NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.8432 8.3501 109.7336 43.1920 0.0000 174.2282 2 A 4.4632 7.7894 123.1666 51.0949 20.8175 174.7868 3 L 3.5407 7.1312 125.7261 55.6243 39.7111 173.5914 4 T 4.3150 8.9619 114.4791 60.5441 71.6680 175.2936 5 E 3.9327 8.6105 121.8806 59.2528 29.4570 178.9613 6 S 4.2397 7.9535 113.9880 61.0672 63.4102 176.4031 7 Q 3.9129 8.0440 121.3980 58.7194 28.4672 178.3767 8 A 3.8987 8.1215 121.6286 55.1140 18.4057 179.5946 9 A 4.0417 7.9808 118.9654 55.0634 18.4114 179.9830 10 L 3.9892 7.7580 117.6426 57.8619 41.6444 179.7641 11 V 3.5290 7.7136 118.1885 65.9293 31.4603 177.8689 12 K 4.0266 8.1568 119.3569 59.7954 31.9246 178.7848 13 S 4.2090 8.4409 115.6041 61.6971 62.8839 176.6492 14 S 4.2525 8.4715 116.8879 61.5337 62.6017 176.3790 15 W 4.3594 8.9449 132.1610 60.3360 30.2271 177.9279 16 E 3.4009 8.1488 117.8116 59.2331 29.0824 178.8985 17 E 4.0297 8.4068 118.7284 58.8907 29.2582 179.2151 18 F 3.9941 7.9479 121.0598 61.1973 39.3298 176.0864 19 N 4.3122 7.4251 112.6086 54.2743 38.8149 175.9129 20 A 4.1630 7.2673 120.4379 54.0482 20.0747 177.1327 21 N 4.6842 7.4397 115.6994 50.7430 39.0847 174.4755 22 I 3.2297 7.6038 123.4907 63.1785 37.5108 175.6200 23 P 4.2896 0.0000 0.0000 65.3816 31.1725 178.5546 24 K 3.8166 7.6139 117.6841 60.0140 32.2527 178.5760 25 H 4.2570 7.7074 116.6772 58.8100 28.0933 177.8630 26 T 4.1638 8.0980 111.8242 64.4182 68.7416 176.5133 27 H 4.2936 8.0032 121.5165 59.1321 29.8959 176.9761 28 R 3.7873 8.0198 120.5447 59.4604 29.8788 177.8485 29 F 4.1809 8.3647 121.8213 60.8738 39.3357 177.2718 30 F 3.3746 7.7587 116.3615 60.1073 38.5875 177.5867 31 I 3.6440 7.6541 119.5820 64.6550 36.5694 178.4715 32 L 3.9782 7.9639 119.4703 57.3857 41.3557 179.7743 33 V 3.3970 7.4425 118.6679 65.8865 31.2483 177.9506 34 L 4.1864 7.6283 116.9323 57.0590 41.6321 178.7770 35 E 4.1171 7.7890 117.7668 58.7866 29.4191 178.7070 36 I 4.1646 7.2639 118.6149 62.5641 38.9532 176.5251 37 A 4.6703 7.9822 123.1093 48.2093 19.6593 174.1359 38 P 4.3065 0.0000 0.0000 65.6696 31.0197 178.3994 39 A 4.0696 8.0154 118.8299 54.6181 18.5882 178.7424 40 A 4.1054 8.2494 119.0044 53.9145 18.3544 179.3284 41 K 3.9043 7.9452 118.8727 59.9671 32.0819 178.3411 42 D 4.4625 8.0920 116.1813 56.6058 40.7857 177.9285 43 L 4.1430 7.8402 118.6314 54.8716 41.9075 176.4978 44 F 4.1747 7.4088 119.0084 55.3315 39.1865 176.3262 45 S 3.9132 8.3708 121.8269 61.1992 62.3918 175.5703 46 F 4.6293 6.1401 112.0986 56.4975 38.3448 175.6339 47 L 4.4698 7.6927 122.5977 56.0449 43.0685 177.2040 48 K 3.7381 7.8356 116.6166 58.0983 32.2994 176.7540 49 G 3.8800 8.8543 110.0176 46.2224 0.0000 173.0726 50 T 4.5769 7.3998 109.3483 59.7575 70.9726 174.1978 51 S 4.4427 8.3846 115.3258 59.5844 64.1374 174.1434 52 E 4.6654 7.5624 120.1420 52.9025 31.9466 176.0407 53 V 3.7046 8.2141 120.9423 62.0148 31.9518 174.1731 54 P 4.3605 0.0000 0.0000 63.4642 31.4197 175.9829 55 Q 4.1572 8.5724 117.9618 57.5267 30.0751 175.7475 56 N 4.9730 7.7669 113.4466 51.3391 39.1855 174.1262 57 N 4.8161 7.6074 117.2088 51.4638 41.6256 172.7070 58 P 4.2832 0.0000 0.0000 65.7132 31.5663 178.4939 59 E 3.8790 8.3326 118.6679 58.7210 29.4546 178.6288 60 L 2.5933 7.3963 119.7719 57.7845 42.1422 178.9580 61 Q 3.9356 7.7134 117.1359 59.0556 28.7188 178.6433 62 A 4.0507 8.0938 121.8418 55.3676 18.3618 179.0144 63 H 4.1329 8.4578 116.5783 59.5844 30.0044 177.4107 64 A 4.3205 8.5614 122.6861 55.1447 18.1022 179.9043 65 G 3.7980 8.3404 104.5182 48.0056 0.0000 176.2752 66 K 4.1740 8.2976 121.0437 58.9640 31.9050 179.5641 67 V 3.6211 7.8917 118.6835 66.2969 31.5019 178.2243 68 F 3.9070 8.1759 117.0867 60.3164 38.7558 177.6049 69 K 4.1591 8.2943 119.4131 58.9915 31.9895 178.6915 70 L 3.9879 7.8947 120.6174 57.7465 42.0884 179.0138 71 V 3.5335 7.6617 118.4519 66.1202 31.4247 177.3768 72 Y 3.6198 8.0676 119.2654 60.6150 38.4744 177.8930 73 E 3.2599 7.7118 118.5995 58.4033 29.4030 179.0868 74 A 3.8398 7.5854 121.2076 54.9003 18.5360 179.5218 75 A 3.7484 7.5950 119.1836 55.1014 18.2575 180.0016 76 I 3.5528 7.0714 118.6416 64.3290 37.1327 178.3959 77 Q 3.8323 7.6423 120.1653 59.0854 28.7406 178.2317 78 L 4.0065 8.0614 120.3428 57.5783 41.3667 179.0054 79 E 4.1217 7.7353 119.6976 58.0421 29.6454 178.5210 80 V 3.7856 7.8446 118.0542 65.2164 31.9125 177.2345 81 T 4.4203 8.3275 106.7550 60.9543 69.9822 175.4681 82 G 3.9183 8.5514 109.8886 45.4126 0.0000 172.8802 83 V 4.3875 7.1328 111.1830 59.8524 35.9035 174.2837 84 V 4.1288 8.0152 120.2139 61.1677 32.2667 175.2551 85 V 3.8089 8.0865 127.2761 62.5294 32.2216 175.3659 86 T 4.2152 8.2998 123.6516 62.9374 68.6800 174.1551 87 D 4.9209 8.1391 125.2729 51.1828 44.1365 175.3307 88 A 3.6960 8.4981 118.0718 55.4681 18.3076 179.5251 89 T 3.8478 7.8430 111.7491 66.8054 69.0320 176.4623 90 L 4.0800 8.0361 119.8664 57.3049 41.5396 179.6588 91 K 4.0451 8.1514 118.8850 59.1164 31.9680 178.7915 92 N 4.3892 8.4623 119.1708 56.2872 39.0465 176.9185 93 L 4.2382 8.3042 120.4942 57.7773 41.6155 179.8805 94 G 3.6959 8.0231 105.7223 47.5198 0.0000 176.1215 95 S 4.1563 7.8494 116.7590 61.4285 63.3644 176.9929 96 V 3.6582 7.8593 116.4402 64.4077 31.3182 178.3760 97 H 4.1090 8.2461 115.5976 58.4349 28.5023 178.2070 98 V 3.5918 7.8173 120.3331 66.1246 31.2345 177.9407 99 S 4.1255 8.0697 113.8451 61.8958 62.8871 176.8467 100 K 4.1481 7.6858 117.9599 57.3069 31.7752 177.8112 101 G 3.8344 7.8879 107.2432 45.6993 0.0000 173.6670 102 V 3.8188 7.5788 118.6981 61.8865 32.3828 175.0869 103 A 5.0034 8.5543 127.8604 49.9659 22.3639 176.4774 104 D 4.5846 9.0281 119.0783 57.7598 40.9444 179.5184 105 A 4.2094 7.9809 119.7262 54.8646 18.8352 178.7358 106 H 4.4247 8.3824 113.7997 58.6573 28.6344 177.7660 107 F 4.1776 8.4383 119.6612 60.1676 38.7456 175.8999 108 P 4.4423 0.0000 0.0000 65.1532 30.9678 178.8538 109 V 3.5581 7.8829 117.6513 66.0803 31.5028 178.2743 110 V 3.6281 7.7609 117.4355 65.3400 31.4363 177.6956 111 K 2.7822 7.8058 119.5822 59.3423 32.1360 178.7720 112 E 3.9719 8.2735 118.3193 59.0120 29.2646 179.2825 113 A 3.9883 7.7173 121.3481 54.9115 18.3688 179.6835 114 I 3.6303 7.7978 118.4366 64.5022 37.2314 178.7079 115 L 3.9477 7.8157 119.8245 57.7569 41.3317 179.7641 116 K 3.9676 8.0017 118.3141 59.3913 31.5137 179.6793 117 T 3.8944 7.9392 116.1288 66.8586 68.4836 176.7498 118 I 3.6249 7.8075 121.7360 64.2764 37.0464 178.4931 119 K 4.0090 7.9538 120.0882 59.3564 31.6620 178.7218 120 E 4.0103 7.6460 118.2764 58.7200 29.4630 179.0098 121 V 3.6138 7.5865 117.7861 66.2881 31.8791 178.3197 122 V 4.0994 7.5072 113.3608 60.0869 31.8004 178.4444 123 G 3.9059 8.7301 106.1163 46.4509 0.0000 177.6371 124 A 4.1887 8.9627 128.9846 54.1433 18.1988 178.9809 125 K 4.3305 7.7760 113.5971 56.5835 32.3109 177.1471 126 W 4.2752 8.1035 130.5847 57.0799 31.3844 175.6929 127 S 4.4325 7.0875 118.4887 55.7198 67.1603 174.9665 128 E 3.6153 8.1159 121.0994 59.1118 28.7656 179.1723 129 E 3.8872 7.8343 119.2062 58.8716 29.7448 178.5253 130 L 3.9567 7.4762 120.3043 58.0074 42.1665 178.2804 131 N 4.4783 7.7539 117.2853 56.9018 38.9733 176.8889 132 S 4.2329 8.2085 114.8265 60.6319 63.3294 176.3922 133 A 3.9164 7.5915 124.5634 54.9432 18.2074 179.5759 134 W 3.9132 8.1325 117.4282 60.1023 29.1664 178.6926 135 T 4.0228 8.2899 115.7789 66.8892 67.9717 176.4721 136 I 3.6983 7.8703 121.0564 64.4758 37.1972 178.3662 137 A 3.9276 7.8436 121.0987 55.4787 18.0741 178.6335 138 Y 3.9537 8.2968 117.9967 60.9620 38.3600 177.7519 139 D 4.4259 8.6422 119.5023 57.9032 41.2152 179.2895 140 E 3.9637 8.3546 118.7666 59.0977 29.5241 179.1251 141 L 3.9408 7.9024 120.3107 57.9728 42.0999 178.8546 142 A 3.7604 7.9020 120.8312 54.7608 18.0054 179.7936 143 I 3.4865 7.1924 117.8463 64.5043 37.1002 178.7581 144 V 3.5459 7.2689 117.8265 65.7524 31.3058 178.2548 145 I 3.6459 7.5433 119.4494 64.4601 37.1452 178.4630 146 K 3.7778 7.9305 119.4709 59.2594 31.5937 179.3868 147 K 3.9030 7.6930 120.1044 59.6061 30.6781 178.8614 148 E 4.0028 7.9157 118.5533 59.2555 29.3340 179.2042 149 M 4.0535 8.1452 118.9425 58.7442 31.9116 178.6029 150 D 4.5520 7.6189 118.1397 56.7986 40.9670 178.3628 151 D 4.4617 7.6971 118.9064 57.1333 40.9334 178.0807 152 A 4.2470 7.3925 118.8774 53.1096 18.7084 177.1390 153 A 4.0485 7.7863 125.4682 53.1953 20.5385 176.0110 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 G 8.35 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 0.00 0.00 0.00 2 A 7.79 4.46 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 3 L 7.13 3.54 0.00 1.79 1.66 0.84 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 4 T 8.96 4.32 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 1.25 0.00 0.00 5 E 8.61 3.93 0.00 2.08 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 2.37 2.42 0.00 6 S 7.95 4.24 0.00 4.08 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 7 Q 8.04 3.91 0.00 2.27 2.12 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 2.50 2.46 0.00 8 A 8.12 3.90 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 9 A 7.98 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 10 L 7.76 3.99 0.00 1.92 1.76 0.90 1.18 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 11 V 7.71 3.53 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.55 0.00 0.00 0.32 0.00 0.00 12 K 8.16 4.03 0.00 2.14 2.10 0.00 1.91 0.00 0.00 1.77 0.00 0.00 3.07 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.58 1.67 7.81 13 S 8.44 4.21 0.00 4.14 3.97 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 14 S 8.47 4.25 0.00 4.37 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 0.00 15 W 8.94 4.36 0.00 3.76 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 16 E 8.15 3.40 0.00 2.12 1.88 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 2.20 2.67 0.00 17 E 8.41 4.03 0.00 2.14 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 2.32 2.46 0.00 18 F 7.95 3.99 0.00 2.86 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 19 N 7.43 4.31 0.00 2.29 2.11 0.00 0.00 7.31 8.03 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 20 A 7.27 4.16 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 21 N 7.44 4.68 0.00 2.46 2.17 0.00 0.00 7.11 8.54 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 22 I 7.60 3.23 1.72 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 1.44 0.65 0.81 0.00 0.00 23 P 0.00 4.29 0.00 2.04 2.02 0.00 3.37 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.05 0.00 24 K 7.61 3.82 0.00 1.70 1.44 0.00 1.67 0.00 0.00 1.74 0.00 0.00 2.87 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.40 1.44 7.81 25 H 7.71 4.26 0.00 2.02 2.98 0.00 5.67 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 26 T 8.10 4.16 4.48 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 1.21 0.00 0.00 27 H 8.00 4.29 0.00 3.29 3.60 0.00 5.79 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 R 8.02 3.79 0.00 2.19 2.18 0.00 3.21 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.72 0.00 29 F 8.36 4.18 0.00 3.35 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 30 F 7.76 3.37 0.00 3.14 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 31 I 7.65 3.64 1.95 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.28 0.87 0.00 0.00 32 L 7.96 3.98 0.00 1.67 1.62 0.98 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.44 3.40 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 1.04 0.00 0.00 0.09 0.00 0.00 34 L 7.63 4.19 0.00 1.65 1.71 0.99 1.03 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 35 E 7.79 4.12 0.00 1.98 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 2.30 2.54 0.00 36 I 7.26 4.16 1.83 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.53 0.90 0.00 0.00 37 A 7.98 4.67 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 38 P 0.00 4.31 0.00 2.28 2.36 0.00 3.71 0.00 0.00 3.87 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 39 A 8.02 4.07 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 40 A 8.25 4.11 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 41 K 7.95 3.90 0.00 2.00 1.86 0.00 1.66 0.00 0.00 1.65 0.00 0.00 3.12 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.52 7.81 42 D 8.09 4.46 0.00 2.64 2.68 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 0.00 0.00 0.00 43 L 7.84 4.14 0.00 0.78 1.18 0.61 0.78 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 44 F 7.41 4.17 0.00 3.14 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 0.00 0.00 0.00 0.00 45 S 8.37 3.91 0.00 3.91 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 46 F 6.14 4.63 0.00 3.13 3.24 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 47 L 7.69 4.47 0.00 1.77 1.68 0.86 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 48 K 7.84 3.74 0.00 1.68 1.72 0.00 1.76 0.00 0.00 1.65 0.00 0.00 3.11 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.57 7.81 49 G 8.85 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 0.00 0.00 0.00 50 T 7.40 4.58 4.34 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 1.31 0.00 0.00 51 S 8.38 4.44 0.00 4.00 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 52 E 7.56 4.67 0.00 1.99 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 2.27 0.00 53 V 8.21 3.70 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 0.90 0.00 0.00 0.96 0.00 0.00 54 P 0.00 4.36 0.00 2.21 2.07 0.00 3.83 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.02 0.00 55 Q 8.57 4.16 0.00 2.08 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 7.47 0.00 0.00 0.00 0.00 0.00 2.23 2.25 0.00 56 N 7.77 4.97 0.00 2.63 2.73 0.00 0.00 6.74 8.00 0.00 0.00 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 N 7.61 4.82 0.00 2.72 2.61 0.00 0.00 6.81 7.71 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 58 P 0.00 4.28 0.00 2.28 2.26 0.00 3.71 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.03 0.00 59 E 8.33 3.88 0.00 1.95 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 0.00 2.35 2.31 0.00 60 L 7.40 2.59 0.00 1.16 1.56 0.86 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 61 Q 7.71 3.94 0.00 2.08 2.10 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 2.34 2.42 0.00 62 A 8.09 4.05 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 63 H 8.46 4.13 0.00 3.44 3.53 0.00 5.79 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 A 8.56 4.32 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.34 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 K 8.30 4.17 0.00 1.93 1.96 0.00 1.80 0.00 0.00 1.73 0.00 0.00 3.00 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.55 1.63 7.81 67 V 7.89 3.62 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 1.03 0.00 0.00 68 F 8.18 3.91 0.00 3.13 2.98 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 69 K 8.29 4.16 0.00 2.27 1.97 0.00 1.72 0.00 0.00 1.77 0.00 0.00 3.00 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.44 1.64 7.81 70 L 7.89 3.99 0.00 2.20 1.72 0.92 1.15 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 71 V 7.66 3.53 2.35 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 1.22 0.00 0.00 1.12 0.00 0.00 72 Y 8.07 3.62 0.00 2.95 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 73 E 7.71 3.26 0.00 2.07 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 2.00 1.92 0.00 74 A 7.59 3.84 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 75 A 7.60 3.75 1.09 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 0.00 0.00 76 I 7.07 3.55 1.43 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.69 0.76 0.00 0.00 77 Q 7.64 3.83 0.00 2.08 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.80 0.00 0.00 0.00 0.00 0.00 2.47 2.31 0.00 78 L 8.06 4.01 0.00 1.66 1.62 0.84 1.01 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 79 E 7.74 4.12 0.00 1.96 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 2.33 2.46 0.00 80 V 7.84 3.79 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 0.87 0.00 0.00 0.89 0.00 0.00 81 T 8.33 4.42 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 1.16 0.00 0.00 82 G 8.55 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 83 V 7.13 4.39 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 0.66 0.00 0.00 0.89 0.00 0.00 84 V 8.02 4.13 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.85 0.00 0.00 85 V 8.09 3.81 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 0.83 0.00 0.00 0.93 0.00 0.00 86 T 8.30 4.22 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 1.25 0.00 0.00 87 D 8.14 4.92 0.00 2.79 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 88 A 8.50 3.70 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 89 T 7.84 3.85 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 1.23 0.00 0.00 90 L 8.04 4.08 0.00 1.67 1.70 0.95 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 91 K 8.15 4.05 0.00 1.92 1.86 0.00 1.74 0.00 0.00 1.57 0.00 0.00 2.87 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.72 1.54 7.81 92 N 8.46 4.39 0.00 2.83 3.03 0.00 0.00 6.87 6.21 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 93 L 8.30 4.24 0.00 2.03 1.81 1.06 1.14 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 94 G 8.02 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 95 S 7.85 4.16 0.00 4.03 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 96 V 7.86 3.66 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 1.03 0.00 0.00 0.87 0.00 0.00 97 H 8.25 4.11 0.00 3.40 3.45 0.00 5.81 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 98 V 7.82 3.59 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 1.05 0.00 0.00 1.06 0.00 0.00 99 S 8.07 4.13 0.00 4.01 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 0.00 100 K 7.69 4.15 0.00 1.65 1.69 0.00 1.63 0.00 0.00 1.65 0.00 0.00 3.03 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.54 1.44 7.81 101 G 7.89 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 0.00 0.00 0.00 102 V 7.58 3.82 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 0.68 0.00 0.00 0.89 0.00 0.00 103 A 8.55 5.00 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 0.00 104 D 9.03 4.58 0.00 2.77 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 0.00 105 A 7.98 4.21 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 0.00 106 H 8.38 4.42 0.00 3.41 3.28 0.00 5.82 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 F 8.44 4.18 0.00 3.37 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 0.00 108 P 0.00 4.44 0.00 2.22 2.18 0.00 3.78 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.26 0.00 109 V 7.88 3.56 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 1.00 0.00 0.00 1.00 0.00 0.00 110 V 7.76 3.63 2.21 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 1.19 0.00 0.00 1.05 0.00 0.00 111 K 7.81 2.78 0.00 1.38 1.83 0.00 2.07 0.00 0.00 1.73 0.00 0.00 2.97 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.32 1.14 7.81 112 E 8.27 3.97 0.00 1.97 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 2.48 2.46 0.00 113 A 7.72 3.99 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 I 7.80 3.63 1.71 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.30 0.54 0.39 0.00 0.00 115 L 7.82 3.95 0.00 1.70 1.78 0.98 0.89 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 0.00 116 K 8.00 3.97 0.00 1.84 1.79 0.00 1.61 0.00 0.00 1.58 0.00 0.00 2.89 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.38 1.63 7.81 117 T 7.94 3.89 4.47 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 0.00 0.00 0.00 1.40 0.00 0.00 118 I 7.81 3.62 1.65 0.00 0.00 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 -0.36 0.71 0.00 0.00 119 K 7.95 4.01 0.00 1.04 1.62 0.00 1.10 0.00 0.00 0.80 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.07 0.91 7.81 120 E 7.65 4.01 0.00 1.99 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.41 0.00 121 V 7.59 3.61 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 0.76 0.00 0.00 0.78 0.00 0.00 122 V 7.51 4.10 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 1.21 0.00 0.00 1.34 0.00 0.00 123 G 8.73 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 A 8.96 4.19 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 0.00 125 K 7.78 4.33 0.00 1.97 1.93 0.00 1.75 0.00 0.00 1.66 0.00 0.00 3.11 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.52 1.42 7.81 126 W 8.10 4.28 0.00 3.43 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 0.00 127 S 7.09 4.43 0.00 3.79 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 0.00 128 E 8.12 3.62 0.00 1.91 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 2.33 2.33 0.00 129 E 7.83 3.89 0.00 1.99 1.84 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 2.33 2.37 0.00 130 L 7.48 3.96 0.00 1.71 1.51 1.23 1.08 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 0.00 131 N 7.75 4.48 0.00 2.81 2.90 0.00 0.00 7.03 7.50 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 0.00 132 S 8.21 4.23 0.00 4.11 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 0.00 133 A 7.59 3.92 1.36 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 0.00 0.00 134 W 8.13 3.91 0.00 3.48 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 T 8.29 4.02 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 1.29 0.00 0.00 136 I 7.87 3.70 1.85 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 1.46 0.90 0.88 0.00 0.00 137 A 7.84 3.93 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 0.00 138 Y 8.30 3.95 0.00 3.28 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 0.00 139 D 8.64 4.43 0.00 3.14 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 0.00 140 E 8.35 3.96 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 2.47 2.40 0.00 141 L 7.90 3.94 0.00 1.70 1.65 0.85 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.90 3.76 1.06 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 0.00 0.00 0.00 0.00 0.00 143 I 7.19 3.49 1.77 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.68 0.83 0.00 0.00 144 V 7.27 3.55 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 0.98 0.00 0.00 0.89 0.00 0.00 145 I 7.54 3.65 1.78 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 1.53 0.80 1.04 0.00 0.00 146 K 7.93 3.78 0.00 1.74 1.69 0.00 0.92 0.00 0.00 1.20 0.00 0.00 2.67 0.00 0.00 2.61 0.00 0.00 0.00 0.00 1.22 0.29 7.81 147 K 7.69 3.90 0.00 1.90 1.98 0.00 1.60 0.00 0.00 1.60 0.00 0.00 2.91 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.40 1.44 7.81 148 E 7.92 4.00 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 2.69 2.48 0.00 149 M 8.15 4.05 0.00 2.13 2.24 0.00 0.00 0.00 0.00 0.00 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.87 2.85 0.00 150 D 7.62 4.55 0.00 2.81 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 0.00 151 D 7.70 4.46 0.00 2.60 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 0.00 152 A 7.39 4.25 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 0.00 153 A 7.79 4.05 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