NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 11 K 4.2176 8.3144 120.1224 55.9213 34.4874 175.5356 12 R 3.8360 8.0932 122.7722 56.7604 30.9490 174.4279 13 Q 4.5880 9.3601 122.7696 54.3081 33.4992 174.0873 14 V 4.3237 8.4309 117.0844 59.1281 33.7430 176.1109 15 A 4.3783 8.7670 128.2838 53.2395 19.3886 176.1446 16 S 4.7147 7.7883 111.3318 56.9580 63.3046 173.3117 17 G 4.1931 8.7839 117.4023 46.4703 0.0000 170.4872 18 R 4.9033 7.9381 116.8608 55.5757 34.6646 174.7684 19 A 5.1831 8.3599 127.7083 50.4464 22.1996 174.2982 20 Y 4.8513 9.1946 120.5363 56.5031 40.7508 175.1111 21 I 4.6989 8.9651 123.8158 59.9697 40.4516 174.6600 22 H 4.9715 9.4594 130.8693 54.6456 28.4336 172.0623 23 A 4.5366 8.1888 121.5302 51.3057 19.2676 177.4864 24 S 5.0846 9.2204 120.9495 57.6953 65.2663 173.7902 25 Y 4.3427 8.7986 114.8108 59.6455 38.8224 176.0417 26 N 4.7530 8.1105 114.2368 52.4881 39.5993 173.9342 27 N 4.3075 6.8289 118.4040 53.6992 42.7992 172.8122 28 T 4.8909 7.7617 117.5919 61.6672 72.0314 172.7177 29 I 4.6988 8.5682 127.1702 59.2850 40.8478 174.3078 30 V 5.4612 8.6181 123.2534 59.3047 33.7385 174.8832 31 T 5.1569 8.7083 119.7133 60.3403 70.7399 172.5323 32 I 5.2340 8.5706 126.7365 59.9285 40.8360 174.6982 33 T 5.8229 9.6665 114.8265 59.5474 72.8473 171.9489 34 D 4.7893 8.3753 120.7832 50.5139 42.6657 176.4467 35 P 4.6880 0.0000 0.0000 62.6662 30.6221 177.4146 36 D 4.6578 10.0880 118.0511 53.5193 43.3882 177.0457 37 G 4.1547 8.6084 105.1051 44.9117 0.0000 172.8487 38 N 4.5356 7.9766 118.1782 51.5007 39.2054 173.5708 39 P 4.7943 0.0000 0.0000 62.6581 31.3287 174.1481 40 I 4.5787 7.3515 119.9285 61.7908 46.7245 174.3420 41 T 4.6157 7.3022 112.4949 60.1950 70.8073 172.2940 42 W 5.5328 8.1390 124.3557 55.1021 31.7512 173.9708 43 S 4.5744 9.7128 115.0693 57.5662 66.0381 172.7484 44 S 4.9753 8.4681 116.9137 57.0404 65.6320 175.0653 45 G 4.1767 7.9409 108.5568 48.0219 0.0000 175.6119 46 G 3.7675 8.1480 108.7707 47.5954 0.0000 175.9259 47 V 3.6675 7.3697 117.2125 64.3826 31.6461 175.5820 48 I 4.4297 7.4576 119.8883 59.4736 39.0839 176.5584 49 G 3.8399 8.7248 110.5761 48.9176 0.0000 174.0416 50 Y 3.9588 7.9496 118.7129 57.7239 38.2973 174.9710 51 K 4.7421 8.4996 125.0725 55.7526 36.3540 174.5384 52 G 4.1304 8.6092 114.5402 46.0174 0.0000 174.6532 53 S 4.3651 8.9798 119.0619 60.8320 63.4565 176.4366 54 R 4.0401 8.0777 119.6136 58.3510 30.2804 178.6631 55 K 3.9083 8.5959 117.1621 59.6971 31.9149 178.2334 56 G 3.7113 7.6948 103.7906 46.7376 0.0000 173.7083 57 T 4.0411 8.0238 115.9418 61.3741 69.3684 172.5868 58 P 4.3479 0.0000 0.0000 65.4983 31.9146 177.0874 59 Y 4.0958 8.0033 118.4945 60.7662 38.4557 177.7979 60 A 3.4069 7.6435 120.4420 54.8463 18.2127 179.0448 61 A 3.9158 7.4894 119.0969 56.3138 18.5610 178.7338 62 Q 3.6055 8.8395 115.5761 59.5481 28.7648 179.6811 63 L 3.6522 7.6411 117.9030 57.6300 41.9696 179.1802 64 A 3.9244 7.7018 120.6120 55.2294 18.1035 179.1470 65 A 3.7976 7.6139 118.0407 55.6525 18.6493 179.6010 66 L 4.0095 7.7586 116.8995 58.0786 41.8279 179.2640 67 D 4.4276 8.9070 117.8427 56.9253 41.1405 178.0478 68 A 4.0580 8.9097 122.1760 55.1409 18.4683 178.0935 69 A 4.0561 8.4172 121.0154 53.1891 18.2651 179.2493 70 K 3.9889 7.9912 115.4884 59.2485 32.4201 178.8632 71 K 3.8787 7.5562 116.3152 59.6974 32.3425 178.6792 72 A 3.9143 8.0492 120.2954 56.3706 18.3756 178.9483 73 M 3.4206 9.1003 113.7052 59.3997 31.8165 178.2876 74 A 3.9891 7.7825 127.7006 55.7345 19.1243 178.6292 75 Y 3.9893 7.9797 114.6676 60.7389 38.5909 175.1476 76 G 3.3679 7.7032 109.0461 44.9216 0.0000 172.0901 77 M 5.2567 7.5506 117.2659 54.1320 36.2137 173.4425 78 Q 4.8383 8.3647 118.2248 56.7430 36.9800 174.0038 79 S 5.0880 8.5391 114.2828 56.6260 64.8755 172.6593 80 V 4.6278 9.1820 120.2026 59.6772 35.0896 174.3689 81 D 5.0182 8.3178 125.3250 52.6603 41.1369 175.7933 82 V 4.6451 8.0034 125.2362 60.9471 33.7484 175.7920 83 I 4.5718 7.7637 121.7433 60.7725 40.6898 174.2337 84 V 4.8811 8.7948 121.0793 59.9124 34.9694 175.5083 85 R 4.6549 9.0592 121.4965 56.6896 34.1602 175.4926 86 G 4.0266 9.3448 112.0938 44.8778 0.0000 172.7548 87 T 4.4269 8.1033 116.7662 61.8976 66.9543 179.5382 88 G 3.8244 9.1133 117.5359 46.1024 0.0000 172.2884 89 A 4.3537 7.6419 118.6791 53.4830 19.3522 179.2723 90 G 3.7906 7.9314 103.1401 46.8946 0.0000 174.8501 91 R 3.9122 7.9621 120.0965 59.8914 30.3583 177.3299 92 E 4.0826 8.2577 118.5779 59.1103 29.6576 178.4086 93 Q 4.0668 8.1301 117.4852 59.6629 28.5817 178.0112 94 A 3.7609 9.8042 117.8765 56.2288 18.5456 179.6066 95 I 3.0913 8.0833 111.5608 64.4883 37.4351 178.3754 96 R 4.0155 7.9886 119.6273 59.8218 30.2818 178.7208 97 A 3.9902 8.1739 120.1708 55.1740 18.4948 179.3401 98 L 4.0777 8.5018 117.3993 58.6256 41.3815 179.0287 99 Q 4.0719 8.1545 117.9113 58.2041 29.0929 178.0460 100 A 4.2701 8.1509 126.7117 52.5836 17.4263 178.0383 101 S 4.5866 8.1242 113.9980 58.0292 65.0172 174.8298 102 G 3.9508 8.1596 108.3593 46.0498 0.0000 173.0355 103 L 4.6996 7.6419 116.9668 52.4199 45.3303 176.1233 104 Q 4.3566 8.2022 121.3665 54.7616 30.0670 175.3420 105 V 3.9570 8.2969 121.3907 60.5416 30.7153 176.1155 106 K 4.2037 9.5803 129.2025 58.9041 32.6244 176.7688 107 S 4.6658 7.2599 111.8761 58.0103 65.6278 175.6703 108 I 4.5541 8.4607 121.2827 59.5499 39.1881 175.2696 109 V 4.3017 8.1529 125.5286 60.9929 34.6476 174.2148 110 D 4.8493 8.4871 126.8878 52.1273 39.5563 175.5314 111 D 4.6871 7.8454 127.0138 53.4771 39.9089 178.1622 112 T 4.3867 7.6881 116.0654 61.9507 69.0281 174.7001 113 P 4.3521 0.0000 0.0000 62.7098 31.7978 176.4525 114 V 4.5046 8.0082 121.2486 59.0961 34.4478 173.0919 115 P 4.5824 0.0000 0.0000 62.3211 33.0358 175.2959 116 H 4.5724 8.2404 116.2306 55.7080 28.3692 173.9597 117 N 4.1460 8.0766 122.0144 53.1406 34.8415 174.2771 118 G 3.7888 7.9652 111.0957 45.0019 0.0000 171.2066 119 C 4.8864 7.8018 114.5388 54.7732 33.2624 174.7974 120 R 3.9430 8.5935 118.5856 56.2126 29.2759 174.0973 121 P 4.7406 0.0000 0.0000 60.2846 33.8702 174.7193 122 K 3.8240 8.1142 117.5713 56.3241 32.6256 177.7005 123 K 3.7694 8.8269 122.4664 59.7858 32.2606 177.6210 124 K 4.0877 8.4338 119.1788 59.7816 32.1573 177.8998 125 F 4.4361 8.4326 115.2784 58.4943 39.3650 177.1531 126 R 4.1632 8.2567 118.4531 57.4642 29.5308 177.7149 127 K 3.9184 7.5003 117.0162 59.8637 32.8064 177.3058 128 A 4.3239 7.9961 122.9034 52.5257 17.5575 177.2469 129 S 4.3151 7.4114 120.3002 58.9773 62.2636 173.7283 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 11 K 8.31 4.22 0.00 1.76 1.74 0.00 1.73 0.00 0.00 1.70 0.00 0.00 2.89 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.32 1.42 7.81 12 R 8.09 3.84 0.00 1.86 1.87 0.00 3.19 0.00 0.00 3.25 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.73 0.00 13 Q 9.36 4.59 0.00 2.01 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.62 0.00 0.00 0.00 0.00 0.00 2.62 2.52 0.00 14 V 8.43 4.32 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 0.91 0.00 0.00 0.97 0.00 0.00 15 A 8.77 4.38 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 16 S 7.79 4.71 0.00 3.85 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 17 G 8.78 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 18 R 7.94 4.90 0.00 1.85 1.80 0.00 3.31 0.00 0.00 3.40 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.62 0.00 19 A 8.36 5.18 1.20 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 20 Y 9.19 4.85 0.00 2.98 2.93 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 21 I 8.97 4.70 1.89 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 1.12 0.72 0.94 0.00 0.00 22 H 9.46 4.97 0.00 3.25 3.36 0.00 5.77 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 23 A 8.19 4.54 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 24 S 9.22 5.08 0.00 4.02 4.02 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 0.00 0.00 0.00 25 Y 8.80 4.34 0.00 2.84 3.08 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 26 N 8.11 4.75 0.00 2.78 2.91 0.00 0.00 6.72 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 27 N 6.83 4.31 0.00 2.84 2.71 0.00 0.00 6.91 7.09 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 28 T 7.76 4.89 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 29 I 8.57 4.70 1.95 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.63 1.12 0.00 0.00 30 V 8.62 5.46 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 0.61 0.00 0.00 1.06 0.00 0.00 31 T 8.71 5.16 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 32 I 8.57 5.23 2.04 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.40 0.99 0.00 0.00 33 T 9.67 5.82 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 1.32 0.00 0.00 34 D 8.38 4.79 0.00 2.80 2.89 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 35 P 0.00 4.69 0.00 2.08 2.15 0.00 3.65 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 2.14 0.00 36 D 10.09 4.66 0.00 2.84 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 37 G 8.61 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 0.00 0.00 0.00 38 N 7.98 4.54 0.00 3.04 2.76 0.00 0.00 6.95 7.91 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 39 P 0.00 4.79 0.00 2.06 2.10 0.00 3.76 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 1.99 2.04 0.00 40 I 7.35 4.58 1.91 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.51 0.82 0.00 0.00 41 T 7.30 4.62 3.08 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 0.86 0.00 0.00 42 W 8.14 5.53 0.00 3.56 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 S 9.71 4.57 0.00 3.65 3.64 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.47 4.98 0.00 4.12 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 45 G 7.94 4.18 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 0.00 0.00 0.00 46 G 8.15 3.77 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 0.00 47 V 7.37 3.67 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 0.59 0.00 0.00 0.93 0.00 0.00 48 I 7.46 4.43 2.11 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.33 0.99 0.00 0.00 49 G 8.72 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 50 Y 7.95 3.96 0.00 3.28 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 51 K 8.50 4.74 0.00 1.67 1.64 0.00 1.82 0.00 0.00 1.72 0.00 0.00 2.97 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.32 1.42 7.81 52 G 8.61 4.13 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 0.00 0.00 0.00 0.00 0.00 0.00 53 S 8.98 4.37 0.00 4.06 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 54 R 8.08 4.04 0.00 2.16 2.27 0.00 3.35 0.00 0.00 3.43 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.75 0.00 55 K 8.60 3.91 0.00 1.96 1.98 0.00 1.82 0.00 0.00 1.84 0.00 0.00 3.36 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.66 1.58 7.81 56 G 7.69 3.71 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 0.00 0.00 0.00 57 T 8.02 4.04 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 1.03 0.00 0.00 58 P 0.00 4.35 0.00 2.29 2.29 0.00 3.74 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 2.05 1.99 0.00 59 Y 8.00 4.10 0.00 2.96 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 60 A 7.64 3.41 0.74 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 61 A 7.49 3.92 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 62 Q 8.84 3.61 0.00 2.06 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.47 0.00 0.00 0.00 0.00 0.00 2.28 2.41 0.00 63 L 7.64 3.65 0.00 1.70 1.55 0.72 0.43 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 64 A 7.70 3.92 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 65 A 7.61 3.80 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 L 7.76 4.01 0.00 1.97 1.69 0.89 0.88 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 67 D 8.91 4.43 0.00 2.62 2.81 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 68 A 8.91 4.06 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 69 A 8.42 4.06 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 70 K 7.99 3.99 0.00 1.82 1.85 0.00 1.76 0.00 0.00 1.82 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.53 1.58 7.81 71 K 7.56 3.88 0.00 1.90 1.72 0.00 1.83 0.00 0.00 1.48 0.00 0.00 2.95 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.44 1.52 7.81 72 A 8.05 3.91 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 M 9.10 3.42 0.00 1.98 2.09 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.86 0.00 74 A 7.78 3.99 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 Y 7.98 3.99 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 76 G 7.70 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 M 7.55 5.26 0.00 1.94 1.94 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.58 0.00 78 Q 8.36 4.84 0.00 2.17 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.66 0.00 0.00 0.00 0.00 0.00 2.37 2.31 0.00 79 S 8.54 5.09 0.00 3.92 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 80 V 9.18 4.63 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.98 0.00 0.00 81 D 8.32 5.02 0.00 3.03 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 82 V 8.00 4.65 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.00 0.00 0.93 0.00 0.00 83 I 7.76 4.57 1.02 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.09 0.81 0.00 0.00 84 V 8.79 4.88 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 0.87 0.00 0.00 0.97 0.00 0.00 85 R 9.06 4.65 0.00 1.79 1.84 0.00 3.27 0.00 0.00 3.28 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.66 0.00 86 G 9.34 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 0.00 0.00 0.00 0.00 87 T 8.10 4.43 4.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 88 G 9.11 3.82 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 0.00 0.00 0.00 89 A 7.64 4.35 1.19 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 90 G 7.93 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 91 R 7.96 3.91 0.00 1.87 1.99 0.00 3.40 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 1.86 0.00 92 E 8.26 4.08 0.00 2.12 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 2.29 2.38 0.00 93 Q 8.13 4.07 0.00 2.11 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.49 0.00 0.00 0.00 0.00 0.00 2.45 2.39 0.00 94 A 9.80 3.76 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 95 I 8.08 3.09 1.93 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 1.62 1.13 0.90 0.00 0.00 96 R 7.99 4.02 0.00 2.07 1.99 0.00 3.13 0.00 0.00 3.47 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.55 0.00 97 A 8.17 3.99 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 98 L 8.50 4.08 0.00 1.66 1.74 0.91 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 99 Q 8.15 4.07 0.00 2.24 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 7.30 0.00 0.00 0.00 0.00 0.00 2.44 2.56 0.00 100 A 8.15 4.27 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 0.00 101 S 8.12 4.59 0.00 3.93 4.18 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 0.00 102 G 8.16 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 0.00 0.00 0.00 103 L 7.64 4.70 0.00 1.80 1.55 0.97 0.92 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 0.00 104 Q 8.20 4.36 0.00 2.27 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 7.01 0.00 0.00 0.00 0.00 0.00 2.27 2.46 0.00 105 V 8.30 3.96 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 0.92 0.00 0.00 106 K 9.58 4.20 0.00 1.77 1.99 0.00 1.85 0.00 0.00 1.92 0.00 0.00 2.96 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.44 1.39 7.81 107 S 7.26 4.67 0.00 3.86 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 I 8.46 4.55 1.85 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.53 0.89 0.00 0.00 109 V 8.15 4.30 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 1.01 0.00 0.00 0.94 0.00 0.00 110 D 8.49 4.85 0.00 2.68 2.55 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.85 4.69 0.00 2.78 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 0.00 112 T 7.69 4.39 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 1.26 0.00 0.00 113 P 0.00 4.35 0.00 2.18 2.09 0.00 3.70 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.99 0.00 114 V 8.01 4.50 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 0.88 0.00 0.00 0.94 0.00 0.00 115 P 0.00 4.58 0.00 2.26 2.05 0.00 3.76 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 1.94 1.97 0.00 116 H 8.24 4.57 0.00 3.18 3.31 0.00 5.79 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 N 8.08 4.15 0.00 2.91 2.95 0.00 0.00 7.05 7.65 0.00 0.00 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 G 7.97 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 0.00 119 C 7.80 4.89 0.00 3.01 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 0.00 120 R 8.59 3.94 0.00 1.93 1.99 0.00 3.00 0.00 0.00 3.26 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.62 0.00 121 P 0.00 4.74 0.00 2.11 2.06 0.00 3.81 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 1.93 2.01 0.00 122 K 8.11 3.82 0.00 1.52 1.69 0.00 1.57 0.00 0.00 1.48 0.00 0.00 2.73 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.30 7.81 123 K 8.83 3.77 0.00 1.71 1.88 0.00 1.82 0.00 0.00 1.64 0.00 0.00 2.99 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.48 7.81 124 K 8.43 4.09 0.00 1.94 2.14 0.00 2.61 0.00 0.00 2.01 0.00 0.00 3.09 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.70 1.61 7.81 125 F 8.43 4.44 0.00 3.02 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 0.00 126 R 8.26 4.16 0.00 2.18 2.12 0.00 3.12 0.00 0.00 3.18 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.69 0.00 127 K 7.50 3.92 0.00 1.87 1.88 0.00 1.78 0.00 0.00 1.73 0.00 0.00 3.05 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.73 1.57 7.81 128 A 8.00 4.32 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 0.00 129 S 7.41 4.32 0.00 3.99 3.78 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