NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 K 4.1506 8.4145 122.1443 53.2711 33.7909 173.6799 3 D 4.0493 8.2594 120.4184 53.8456 38.7087 175.6025 4 G 4.0946 9.2629 115.1073 43.5003 0.0000 172.3609 5 M 3.6067 7.8903 118.7100 54.2507 32.7684 176.2378 6 R 4.3943 7.9258 118.1716 54.0808 31.1624 176.1138 7 V 3.5144 8.0453 122.8846 64.1302 32.0117 176.0847 8 G 3.9124 9.0497 115.1951 44.9867 0.0000 172.9405 9 E 4.2348 7.7822 122.3336 55.9845 30.8164 175.5049 10 R 5.0734 8.6432 125.8883 55.1146 31.7259 175.4740 11 F 5.2664 9.6592 126.1570 56.5035 42.8970 173.5589 12 T 4.7825 7.3818 114.2231 59.8753 71.3974 172.6846 13 H 4.4681 8.8020 124.1141 54.4598 32.6619 171.5177 14 D 5.1707 8.3110 125.5431 52.6707 42.9192 176.0678 15 F 4.5607 8.8037 125.1880 56.6039 42.7537 173.3978 16 V 3.8519 7.7773 127.2384 62.1817 32.1849 175.5455 17 V 3.3833 8.1209 129.5293 61.9817 31.4098 174.3335 18 P 4.6969 0.0000 0.0000 60.7923 32.8531 175.0360 19 P 4.4053 0.0000 0.0000 65.2348 31.2433 176.8643 20 H 4.2763 7.2338 113.4325 55.4515 28.8266 175.4640 21 K 3.8545 7.6323 118.1863 56.8061 33.0741 176.5234 22 T 5.1302 7.8762 108.3454 60.1861 70.3963 175.7376 23 V 3.3697 8.4244 120.9827 66.4781 30.9820 178.2329 24 R 4.1920 8.0200 116.7857 59.0600 29.6952 178.2540 25 H 4.5649 8.2051 114.7944 57.3762 28.9351 177.1694 26 L 4.1020 7.6898 122.1685 56.9517 43.2410 176.8136 27 Y 4.8512 7.5833 117.6409 53.8187 38.3764 174.0360 28 P 4.6268 0.0000 0.0000 64.3456 31.9559 177.6263 29 E 4.0559 8.3554 116.8104 57.5833 29.7254 175.9141 30 S 4.6548 8.0491 115.2566 55.8591 62.4476 172.7589 31 P 4.2987 0.0000 0.0000 65.3513 31.3472 178.4822 32 E 4.1427 7.4136 115.8532 57.9251 29.6234 177.2963 33 F 5.0654 7.7756 117.3161 57.2149 39.4114 177.4058 34 A 4.0600 7.9820 125.2399 54.5852 18.1634 178.4253 35 E 4.4453 8.0665 110.6516 55.8360 30.4733 176.1624 36 A 4.0936 7.8510 123.8003 51.6801 18.9239 175.9943 37 P 4.4156 0.0000 0.0000 63.0487 32.2391 177.1651 38 E 4.4222 8.3872 121.3551 55.4582 28.2191 176.0533 39 V 4.8051 7.2272 114.1212 58.6769 37.1586 175.0470 40 F 4.9373 9.1732 125.2764 59.0290 39.6517 174.9309 41 A 4.1215 8.8238 128.6571 52.0113 19.0847 178.2348 42 T 3.7201 8.8908 118.6214 66.9269 68.5557 177.1727 43 G 3.4373 7.8267 106.7948 47.7905 0.0000 175.6093 44 F 4.3010 7.5187 119.5119 60.2574 38.9696 177.4138 45 M 4.1241 7.7535 118.4340 58.3682 32.0175 178.3274 46 V 3.6167 8.0558 118.9842 66.1386 31.7489 178.3123 47 G 3.6713 8.0019 105.2330 47.6683 0.0000 175.3864 48 L 4.2635 8.1072 122.6129 58.2611 42.2291 178.9997 49 M 4.0353 8.1818 118.8348 58.2464 31.8392 178.4150 50 E 3.8152 8.1368 118.7513 59.1490 29.6805 179.1476 51 W 4.2609 8.2816 127.9786 60.4975 30.5820 177.6934 52 A 3.9039 8.0587 120.6140 55.5478 17.9323 179.4926 53 C 3.1656 7.6890 114.8027 62.3733 27.7935 176.4626 54 V 3.5655 8.0458 120.3210 66.0818 30.9005 178.2497 55 R 3.9422 7.9286 116.3099 59.3053 29.9914 178.6159 56 A 3.6112 7.2603 119.6886 54.7581 18.6360 178.8768 57 M 4.4608 8.0797 113.6328 56.5294 31.7871 178.2846 58 A 4.0238 7.6792 123.2642 54.9265 18.4266 177.7367 59 P 4.2434 0.0000 0.0000 65.2701 31.4553 177.1468 60 Y 4.3230 7.8695 115.2421 57.9222 38.6472 175.5641 61 L 4.5066 7.1402 119.8254 53.8931 42.8988 176.6696 62 E 4.3203 9.5371 122.2167 54.7958 30.3725 174.6669 63 P 4.3294 0.0000 0.0000 64.7241 31.7350 177.2864 64 G 3.8892 9.0811 110.8916 45.1793 0.0000 172.7382 65 E 4.9306 7.8676 118.9946 55.5391 31.3739 176.2060 66 G 4.2023 8.8880 107.8543 46.0134 0.0000 171.3374 67 S 5.7329 8.3148 113.2871 57.1870 66.3992 173.3690 68 L 4.7803 8.2111 118.9386 52.7018 45.9311 175.9961 69 G 4.1939 8.7400 109.8465 46.3869 0.0000 173.4094 70 T 4.7197 8.8503 115.3398 61.9422 70.6850 174.3705 71 A 4.6571 7.6242 121.7956 51.2300 22.5548 174.9219 72 I 5.0168 8.2423 119.7761 59.8825 41.6155 174.5915 73 C 4.7235 9.5952 129.3496 57.9603 33.1794 172.6493 74 V 5.1709 8.0448 116.8309 59.3964 35.7034 175.0926 75 T 4.3422 8.5986 113.1709 61.7372 70.9555 173.4557 76 H 5.3890 8.6024 121.7449 54.8799 30.2571 172.4012 77 T 4.5982 8.9346 111.3243 61.0685 69.7339 174.7058 78 A 4.5491 7.8006 123.3061 51.0605 22.1367 175.2022 79 A 4.7915 8.3263 122.4214 50.8261 21.4268 176.7163 80 T 4.6659 8.3268 116.4425 60.9757 71.6934 172.3090 81 P 4.8275 0.0000 0.0000 61.4047 33.1556 174.2070 82 P 4.4341 0.0000 0.0000 64.1026 31.8011 175.4196 83 G 4.0688 9.0579 109.2501 45.7411 0.0000 174.6277 84 L 4.2183 7.2799 118.2182 54.7110 43.4094 176.4926 85 T 4.6303 8.1688 118.0387 62.2523 70.3847 173.9493 86 V 4.3366 8.5708 128.1326 62.4189 33.0528 174.6530 87 T 4.7848 8.9480 125.8798 62.1266 70.3795 173.8135 88 V 4.6263 8.9023 127.3771 61.8087 33.7060 174.4546 89 T 5.0023 8.9287 124.7372 61.8232 70.8281 173.1213 90 A 5.4725 9.2606 129.1126 49.9774 22.0820 174.6546 91 E 5.7519 9.6092 120.4049 53.1030 33.0126 174.9474 92 L 3.3288 8.4984 126.4879 55.0867 42.5880 177.2218 93 R 4.2362 8.7357 126.2106 58.3736 31.2432 176.7553 94 S 4.5975 7.0929 110.2731 57.4098 66.0261 174.8484 95 V 4.6235 8.2123 120.0834 60.0975 33.5937 175.1989 96 E 4.4516 9.2501 126.2875 54.2693 30.8972 176.3397 97 G 4.0832 8.1783 117.7381 45.8007 0.0000 172.4592 98 R 4.3226 8.7116 124.8569 55.6436 30.3882 174.5870 99 R 4.9708 7.5701 119.3878 54.8119 31.7771 174.7639 100 L 5.0276 8.7220 126.4467 52.9386 44.7073 175.2536 101 S 5.1443 8.6012 118.0445 56.2863 65.0895 172.7313 102 W 5.2837 9.3590 126.1731 54.9357 33.0153 174.2234 103 R 5.1269 8.9713 123.2650 55.1395 31.9797 175.4365 104 V 5.2793 8.9748 118.0556 60.0703 36.2333 174.5697 105 S 5.1907 8.8253 116.3540 57.7402 66.8532 172.7566 106 A 5.6849 8.9067 120.9559 50.7544 23.0259 174.7403 107 H 5.1888 8.6730 118.7835 54.4166 33.6907 173.2116 108 D 5.1737 8.0954 123.7266 52.4267 39.4648 177.8737 109 G 4.0526 8.5775 108.7085 46.1467 0.0000 174.3899 110 V 4.1954 7.8795 115.8624 63.8796 33.6624 174.9601 111 D 4.9159 8.4989 118.6734 51.7167 44.1746 174.8497 112 E 4.4528 8.7043 123.0755 56.4980 30.2129 176.4897 113 I 4.3912 9.3738 119.2798 60.0242 39.5016 175.4339 114 G 4.7820 7.7482 113.6201 46.5269 0.0000 171.1532 115 S 5.0200 7.4407 114.1284 56.9415 66.7745 174.6231 116 G 4.0717 7.2792 106.7009 46.1456 0.0000 171.4258 117 T 5.2753 8.0463 112.2513 60.4512 72.8378 173.1158 118 H 5.4320 9.1168 121.3307 55.0867 33.8748 171.7927 119 E 5.3336 9.1379 124.6392 54.7449 32.7115 175.2549 120 R 5.1851 9.1503 121.0912 54.3338 35.1859 173.9551 121 A 5.2291 8.6777 122.5813 50.0172 21.7351 175.8495 122 V 4.3418 8.8442 124.5037 62.8024 32.3661 175.3734 123 I 4.7139 8.8188 120.6449 59.2251 41.8301 174.0773 124 H 4.9531 8.7083 122.9329 55.1916 30.1852 175.4127 125 L 4.0396 8.8446 128.8622 58.4107 41.5830 179.7307 126 E 4.0516 8.0456 117.4719 59.3848 29.2106 179.2717 127 K 4.1890 8.3527 117.4818 58.6353 32.1182 179.0675 128 F 4.2924 8.4877 121.7925 61.1573 39.3706 176.6939 129 N 4.1380 8.3698 116.5057 56.5327 38.4289 176.6608 130 A 4.0187 7.6264 121.1361 55.0014 18.7886 179.4844 131 K 3.9787 7.4915 115.8458 59.3489 32.0063 179.8510 132 V 3.4415 7.4851 118.6353 66.0766 31.2974 178.3326 133 R 3.6674 8.2047 119.2607 58.4234 29.6316 178.3419 134 Q 4.2843 7.4756 114.3103 57.1478 28.6393 177.1964 135 K 4.3907 8.3630 120.0279 57.6253 33.9290 176.1376 136 T 4.0277 7.3762 118.8046 64.0875 68.5080 173.5988 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 K 8.41 4.15 0.00 1.79 1.75 0.00 1.92 0.00 0.00 1.70 0.00 0.00 2.91 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.01 7.81 3 D 8.26 4.05 0.00 2.89 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 G 9.26 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 0.00 0.00 0.00 5 M 7.89 3.61 0.00 1.52 1.61 0.00 0.00 0.00 0.00 0.00 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 0.81 0.00 6 R 7.93 4.39 0.00 1.94 2.02 0.00 2.96 0.00 0.00 3.28 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.56 0.00 7 V 8.05 3.51 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 0.85 0.00 0.00 0.83 0.00 0.00 8 G 9.05 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 9 E 7.78 4.23 0.00 2.09 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 2.41 2.37 0.00 10 R 8.64 5.07 0.00 1.79 1.90 0.00 3.23 0.00 0.00 3.18 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.66 0.00 11 F 9.66 5.27 0.00 3.13 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 12 T 7.38 4.78 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 1.09 0.00 0.00 13 H 8.80 4.47 0.00 2.95 2.94 0.00 5.75 0.00 0.00 0.00 0.00 6.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 D 8.31 5.17 0.00 2.43 2.42 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 F 8.80 4.56 0.00 2.70 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 16 V 7.78 3.85 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 0.57 0.00 0.00 0.75 0.00 0.00 17 V 8.12 3.38 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 0.78 0.00 0.00 0.37 0.00 0.00 18 P 0.00 4.70 0.00 2.00 2.05 0.00 3.64 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.81 0.00 19 P 0.00 4.41 0.00 2.06 2.15 0.00 3.66 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.04 0.00 20 H 7.23 4.28 0.00 3.33 3.29 0.00 5.69 0.00 0.00 0.00 0.00 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 K 7.63 3.85 0.00 1.85 1.58 0.00 0.61 0.00 0.00 0.84 0.00 0.00 2.86 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.15 1.44 7.81 22 T 7.88 5.13 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 1.43 0.00 0.00 23 V 8.42 3.37 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 0.37 0.00 0.00 0.91 0.00 0.00 24 R 8.02 4.19 0.00 1.92 2.02 0.00 3.23 0.00 0.00 3.36 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.73 0.00 25 H 8.21 4.56 0.00 3.48 3.60 0.00 5.85 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 26 L 7.69 4.10 0.00 1.40 1.85 -0.33 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 27 Y 7.58 4.85 0.00 3.33 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 28 P 0.00 4.63 0.00 2.07 2.15 0.00 3.73 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 2.05 2.12 0.00 29 E 8.36 4.06 0.00 2.22 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 2.47 2.41 0.00 30 S 8.05 4.65 0.00 3.66 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 31 P 0.00 4.30 0.00 2.18 2.07 0.00 3.54 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.08 0.00 32 E 7.41 4.14 0.00 1.60 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 0.00 2.24 2.25 0.00 33 F 7.78 5.07 0.00 3.18 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 34 A 7.98 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 35 E 8.07 4.45 0.00 2.11 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 2.25 2.35 0.00 36 A 7.85 4.09 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 37 P 0.00 4.42 0.00 2.06 2.02 0.00 3.67 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.13 0.00 38 E 8.39 4.42 0.00 1.98 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 2.34 2.31 0.00 39 V 7.23 4.81 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 0.92 0.00 0.00 0.96 0.00 0.00 40 F 9.17 4.94 0.00 3.05 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 41 A 8.82 4.12 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 42 T 8.89 3.72 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 1.18 0.00 0.00 43 G 7.83 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.52 4.30 0.00 2.70 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 45 M 7.75 4.12 0.00 1.97 1.84 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.56 0.00 46 V 8.06 3.62 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.93 0.00 0.00 47 G 8.00 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 48 L 8.11 4.26 0.00 2.16 1.99 0.69 0.88 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 49 M 8.18 4.04 0.00 2.06 2.17 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.58 0.00 50 E 8.14 3.82 0.00 2.17 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 0.00 2.07 2.39 0.00 51 W 8.28 4.26 0.00 3.44 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 52 A 8.06 3.90 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 53 C 7.69 3.17 0.00 2.66 1.66 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 54 V 8.05 3.57 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 1.06 0.00 0.00 0.97 0.00 0.00 55 R 7.93 3.94 0.00 2.05 1.97 0.00 3.29 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 2.03 0.00 56 A 7.26 3.61 1.10 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 0.00 0.00 57 M 8.08 4.46 0.00 2.54 2.46 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.92 0.00 58 A 7.68 4.02 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 59 P 0.00 4.24 0.00 1.79 2.02 0.00 3.90 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.91 0.00 60 Y 7.87 4.32 0.00 3.14 3.06 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 61 L 7.14 4.51 0.00 1.65 1.62 1.02 1.23 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 62 E 9.54 4.32 0.00 2.07 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 2.35 2.45 0.00 63 P 0.00 4.33 0.00 2.05 2.02 0.00 3.70 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.11 0.00 64 G 9.08 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 65 E 7.87 4.93 0.00 2.16 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 2.32 2.32 0.00 66 G 8.89 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 0.00 0.00 0.00 67 S 8.31 5.73 0.00 3.92 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 68 L 8.21 4.78 0.00 1.36 1.45 0.86 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 69 G 8.74 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 0.00 0.00 0.00 0.00 70 T 8.85 4.72 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 1.20 0.00 0.00 71 A 7.62 4.66 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 72 I 8.24 5.02 1.91 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 1.22 0.78 0.92 0.00 0.00 73 C 9.60 4.72 0.00 2.97 2.77 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 74 V 8.04 5.17 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 0.85 0.00 0.00 0.93 0.00 0.00 75 T 8.60 4.34 4.27 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 1.23 0.00 0.00 76 H 8.60 5.39 0.00 3.09 3.18 0.00 5.73 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 77 T 8.93 4.60 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 1.23 0.00 0.00 78 A 7.80 4.55 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 79 A 8.33 4.79 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 80 T 8.33 4.67 4.35 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 1.17 0.00 0.00 81 P 0.00 4.83 0.00 2.10 2.18 0.00 3.70 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.99 0.00 82 P 0.00 4.43 0.00 2.02 1.88 0.00 3.64 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.09 0.00 83 G 9.06 4.07 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 0.00 0.00 0.00 0.00 0.00 0.00 84 L 7.28 4.22 0.00 1.69 1.66 0.87 0.65 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 85 T 8.17 4.63 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 1.09 0.00 0.00 86 V 8.57 4.34 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 1.05 0.00 0.00 0.69 0.00 0.00 87 T 8.95 4.78 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 1.15 0.00 0.00 88 V 8.90 4.63 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 1.02 0.00 0.00 0.95 0.00 0.00 89 T 8.93 5.00 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 1.24 0.00 0.00 90 A 9.26 5.47 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 91 E 9.61 5.75 0.00 2.02 2.13 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 0.00 2.45 2.15 0.00 92 L 8.50 3.33 0.00 0.93 1.21 -0.29 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 93 R 8.74 4.24 0.00 1.70 1.89 0.00 3.28 0.00 0.00 3.27 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.62 0.00 94 S 7.09 4.60 0.00 3.74 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 95 V 8.21 4.62 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 0.55 0.00 0.00 0.86 0.00 0.00 96 E 9.25 4.45 0.00 1.91 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.19 0.00 97 G 8.18 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 98 R 8.71 4.32 0.00 1.88 2.07 0.00 3.12 0.00 0.00 3.56 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.60 0.00 99 R 7.57 4.97 0.00 1.97 1.95 0.00 3.09 0.00 0.00 3.16 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.61 0.00 100 L 8.72 5.03 0.00 1.81 1.37 0.94 0.35 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 0.00 101 S 8.60 5.14 0.00 3.83 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 0.00 102 W 9.36 5.28 0.00 3.41 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 0.00 103 R 8.97 5.13 0.00 1.94 1.85 0.00 3.07 0.00 0.00 3.21 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.85 0.00 104 V 8.97 5.28 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 0.83 0.00 0.00 1.03 0.00 0.00 105 S 8.83 5.19 0.00 3.97 3.95 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 0.00 106 A 8.91 5.68 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 0.00 107 H 8.67 5.19 0.00 3.16 3.06 0.00 5.65 0.00 0.00 0.00 0.00 6.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 D 8.10 5.17 0.00 2.76 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 0.00 109 G 8.58 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 0.00 0.00 0.00 110 V 7.88 4.20 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 0.86 0.00 0.00 0.91 0.00 0.00 111 D 8.50 4.92 0.00 2.63 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 0.00 112 E 8.70 4.45 0.00 2.00 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 2.32 2.53 0.00 113 I 9.37 4.39 2.15 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.83 1.00 0.00 0.00 114 G 7.75 4.78 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 0.00 0.00 0.00 0.00 0.00 0.00 115 S 7.44 5.02 0.00 4.02 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 0.00 116 G 7.28 4.07 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 0.00 0.00 0.00 0.00 0.00 0.00 117 T 8.05 5.28 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 1.26 0.00 0.00 118 H 9.12 5.43 0.00 3.28 3.23 0.00 5.72 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 E 9.14 5.33 0.00 1.99 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 0.00 2.23 2.32 0.00 120 R 9.15 5.19 0.00 1.84 1.87 0.00 2.97 0.00 0.00 3.18 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.52 0.00 121 A 8.68 5.23 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 0.00 122 V 8.84 4.34 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 0.84 0.00 0.00 0.96 0.00 0.00 123 I 8.82 4.71 1.77 0.00 0.00 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.73 0.65 0.00 0.00 124 H 8.71 4.95 0.00 3.21 3.27 0.00 5.70 0.00 0.00 0.00 0.00 6.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 L 8.84 4.04 0.00 1.72 1.74 0.91 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 126 E 8.05 4.05 0.00 2.17 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 2.43 2.41 0.00 127 K 8.35 4.19 0.00 1.87 1.89 0.00 1.58 0.00 0.00 1.67 0.00 0.00 2.88 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.51 1.26 7.81 128 F 8.49 4.29 0.00 3.22 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 0.00 129 N 8.37 4.14 0.00 2.95 2.98 0.00 0.00 7.11 8.25 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 0.00 130 A 7.63 4.02 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 0.00 131 K 7.49 3.98 0.00 1.66 1.71 0.00 1.70 0.00 0.00 1.60 0.00 0.00 2.90 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.42 1.60 7.81 132 V 7.49 3.44 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 0.94 0.00 0.00 0.32 0.00 0.00 133 R 8.20 3.67 0.00 1.85 1.94 0.00 3.17 0.00 0.00 3.25 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.78 0.00 134 Q 7.48 4.28 0.00 2.20 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.76 0.00 0.00 0.00 0.00 0.00 2.36 2.52 0.00 135 K 8.36 4.39 0.00 1.79 1.80 0.00 1.69 0.00 0.00 1.65 0.00 0.00 3.00 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.34 1.39 7.81 136 T 7.38 4.03 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 1.20 0.00 0.00