E 4.2059 8.2808 121.2073 56.8752 30.4136 177.2064 151 Y 4.4949 7.7969 119.0098 60.3230 38.7428 175.3183 152 L 4.9647 7.5939 121.9545 53.0652 45.3193 173.7523 153 P 4.8435 0.0000 0.0000 61.5437 32.6787 174.2889 154 P 4.5254 0.0000 0.0000 62.5868 31.8994 176.3517 155 K 4.0433 8.7235 124.9176 56.9258 32.6238 176.9070 156 A 4.8290 8.3457 130.2887 51.2612 20.6229 177.0180 157 K 4.1902 8.5706 113.8676 57.4644 32.9076 176.3123 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 8.19 4.43 0.00 4.02 4.10 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 3 S 8.62 3.76 0.00 3.99 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 4 S 8.79 4.13 0.00 3.93 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 I 7.37 3.69 2.08 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 1.52 0.84 0.89 0.00 0.00 6 R 8.80 3.89 0.00 1.79 2.03 0.00 3.27 0.00 0.00 3.16 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.84 0.00 7 E 8.20 3.99 0.00 2.23 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 2.35 2.47 0.00 8 E 8.13 3.96 0.00 2.07 2.09 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 2.29 2.32 0.00 9 V 8.00 3.53 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 0.93 0.00 0.00 0.90 0.00 0.00 10 H 8.40 4.22 0.00 3.21 3.32 0.00 5.67 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 R 8.20 3.92 0.00 2.08 2.12 0.00 3.11 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.64 0.00 12 H 8.57 4.09 0.00 3.34 3.53 0.00 5.85 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 13 L 8.06 4.08 0.00 1.81 1.74 0.93 1.26 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 14 G 8.01 3.74 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 0.00 0.00 0.00 15 T 8.13 3.96 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 1.20 0.00 0.00 16 V 7.87 3.67 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 0.62 0.00 0.00 0.93 0.00 0.00 17 A 7.68 4.03 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 L 7.74 4.03 0.00 1.78 1.74 0.92 0.85 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 19 M 7.42 4.53 0.00 1.99 2.15 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.51 0.00 20 Q 7.34 3.94 0.00 2.02 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.63 6.89 0.00 0.00 0.00 0.00 0.00 2.38 2.39 0.00 21 P 0.00 4.35 0.00 2.08 1.97 0.00 3.77 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 22 A 8.00 4.40 1.22 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 23 L 8.26 4.36 0.00 1.64 1.66 0.93 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 24 H 8.56 4.43 0.00 3.07 3.26 0.00 5.89 0.00 0.00 0.00 0.00 6.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 Q 8.18 4.42 0.00 2.03 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.74 6.75 0.00 0.00 0.00 0.00 0.00 2.25 2.35 0.00 26 Q 8.45 4.09 0.00 2.10 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.48 0.00 0.00 0.00 0.00 0.00 2.41 2.41 0.00 27 T 8.19 4.55 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 1.27 0.00 0.00 28 H 8.35 4.68 0.00 3.13 3.24 0.00 5.85 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 A 8.04 3.69 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 30 P 0.00 4.38 0.00 2.20 2.08 0.00 3.69 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 1.94 1.95 0.00 31 A 8.24 4.24 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 32 P 0.00 4.37 0.00 2.19 2.14 0.00 3.60 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 2.12 2.10 0.00 33 T 7.87 4.12 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 34 E 8.36 4.32 0.00 2.12 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 2.30 2.42 0.00 35 I 7.42 4.31 2.07 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 1.55 0.85 1.14 0.00 0.00 36 T 8.21 4.40 4.29 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 1.25 0.00 0.00 37 H 8.65 4.21 0.00 3.27 3.39 0.00 5.88 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 38 T 7.95 3.83 4.26 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 1.20 0.00 0.00 39 L 8.06 3.99 0.00 2.06 1.93 0.87 1.10 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 40 F 8.56 4.15 0.00 3.28 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 41 R 8.38 3.90 0.00 1.88 2.00 0.00 3.17 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 42 A 7.69 3.86 1.16 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 43 Y 7.91 4.24 0.00 2.93 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 44 T 7.32 4.34 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 0.52 0.00 0.00 45 R 6.81 4.06 0.00 2.02 2.07 0.00 3.03 0.00 0.00 3.16 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.53 0.00 46 V 7.94 4.06 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 0.66 0.00 0.00 0.95 0.00 0.00 47 P 0.00 4.04 0.00 1.51 1.82 0.00 3.44 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.99 0.00 48 H 6.97 4.35 0.00 3.31 3.36 0.00 5.56 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 49 D 7.75 4.55 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 50 V 7.23 4.53 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 1.10 0.00 0.00 1.00 0.00 0.00 51 G 7.99 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 52 G 8.96 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 53 E 8.04 4.08 0.00 2.09 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 2.33 2.41 0.00 54 A 8.33 4.15 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 55 D 8.16 4.64 0.00 2.61 2.52 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 56 V 7.90 4.18 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 0.77 0.00 0.00 0.90 0.00 0.00 57 P 0.00 4.50 0.00 1.97 1.91 0.00 3.58 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 1.98 2.03 0.00 58 I 7.40 4.41 1.73 0.00 0.00 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.76 0.81 0.00 0.00 59 E 8.47 3.91 0.00 1.88 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 2.28 2.31 0.00 60 Y 8.12 4.35 0.00 3.02 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 61 H 8.24 5.03 0.00 3.16 3.26 0.00 5.71 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 62 E 8.49 4.50 0.00 1.97 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 2.26 2.21 0.00 63 K 7.95 4.57 0.00 1.68 1.59 0.00 1.79 0.00 0.00 1.72 0.00 0.00 3.02 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.29 1.44 7.81 64 E 8.58 4.07 0.00 1.97 1.83 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 2.29 2.27 0.00 65 E 8.36 4.22 0.00 1.80 1.73 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 2.04 2.04 0.00 66 E 9.21 4.20 0.00 1.16 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 2.18 2.30 0.00 67 I 8.33 3.72 2.17 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.95 0.96 0.00 0.00 68 W 8.19 4.99 0.00 3.50 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 69 E 6.94 2.89 0.00 1.47 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 1.47 1.47 0.00 70 L 7.41 3.77 0.00 1.79 1.75 0.98 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 71 N 8.30 4.47 0.00 2.99 2.98 0.00 0.00 7.05 6.41 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 72 T 8.05 4.06 4.42 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 1.65 0.00 0.00 73 F 8.41 4.26 0.00 2.77 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 74 A 8.20 3.92 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 75 T 8.24 3.88 4.54 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 1.29 0.00 0.00 76 C 8.45 4.62 0.00 3.58 3.41 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 77 E 8.33 4.10 0.00 1.79 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 1.77 1.90 0.00 78 C 8.60 4.61 0.00 3.24 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 79 L 8.49 3.96 0.00 2.02 1.33 0.63 0.85 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 80 A 8.21 5.26 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 W 8.71 4.47 0.00 3.31 3.36 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 0.00 82 R 8.21 4.35 0.00 1.63 1.72 0.00 3.04 0.00 0.00 2.48 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.40 0.00 83 G 8.05 3.99 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 0.00 0.00 0.00 84 V 8.39 3.72 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 0.57 0.00 0.00 0.50 0.00 0.00 85 W 7.88 4.91 0.00 3.53 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 86 T 8.43 4.81 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 1.26 0.00 0.00 87 A 8.26 3.60 1.22 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 88 E 7.96 3.80 0.00 1.93 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 2.35 2.31 0.00 89 E 7.76 3.91 0.00 2.22 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 0.00 2.38 2.34 0.00 90 R 7.10 3.10 0.00 0.67 1.18 0.00 2.58 0.00 0.00 2.48 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.76 0.00 91 R 7.72 3.60 0.00 1.85 1.85 0.00 3.30 0.00 0.00 3.02 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.66 0.00 92 R 7.75 3.76 0.00 1.79 2.01 0.00 3.33 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.78 0.00 93 K 7.94 4.22 0.00 2.04 1.92 0.00 1.90 0.00 0.00 2.00 0.00 0.00 3.08 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.52 1.50 7.81 94 Q 8.59 4.19 0.00 1.89 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.68 0.00 0.00 0.00 0.00 0.00 2.12 2.13 0.00 95 N 8.51 5.00 0.00 2.74 2.89 0.00 0.00 6.83 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 96 C 7.48 4.17 0.00 3.01 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 97 D 8.24 4.42 0.00 2.92 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 98 V 7.11 3.69 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 0.79 0.00 0.00 1.14 0.00 0.00 99 G 8.11 4.11 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 0.00 0.00 0.00 0.00 0.00 0.00 100 Q 8.83 4.02 0.00 2.20 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.85 0.00 0.00 0.00 0.00 0.00 2.47 2.60 0.00 101 T 7.92 3.94 4.29 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 1.25 0.00 0.00 102 V 7.81 3.62 2.32 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 1.10 0.00 0.00 0.98 0.00 0.00 103 Y 8.39 4.20 0.00 3.24 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 0.00 104 L 7.68 4.46 0.00 1.65 1.70 1.02 0.84 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 0.00 105 G 8.28 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 0.00 106 M 7.34 4.60 0.00 2.10 2.19 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.68 0.00 107 P 0.00 4.55 0.00 2.46 2.14 0.00 3.77 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.18 0.00 108 Y 8.58 4.13 0.00 2.97 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 0.00 109 Y 8.25 4.41 0.00 3.10 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 G 8.53 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 R 8.25 4.14 0.00 2.13 2.05 0.00 3.26 0.00 0.00 3.35 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.94 0.00 112 W 8.40 4.44 0.00 3.84 3.59 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 0.00 0.00 0.00 0.00 113 L 8.70 4.22 0.00 2.23 2.07 1.07 0.47 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 0.00 114 L 8.25 4.08 0.00 1.98 1.78 0.98 0.66 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 0.00 115 T 8.33 4.11 4.57 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 1.50 0.00 0.00 116 A 8.37 3.99 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 0.00 117 A 8.14 4.04 1.41 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 0.00 0.00 118 R 8.05 3.85 0.00 2.18 2.15 0.00 3.17 0.00 0.00 3.13 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.94 0.00 119 I 7.96 3.86 1.58 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.93 0.11 0.00 0.00 120 L 7.49 4.11 0.00 1.91 1.73 0.89 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 121 V 7.40 3.90 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 1.26 0.00 0.00 0.95 0.00 0.00 122 D 8.44 4.41 0.00 2.70 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 0.00 123 K 7.66 4.23 0.00 1.73 1.23 0.00 2.06 0.00 0.00 1.78 0.00 0.00 3.07 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.32 1.44 7.81 124 Q 7.62 3.39 0.00 1.96 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.31 7.02 0.00 0.00 0.00 0.00 0.00 2.22 2.19 0.00 125 F 7.91 4.52 0.00 3.15 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 0.00 126 V 7.31 4.68 2.09 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 0.85 0.00 0.00 0.94 0.00 0.00 127 T 8.85 4.21 4.21 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 1.19 0.00 0.00 128 L 8.26 3.91 0.00 1.71 1.62 0.81 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 0.00 129 T 7.80 3.82 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 130 E 8.26 3.95 0.00 2.16 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 2.31 0.00 131 L 7.75 3.93 0.00 1.76 1.80 0.93 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 132 H 8.37 4.26 0.00 3.35 3.30 0.00 5.69 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 0.00 133 N 8.50 4.39 0.00 2.90 2.87 0.00 0.00 6.71 8.48 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 0.00 134 K 8.38 3.96 0.00 1.94 2.04 0.00 1.53 0.00 0.00 1.65 0.00 0.00 3.03 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.53 7.81 135 I 7.78 3.71 2.03 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 1.75 0.69 0.89 0.00 0.00 136 V 7.81 3.57 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 1.06 0.00 0.00 0.99 0.00 0.00 137 E 8.47 3.91 0.00 2.21 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 2.31 2.36 0.00 138 M 8.14 4.07 0.00 2.08 2.22 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 2.64 2.96 0.00 139 R 8.02 3.92 0.00 2.05 1.96 0.00 3.11 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.82 0.00 140 E 8.42 3.95 0.00 2.12 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 2.33 2.65 0.00 141 R 8.19 3.88 0.00 2.04 2.12 0.00 3.11 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.65 0.00 142 V 7.73 3.57 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 0.96 0.00 0.00 0.97 0.00 0.00 143 A 8.04 4.06 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 0.00 144 S 8.31 4.32 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 0.00 145 G 8.00 3.93 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 0.00 0.00 0.00 0.00 0.00 0.00 146 Q 7.96 4.03 0.00 2.22 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.55 0.00 0.00 0.00 0.00 0.00 2.39 2.31 0.00 147 G 8.29 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 0.00 148 L 8.56 4.56 0.00 1.69 1.64 0.98 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 149 G 8.43 3.67 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 0.00 0.00 0.00 150 E 8.28 4.21 0.00 1.94 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 1.58 1.82 0.00 151 Y 7.80 4.49 0.00 3.25 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 0.00 152 L 7.59 4.96 0.00 1.80 1.60 0.95 0.97 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 0.00 153 P 0.00 4.84 0.00 2.12 2.04 0.00 3.86 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 2.00 2.01 0.00 154 P 0.00 4.53 0.00 1.96 2.04 0.00 3.69 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.30 0.00 155 K 8.72 4.04 0.00 1.78 1.72 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.41 7.81 156 A 8.35 4.83 1.23 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 0.00 0.00 157 K 8.57 4.19 0.00 1.84 1.78 0.00 1.50 0.00 0.00 1.74 0.00 0.00 3.15 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.32 1.46 7.81