NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.2736 8.3231 115.2823 58.3823 63.5618 171.5024 2 G 3.7341 7.0462 107.7315 45.4145 0.0000 170.2975 3 F 4.9415 8.2645 116.4195 55.3941 43.8088 172.5776 4 K 4.3667 8.7266 123.5055 54.9711 32.9951 176.2272 5 H 4.3867 8.4062 121.6169 56.3249 28.8350 175.2545 6 V 4.2727 7.9584 113.7100 60.4150 34.8943 175.0437 7 S 4.2974 8.6170 119.6995 60.0699 62.6500 173.9687 8 H 4.6818 7.7859 114.0688 55.8344 28.6507 175.6474 9 V 4.0460 7.5337 119.7737 61.6983 32.3081 176.0251 10 G 3.8573 8.6112 109.6009 46.6008 0.0000 174.2659 11 W 4.5163 8.0202 128.2152 56.5666 31.3016 174.5379 12 D 3.7137 6.5239 120.7802 51.7031 44.0334 173.5609 13 P 4.3622 0.0000 0.0000 61.8647 28.2318 174.4601 14 Q 4.5625 6.2921 119.2435 57.1057 36.9800 176.2118 15 N 4.5020 7.1364 115.3543 53.6001 40.9166 176.3482 16 G 4.2904 7.2806 105.8060 44.9363 0.0000 176.4769 17 F 4.6992 9.3642 121.3848 55.8546 41.0865 176.3210 18 D 4.8180 8.4577 127.7565 52.7278 39.7146 177.2961 19 V 3.7500 7.8464 116.6321 64.3863 32.3574 178.8059 20 N 4.4234 8.3241 115.6648 55.4365 36.9484 174.9312 21 N 5.0963 8.0104 114.6666 52.4728 39.9208 174.3071 22 L 4.1629 7.8798 119.0566 54.4731 42.3061 177.4931 23 D 4.4325 8.8957 122.2415 54.1984 42.5254 174.7886 24 P 4.2510 0.0000 0.0000 66.2251 31.4350 178.0746 25 D 4.3689 8.1647 116.5236 57.7580 40.3217 178.6442 26 L 3.9240 8.0405 119.8402 58.2189 41.9129 178.7087 27 R 4.1186 8.4071 118.9959 59.9802 30.0391 178.7773 28 S 4.2345 7.9893 114.4336 61.2547 61.8494 176.2665 29 L 3.9847 7.9023 123.0078 57.3849 41.5507 178.7709 30 F 4.3249 7.7131 116.4854 60.0769 39.3293 177.8352 31 S 4.1111 7.8061 110.7475 61.6024 62.0330 176.2342 32 R 4.1013 7.9310 119.8438 58.9403 30.0090 178.3509 33 A 4.1359 7.2774 119.9376 52.9576 19.0523 177.7714 34 G 4.0485 8.6338 105.9483 46.5835 0.0000 173.7530 35 I 4.4900 7.4910 117.6192 59.0439 40.9661 175.5160 36 S 4.7731 7.9769 117.7153 55.8823 65.8843 174.4434 37 E 3.8580 8.5317 118.1577 59.1764 28.6187 179.2958 38 A 3.9784 7.7026 121.3764 54.6951 18.5692 179.1055 39 Q 4.0401 7.6676 114.5520 58.0862 28.9637 177.8749 40 L 3.9103 7.3975 118.4448 55.5205 42.4686 176.6683 41 T 4.5491 8.3300 109.7415 61.7984 69.4529 174.0004 42 D 4.6307 7.9169 121.4293 52.7771 44.3932 175.5497 43 A 3.8809 8.7828 128.3233 54.3823 18.8287 178.7536 44 E 4.1510 8.1399 117.0117 59.7383 29.7615 178.9878 45 T 4.2547 7.8835 115.1941 65.8395 68.7242 176.8485 46 S 4.6500 9.2349 117.6758 61.7164 62.8158 176.6245 47 K 3.9087 8.1486 122.1241 58.7954 32.0656 178.2213 48 L 4.0764 7.4305 118.4951 58.1248 42.2038 178.4852 49 I 4.1944 8.4363 119.6029 63.3923 37.3281 177.2337 50 Y 3.9938 7.8467 120.0887 60.2801 38.4083 177.4814 51 D 3.8609 8.1828 118.1967 56.5366 41.1832 177.3435 52 F 4.2915 8.6092 121.7623 61.1202 39.2608 177.5215 53 I 3.6958 7.6528 118.6325 63.3743 36.5741 177.9804 54 E 3.4673 7.8545 121.1043 58.9165 29.2773 177.9412 55 D 4.1895 7.2082 116.0957 57.1079 41.3609 177.7950 56 Q 3.8533 7.9585 118.1837 57.2569 28.6148 177.0617 57 G 3.8549 7.4945 106.3350 44.8023 0.0000 172.9656 58 G 3.7887 7.1092 106.4319 43.4243 0.0000 173.7254 59 L 3.8667 8.4740 126.8081 58.2305 42.0376 179.4815 60 E 3.9796 8.1338 116.6561 59.2251 29.5026 178.5510 61 A 3.8896 7.8099 120.2679 54.4528 18.6203 179.0772 62 V 3.6864 7.9677 117.5636 65.5979 31.6657 178.0165 63 R 4.0145 7.6482 118.0872 59.8405 29.7754 178.9162 64 Q 4.0507 7.4414 115.4315 58.3762 28.8747 178.2833 65 E 4.1068 8.6997 121.0906 59.3556 28.5855 178.1666 66 M 4.1287 8.0471 118.1862 58.6458 31.7283 178.6069 67 R 4.0785 7.8910 117.8411 58.9835 30.2375 178.1050 68 R 4.2711 7.1576 114.3643 57.1712 32.0053 177.7328 69 Q 4.3966 8.9809 121.3771 53.9648 26.1560 173.9095 70 G 3.8247 7.3714 107.5733 43.9802 0.0000 169.9032 71 G 4.0718 8.8230 108.1379 46.0686 0.0000 174.0166 72 S 4.6925 8.5373 113.4300 57.0686 65.2438 174.6144 73 G 3.7901 8.2970 114.5174 47.9603 0.0000 172.2035 74 G 3.9703 9.9342 115.9568 43.6618 0.0000 173.8752 75 S 5.0685 8.0898 113.1971 58.9498 64.8096 176.8651 76 Q 4.2979 7.9578 119.6236 54.4298 29.9191 172.1798 77 S 3.6417 8.5860 124.8246 57.9040 63.2170 171.7394 78 S 4.5071 8.6078 123.0755 59.8716 63.8379 175.4856 79 E 4.0140 7.9424 117.4627 56.7415 30.0300 173.7800 80 G 3.6246 9.4755 114.0591 47.1150 0.0000 172.3188 81 L 4.2782 8.6306 131.4051 55.5048 41.5987 176.8542 82 V 3.8313 7.6069 116.7953 65.6307 31.2883 177.9485 83 G 3.6023 8.1080 103.9792 47.1984 0.0000 174.9974 84 A 4.0553 7.5899 121.8753 54.9030 18.5072 179.4030 85 L 3.1569 7.4130 118.0673 57.9818 41.6939 178.9094 86 M 4.1538 7.3881 118.1278 58.3613 32.1556 177.8924 87 H 4.4338 8.1542 116.4324 58.3174 28.5493 177.8204 88 V 3.7838 7.5817 119.7454 65.7847 31.4496 177.5117 89 M 4.2901 7.7126 116.8648 57.6254 31.9099 178.4642 90 Q 4.0235 7.5922 117.2154 58.6204 28.5468 178.5762 91 K 3.9065 7.3310 120.4300 59.7101 32.4069 178.7413 92 R 4.1405 7.9206 117.5238 58.9049 29.9292 178.9645 93 S 4.1378 7.8721 114.6389 61.5632 62.8884 176.5919 94 R 4.1064 8.0954 119.6379 57.2964 29.8478 176.6844 95 A 4.4181 7.0752 122.3857 51.2454 19.5456 176.6366 96 I 4.1017 8.2407 124.1678 62.6015 38.2405 177.4496 97 H 4.6792 7.3400 111.5578 55.5058 31.2339 175.2689 98 S 4.3937 7.7298 116.1629 60.4183 63.1854 175.7511 99 S 4.1943 8.2420 114.2372 60.7817 62.7920 174.6018 100 D 4.8937 7.8437 119.9018 53.5376 41.1523 175.7576 101 E 4.4320 8.6313 120.0263 53.7021 31.0498 175.8667 102 G 4.7255 8.1327 127.0700 46.1529 0.0000 171.2758 103 E 4.1566 7.5981 119.6096 56.6863 30.4890 177.0484 104 D 4.8753 8.5140 122.1781 54.4139 43.3778 176.7432 105 Q 4.1232 8.0571 117.9296 55.4372 29.3561 175.0788 106 A 4.6380 8.5285 124.6626 51.3194 21.6330 176.3508 107 G 4.0443 8.9436 110.0770 45.8344 0.0000 173.5518 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 S 8.32 4.27 0.00 3.79 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 2 G 7.05 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 0.00 0.00 0.00 3 F 8.26 4.94 0.00 3.10 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 4 K 8.73 4.37 0.00 1.77 1.78 0.00 1.86 0.00 0.00 1.81 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.29 1.41 7.81 5 H 8.41 4.39 0.00 3.29 3.37 0.00 5.58 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 V 7.96 4.27 1.68 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 0.82 0.00 0.00 0.96 0.00 0.00 7 S 8.62 4.30 0.00 3.80 3.87 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 8 H 7.79 4.68 0.00 3.28 3.41 0.00 5.59 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 V 7.53 4.05 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 0.93 0.00 0.00 1.26 0.00 0.00 10 G 8.61 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 11 W 8.02 4.52 0.00 3.14 3.07 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 12 D 6.52 3.71 0.00 2.40 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 0.00 0.00 0.00 13 P 0.00 4.36 0.00 1.89 1.90 0.00 3.35 0.00 0.00 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.96 0.00 14 Q 6.29 4.56 0.00 1.76 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.13 7.01 0.00 0.00 0.00 0.00 0.00 2.17 2.25 0.00 15 N 7.14 4.50 0.00 2.61 2.73 0.00 0.00 7.19 7.47 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 16 G 7.28 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 0.00 0.00 0.00 0.00 17 F 9.36 4.70 0.00 3.32 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 18 D 8.46 4.82 0.00 2.85 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 19 V 7.85 3.75 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 0.90 0.00 0.00 0.96 0.00 0.00 20 N 8.32 4.42 0.00 2.83 2.99 0.00 0.00 5.80 8.06 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 21 N 8.01 5.10 0.00 2.73 2.83 0.00 0.00 7.06 7.21 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 22 L 7.88 4.16 0.00 1.87 1.74 1.08 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 23 D 8.90 4.43 0.00 2.77 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 P 0.00 4.25 0.00 2.21 2.13 0.00 3.70 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.23 0.00 25 D 8.16 4.37 0.00 2.77 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 26 L 8.04 3.92 0.00 1.74 1.83 0.91 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 27 R 8.41 4.12 0.00 2.19 1.98 0.00 3.20 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.78 0.00 28 S 7.99 4.23 0.00 4.02 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 29 L 7.90 3.98 0.00 1.72 1.68 0.95 0.95 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 30 F 7.71 4.32 0.00 3.34 2.92 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 31 S 7.81 4.11 0.00 3.90 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 32 R 7.93 4.10 0.00 1.91 1.96 0.00 3.34 0.00 0.00 3.23 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.71 0.00 33 A 7.28 4.14 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 34 G 8.63 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 35 I 7.49 4.49 1.92 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.76 0.57 0.00 0.00 36 S 7.98 4.77 0.00 3.90 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 37 E 8.53 3.86 0.00 1.97 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 2.36 2.31 0.00 38 A 7.70 3.98 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 39 Q 7.67 4.04 0.00 2.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.81 0.00 0.00 0.00 0.00 0.00 2.32 2.37 0.00 40 L 7.40 3.91 0.00 1.31 1.09 0.37 -1.18 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 41 T 8.33 4.55 4.24 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 1.17 0.00 0.00 42 D 7.92 4.63 0.00 2.65 2.59 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 43 A 8.78 3.88 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 44 E 8.14 4.15 0.00 2.06 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 0.00 2.43 2.42 0.00 45 T 7.88 4.25 4.52 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 1.22 0.00 0.00 46 S 9.23 4.65 0.00 4.32 4.56 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 47 K 8.15 3.91 0.00 2.01 1.92 0.00 1.79 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.11 1.55 7.81 48 L 7.43 4.08 0.00 1.83 1.92 0.97 1.13 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 49 I 8.44 4.19 2.26 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.89 1.22 0.00 0.00 50 Y 7.85 3.99 0.00 1.81 2.44 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 51 D 8.18 3.86 0.00 2.79 2.69 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 0.00 52 F 8.61 4.29 0.00 3.07 3.15 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 53 I 7.65 3.70 1.79 0.00 0.00 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 1.72 0.90 0.89 0.00 0.00 54 E 7.85 3.47 0.00 1.16 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 1.75 1.57 0.00 55 D 7.21 4.19 0.00 2.69 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 0.00 0.00 0.00 0.00 56 Q 7.96 3.85 0.00 1.58 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.91 5.96 0.00 0.00 0.00 0.00 0.00 1.23 1.25 0.00 57 G 7.49 3.85 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 0.00 0.00 0.00 58 G 7.11 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 59 L 8.47 3.87 0.00 1.74 1.69 1.02 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 60 E 8.13 3.98 0.00 2.23 2.20 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 2.36 2.35 0.00 61 A 7.81 3.89 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 62 V 7.97 3.69 2.18 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 1.03 0.00 0.00 0.77 0.00 0.00 63 R 7.65 4.01 0.00 2.06 1.98 0.00 3.43 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.70 0.00 64 Q 7.44 4.05 0.00 2.11 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.91 0.00 0.00 0.00 0.00 0.00 2.38 2.35 0.00 65 E 8.70 4.11 0.00 1.95 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 0.00 2.25 2.31 0.00 66 M 8.05 4.13 0.00 2.12 2.16 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.54 0.00 67 R 7.89 4.08 0.00 1.98 1.95 0.00 3.24 0.00 0.00 3.22 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 68 R 7.16 4.27 0.00 1.86 1.95 0.00 3.19 0.00 0.00 3.14 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.61 0.00 69 Q 8.98 4.40 0.00 1.97 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.65 0.00 0.00 0.00 0.00 0.00 2.30 2.35 0.00 70 G 7.37 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 71 G 8.82 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 72 S 8.54 4.69 0.00 3.81 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 73 G 8.30 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 74 G 9.93 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 0.00 0.00 0.00 75 S 8.09 5.07 0.00 3.82 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 76 Q 7.96 4.30 0.00 2.02 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 5.88 0.00 0.00 0.00 0.00 0.00 2.24 2.36 0.00 77 S 8.59 3.64 0.00 3.99 3.85 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 78 S 8.61 4.51 0.00 3.89 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 79 E 7.94 4.01 0.00 2.07 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 2.27 2.31 0.00 80 G 9.48 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 L 8.63 4.28 0.00 1.94 1.87 0.92 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.86 0.00 0.00 0.00 0.00 0.00 0.00 82 V 7.61 3.83 2.31 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 1.01 0.00 0.00 0.95 0.00 0.00 83 G 8.11 3.60 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 84 A 7.59 4.06 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 85 L 7.41 3.16 0.00 0.27 1.18 0.64 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 86 M 7.39 4.15 0.00 2.00 2.27 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.62 0.00 87 H 8.15 4.43 0.00 3.32 3.33 0.00 5.63 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 88 V 7.58 3.78 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 1.08 0.00 0.00 1.03 0.00 0.00 89 M 7.71 4.29 0.00 2.09 2.06 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 2.57 2.93 0.00 90 Q 7.59 4.02 0.00 2.32 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.06 6.75 0.00 0.00 0.00 0.00 0.00 2.35 2.59 0.00 91 K 7.33 3.91 0.00 2.00 1.86 0.00 1.69 0.00 0.00 1.71 0.00 0.00 3.14 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.48 1.55 7.81 92 R 7.92 4.14 0.00 2.00 1.95 0.00 3.35 0.00 0.00 3.34 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.67 0.00 93 S 7.87 4.14 0.00 4.00 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 94 R 8.10 4.11 0.00 1.91 1.99 0.00 3.19 0.00 0.00 3.37 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.68 0.00 95 A 7.08 4.42 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 96 I 8.24 4.10 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 1.42 0.50 0.95 0.00 0.00 97 H 7.34 4.68 0.00 3.10 3.21 0.00 5.69 0.00 0.00 0.00 0.00 8.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 S 7.73 4.39 0.00 3.86 3.85 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 99 S 8.24 4.19 0.00 4.03 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 0.00 100 D 7.84 4.89 0.00 2.72 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 0.00 101 E 8.63 4.43 0.00 1.98 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 2.25 0.00 102 G 8.13 4.73 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 0.00 0.00 0.00 103 E 7.60 4.16 0.00 1.97 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 2.31 2.33 0.00 104 D 8.51 4.88 0.00 2.61 2.67 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 0.00 105 Q 8.06 4.12 0.00 2.04 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.68 0.00 0.00 0.00 0.00 0.00 2.36 2.35 0.00 106 A 8.53 4.64 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 0.00 107 G 8.94 4.04 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 0.00 0.00 0.00