NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.3661 8.1927 116.7287 57.9444 65.4195 172.9177 3 E 4.8347 7.9289 117.7964 52.5799 32.8933 172.8587 4 Q 4.7596 9.0448 122.3298 54.4583 33.0926 173.3380 5 S 4.5475 8.8228 117.0705 58.3815 62.4100 173.6810 6 I 4.3221 8.5583 121.3911 62.2562 38.7791 174.9366 7 C 4.6755 7.5736 116.3778 57.7670 32.9217 172.5983 8 Q 4.8890 8.3769 119.8421 54.8569 31.4852 173.3962 9 A 5.0149 9.1356 127.3895 50.3742 23.5000 174.9449 10 R 4.8735 9.3360 120.5695 55.9638 31.5406 175.6914 11 A 4.7986 8.7692 124.0259 50.4928 23.3568 174.8916 12 A 3.9106 7.2883 123.4575 51.2794 19.8207 176.8449 13 V 4.0977 8.1432 123.2037 62.3839 33.0599 174.7512 14 M 5.3366 9.2514 127.1547 53.6841 35.8152 175.0703 15 V 4.9145 8.7072 113.6458 59.7342 36.0064 174.1631 16 Y 4.0781 8.3064 125.3294 56.6051 40.2749 173.8899 17 D 4.3464 8.5960 128.1386 53.5919 41.3080 176.6402 18 D 4.3363 8.5671 126.7074 56.5389 41.4743 178.0463 19 A 4.0936 8.0456 121.3737 54.4940 18.6980 177.8096 20 N 4.4943 8.1217 110.1777 52.3857 39.6777 174.9269 21 K 3.5165 7.6258 116.3798 55.4252 30.0681 174.3507 22 K 4.5218 6.1581 115.9254 54.9793 36.7601 176.6668 23 W 4.7639 8.6699 121.3774 56.8081 29.8661 176.1535 24 V 4.6637 9.0672 116.8855 58.5783 35.6436 173.3363 25 P 4.6434 0.0000 0.0000 62.3965 32.4656 175.9442 26 A 4.0356 8.8001 128.4268 53.4172 18.6798 178.1619 27 G 3.8949 8.8315 111.4808 44.9781 0.0000 174.0015 28 G 4.0228 7.9174 108.3219 44.8895 0.0000 173.9021 29 S 4.6452 7.6241 114.2427 56.5305 64.2946 174.2982 30 T 3.9878 8.2525 115.5097 62.0726 69.3393 173.3066 31 G 4.2657 8.5911 109.2064 43.9522 0.0000 173.7291 32 F 4.4286 9.0210 118.3754 57.2921 40.5749 174.8459 33 S 5.1781 9.1598 117.1275 56.7664 67.2260 173.0631 34 R 4.7069 8.8623 122.5380 55.3397 31.3502 175.0652 35 V 4.9563 8.8786 127.6387 61.6404 33.7756 174.1046 36 H 5.7563 9.6793 125.0922 53.4880 31.9876 173.4668 37 I 4.8212 7.9722 121.6367 60.2218 39.2141 174.1036 38 Y 4.9669 9.3328 125.6146 56.7796 40.3780 174.1404 39 H 4.7604 9.3055 124.2915 54.6455 32.0224 173.1659 40 H 4.7920 9.0400 127.9271 55.5524 29.4318 175.8527 41 T 3.6022 8.0719 117.8728 63.6831 69.1387 176.5666 42 G 3.7189 7.9367 110.5510 47.4688 0.0000 173.9806 43 N 4.5780 8.2442 114.6130 52.0969 40.0675 173.8387 44 N 4.1142 8.1536 116.1889 55.1715 37.8481 172.9065 45 T 4.8653 7.2847 106.0846 59.8882 73.0979 173.4417 46 F 5.4524 8.6159 119.4471 56.0680 43.5304 174.1635 47 R 4.9678 8.7509 120.0340 55.2749 34.0926 173.7073 48 V 4.7358 9.3402 127.0595 61.8079 33.3096 174.6319 49 V 5.0335 9.4970 128.2051 61.1633 34.6830 174.2139 50 G 4.5968 9.3008 115.0572 44.4937 0.0000 171.8539 51 R 5.3801 8.7968 121.9470 53.6846 34.1771 175.0956 52 K 4.2841 9.1906 123.6866 57.1821 32.5846 178.4639 53 I 3.7806 8.4579 125.3086 64.1045 37.5756 177.7446 54 Q 4.0778 8.2148 120.9368 58.4752 28.9896 176.0101 55 D 4.7044 7.5355 111.8840 52.3327 40.3951 175.4145 56 H 4.2275 8.4959 115.3450 56.4887 27.1720 174.3851 57 Q 4.0366 7.9454 121.7923 56.5086 29.8459 175.8378 58 V 4.3386 8.5719 126.7498 63.5379 31.4187 175.5810 59 V 4.4044 8.6644 121.3351 61.6230 33.6443 176.2619 60 I 4.5578 7.5537 120.7083 59.6426 41.4183 173.3730 61 N 5.3948 8.8843 127.3028 51.7290 39.7630 170.7552 62 C 4.9572 9.3621 123.1510 56.5505 34.5261 172.8574 63 A 4.4362 8.9451 127.8992 52.3877 19.1208 177.1689 64 I 4.3272 8.3830 122.1122 58.7104 37.6056 174.2531 65 P 4.5581 0.0000 0.0000 61.7210 32.1633 178.1355 66 K 3.9995 8.5937 118.1869 59.1433 32.7034 177.8703 67 G 3.9623 7.8792 107.2265 44.9621 0.0000 173.2966 68 L 3.9852 7.5242 122.7647 54.8738 42.2974 176.9828 69 K 4.3405 8.6345 126.1049 55.1518 31.4615 174.8708 70 Y 4.6679 8.4576 125.4725 56.3873 39.3197 174.1335 71 N 4.7807 9.2286 127.1065 52.1181 40.5697 174.8798 72 Q 4.1717 8.2735 128.2198 53.7372 27.2356 174.8547 73 A 4.0239 7.7511 123.8314 55.0061 19.1209 178.7208 74 T 4.8060 7.7350 104.0993 59.6147 71.5179 174.1062 75 Q 4.2206 8.7227 119.2615 58.4734 29.0016 177.1120 76 T 4.6157 8.0413 105.2817 60.8508 69.9740 172.4416 77 F 5.1343 8.4640 125.3568 57.0456 41.9695 173.3168 78 H 5.5382 8.4698 123.3637 54.0953 32.2478 173.0744 79 Q 5.0530 9.1105 118.9526 54.8654 32.7436 173.3874 80 W 5.3693 8.5496 114.4291 55.9035 31.6934 173.6537 81 R 4.6708 8.8934 121.8350 55.6258 30.8399 175.9749 82 D 4.3847 9.3627 123.7567 53.7590 42.0411 179.0229 83 A 3.3247 8.3991 124.8734 53.6996 19.9057 177.7498 84 R 3.7692 7.2580 116.6568 58.9361 30.9336 177.6826 85 Q 4.3479 8.5454 112.7161 55.1536 32.2388 173.0453 86 V 4.3170 7.9433 117.8364 62.2584 32.8257 174.2912 87 Y 4.8566 8.4975 126.2648 56.8128 39.9446 174.9587 88 G 3.9306 9.0703 108.9366 44.2261 0.0000 171.3697 89 L 4.3788 8.0246 122.7177 52.4426 44.8514 175.3790 90 N 4.9617 8.1657 124.5119 51.8192 38.9216 174.0796 91 F 4.8146 8.9424 124.7113 57.0610 39.3647 176.0963 92 G 4.1025 9.1899 109.8197 49.0290 0.0000 173.7990 93 S 4.9171 8.0749 113.2918 55.2753 66.5406 175.1216 94 K 3.9630 8.6450 120.2218 59.3260 31.6644 178.8793 95 E 3.8731 8.2300 119.2396 59.7313 29.5350 178.3939 96 D 4.3627 8.4928 118.6435 57.3624 40.8557 178.9670 97 A 2.0000 7.5315 120.7355 54.7453 18.3875 179.4023 98 N 4.2218 8.2115 115.2798 56.3242 38.5416 177.8963 99 V 3.4970 7.6350 119.5160 65.9034 31.6647 177.7738 100 F 3.8366 7.9974 119.9272 61.2581 39.1968 176.7888 101 A 4.0230 8.3050 120.4687 55.3418 18.2387 179.5158 102 S 3.9202 8.1738 111.3235 61.5017 62.4516 176.3135 103 A 3.8432 7.8056 123.4895 55.0743 18.0111 179.3367 104 M 3.4271 7.7652 117.2642 58.8121 32.2209 178.4364 105 M 3.9366 8.0302 119.2008 58.3208 31.9544 178.2895 106 H 4.0759 7.8748 117.8729 58.9033 30.0783 177.0285 107 A 2.6534 7.4909 122.5241 54.8136 18.0826 179.6782 108 L 3.7303 7.4019 117.3381 57.6685 41.3835 179.3793 109 E 3.8542 7.5584 118.5072 59.0169 29.4122 178.7079 110 V 3.6670 7.7822 118.6944 66.1006 31.4300 178.1142 111 L 4.1491 7.6138 116.8769 56.7657 41.4832 178.1008 112 N 4.8247 7.5202 113.9849 52.7483 38.9990 175.0043 113 S 4.2973 7.6117 120.7544 58.5393 63.3112 173.9621 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 4.37 0.00 3.70 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 3 E 7.93 4.83 0.00 1.86 1.63 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 2.23 2.33 0.00 4 Q 9.04 4.76 0.00 2.16 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.78 0.00 0.00 0.00 0.00 0.00 2.21 2.32 0.00 5 S 8.82 4.55 0.00 3.64 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 6 I 8.56 4.32 1.88 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.65 1.02 0.00 0.00 7 C 7.57 4.68 0.00 2.90 2.90 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 0.00 0.00 0.00 8 Q 8.38 4.89 0.00 1.95 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.75 0.00 0.00 0.00 0.00 0.00 2.19 2.08 0.00 9 A 9.14 5.01 1.53 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 0.00 0.00 10 R 9.34 4.87 0.00 1.97 2.14 0.00 3.17 0.00 0.00 3.20 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.67 0.00 11 A 8.77 4.80 0.65 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 0.00 0.00 0.00 0.00 0.00 0.00 12 A 7.29 3.91 0.64 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 0.00 0.00 13 V 8.14 4.10 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 1.06 0.00 0.00 0.83 0.00 0.00 14 M 9.25 5.34 0.00 2.29 2.04 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.51 0.00 15 V 8.71 4.91 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 0.46 0.00 0.00 0.89 0.00 0.00 16 Y 8.31 4.08 0.00 1.57 2.29 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 17 D 8.60 4.35 0.00 2.47 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 0.00 0.00 0.00 0.00 18 D 8.57 4.34 0.00 2.63 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 19 A 8.05 4.09 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 N 8.12 4.49 0.00 2.65 2.75 0.00 0.00 7.15 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 21 K 7.63 3.52 0.00 1.85 1.85 0.00 1.74 0.00 0.00 1.67 0.00 0.00 3.11 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.32 1.44 7.81 22 K 6.16 4.52 0.00 1.70 1.71 0.00 1.45 0.00 0.00 1.74 0.00 0.00 2.91 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.18 1.33 7.81 23 W 8.67 4.76 0.00 3.21 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 24 V 9.07 4.66 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 0.66 0.00 0.00 0.95 0.00 0.00 25 P 0.00 4.64 0.00 2.08 1.97 0.00 3.60 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.11 0.00 26 A 8.80 4.04 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 27 G 8.83 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 28 G 7.92 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 0.00 0.00 0.00 29 S 7.62 4.65 0.00 4.00 3.90 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 0.00 0.00 0.00 30 T 8.25 3.99 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 31 G 8.59 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 0.00 0.00 0.00 0.00 32 F 9.02 4.43 0.00 2.92 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 33 S 9.16 5.18 0.00 3.76 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 34 R 8.86 4.71 0.00 2.00 1.90 0.00 3.33 0.00 0.00 3.15 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.59 0.00 35 V 8.88 4.96 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 1.04 0.00 0.00 0.87 0.00 0.00 36 H 9.68 5.76 0.00 2.67 2.44 0.00 5.66 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 I 7.97 4.82 1.62 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.19 0.90 0.00 0.00 38 Y 9.33 4.97 0.00 2.89 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 H 9.31 4.76 0.00 3.08 3.07 0.00 5.59 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 40 H 9.04 4.79 0.00 3.14 3.06 0.00 5.63 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 T 8.07 3.60 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 1.00 0.00 0.00 42 G 7.94 3.72 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 0.00 0.00 0.00 43 N 8.24 4.58 0.00 2.53 2.77 0.00 0.00 6.85 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 44 N 8.15 4.11 0.00 2.80 2.85 0.00 0.00 6.93 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 45 T 7.28 4.87 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 46 F 8.62 5.45 0.00 2.86 2.87 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 0.00 0.00 0.00 47 R 8.75 4.97 0.00 1.96 1.86 0.00 3.27 0.00 0.00 3.13 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.66 0.00 48 V 9.34 4.74 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 1.28 0.00 0.00 0.84 0.00 0.00 49 V 9.50 5.03 2.56 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 1.07 0.00 0.00 1.08 0.00 0.00 50 G 9.30 4.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.80 5.38 0.00 1.85 2.00 0.00 3.26 0.00 0.00 3.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.69 0.00 52 K 9.19 4.28 0.00 1.86 1.75 0.00 1.70 0.00 0.00 1.66 0.00 0.00 2.89 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.64 1.61 7.81 53 I 8.46 3.78 1.94 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.60 0.94 0.00 0.00 54 Q 8.21 4.08 0.00 2.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.90 0.00 0.00 0.00 0.00 0.00 2.34 2.40 0.00 55 D 7.54 4.70 0.00 2.77 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 56 H 8.50 4.23 0.00 3.38 3.49 0.00 5.67 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 Q 7.95 4.04 0.00 2.43 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.99 0.00 0.00 0.00 0.00 0.00 2.39 2.35 0.00 58 V 8.57 4.34 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 0.89 0.00 0.00 0.97 0.00 0.00 59 V 8.66 4.40 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 0.80 0.00 0.00 0.95 0.00 0.00 60 I 7.55 4.56 1.91 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 1.22 0.97 0.00 0.00 61 N 8.88 5.39 0.00 2.74 2.70 0.00 0.00 6.86 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 62 C 9.36 4.96 0.00 2.73 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 63 A 8.95 4.44 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 64 I 8.38 4.33 1.87 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.62 0.69 0.00 0.00 65 P 0.00 4.56 0.00 2.25 2.22 0.00 3.74 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.02 0.00 66 K 8.59 4.00 0.00 1.97 1.99 0.00 1.71 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.41 1.44 7.81 67 G 7.88 3.96 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 0.00 0.00 0.00 68 L 7.52 3.99 0.00 1.71 1.53 0.55 0.64 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 69 K 8.63 4.34 0.00 2.16 1.87 0.00 1.91 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 2.65 0.00 0.00 0.00 0.00 1.37 0.97 7.81 70 Y 8.46 4.67 0.00 2.83 2.91 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 71 N 9.23 4.78 0.00 2.81 2.80 0.00 0.00 6.74 7.57 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 72 Q 8.27 4.17 0.00 2.02 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.73 0.00 0.00 0.00 0.00 0.00 1.76 2.17 0.00 73 A 7.75 4.02 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 T 7.73 4.81 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 1.21 0.00 0.00 75 Q 8.72 4.22 0.00 2.11 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.05 6.92 0.00 0.00 0.00 0.00 0.00 2.40 2.38 0.00 76 T 8.04 4.62 4.40 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 1.28 0.00 0.00 77 F 8.46 5.13 0.00 3.08 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 H 8.47 5.54 0.00 3.30 2.74 0.00 5.63 0.00 0.00 0.00 0.00 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 Q 9.11 5.05 0.00 2.28 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.68 0.00 0.00 0.00 0.00 0.00 2.35 2.40 0.00 80 W 8.55 5.37 0.00 3.67 3.52 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 81 R 8.89 4.67 0.00 1.85 1.97 0.00 3.24 0.00 0.00 3.18 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.65 0.00 82 D 9.36 4.38 0.00 3.20 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 83 A 8.40 3.32 1.44 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 84 R 7.26 3.77 0.00 1.85 1.95 0.00 3.44 0.00 0.00 3.34 7.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.91 0.00 85 Q 8.55 4.35 0.00 1.91 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.14 6.89 0.00 0.00 0.00 0.00 0.00 1.81 1.31 0.00 86 V 7.94 4.32 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 1.09 0.00 0.00 0.82 0.00 0.00 87 Y 8.50 4.86 0.00 1.43 1.76 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 88 G 9.07 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 89 L 8.02 4.38 0.00 0.48 0.13 0.29 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 90 N 8.17 4.96 0.00 2.80 2.46 0.00 0.00 6.78 7.92 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 91 F 8.94 4.81 0.00 3.00 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 92 G 9.19 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 0.00 0.00 0.00 93 S 8.07 4.92 0.00 3.87 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 94 K 8.64 3.96 0.00 1.91 1.89 0.00 1.80 0.00 0.00 1.74 0.00 0.00 2.84 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.53 1.06 7.81 95 E 8.23 3.87 0.00 2.02 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 2.37 2.41 0.00 96 D 8.49 4.36 0.00 2.98 2.91 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 97 A 7.53 2.00 0.99 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 98 N 8.21 4.22 0.00 2.80 2.85 0.00 0.00 6.75 7.87 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 99 V 7.63 3.50 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 0.97 0.00 0.00 0.97 0.00 0.00 100 F 8.00 3.84 0.00 3.41 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 0.00 101 A 8.31 4.02 1.59 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 0.00 0.00 102 S 8.17 3.92 0.00 3.93 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 0.00 103 A 7.81 3.84 1.08 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 0.00 104 M 7.77 3.43 0.00 1.30 1.15 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.16 0.00 105 M 8.03 3.94 0.00 1.97 2.11 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.75 0.00 106 H 7.87 4.08 0.00 3.06 3.25 0.00 5.60 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 0.00 107 A 7.49 2.65 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 L 7.40 3.73 0.00 1.67 1.59 0.86 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 109 E 7.56 3.85 0.00 2.01 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.41 0.00 110 V 7.78 3.67 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 1.13 0.00 0.00 0.75 0.00 0.00 111 L 7.61 4.15 0.00 1.74 1.72 0.98 1.29 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 0.00 112 N 7.52 4.82 0.00 2.74 2.80 0.00 0.00 7.02 7.57 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 0.00 113 S 7.61 4.30 0.00 3.98 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