NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4394 8.3049 120.3534 54.6419 34.1379 175.4237 2 K 4.1800 7.8228 117.4392 55.1072 32.8987 175.7796 3 T 4.0146 8.6698 112.9080 64.3444 70.0529 174.2404 4 F 4.8550 8.0728 123.4135 58.9920 40.0255 175.0464 5 T 4.3645 7.1230 107.7557 62.0279 69.0566 173.6308 6 A 3.9458 6.3908 124.2705 52.2451 19.0271 178.4569 7 K 3.9218 8.7025 119.6513 59.1960 32.0203 177.1721 8 P 3.9781 0.0000 0.0000 64.7571 31.4731 177.1705 9 E 3.5943 6.7580 113.8249 57.7725 26.8903 174.4657 10 T 4.4267 7.5877 111.8060 59.5725 70.5564 174.9442 11 V 2.9910 7.9781 116.6552 63.5410 31.9186 173.3969 12 K 4.3355 7.5247 119.7695 55.3527 33.4585 174.8578 13 R 4.0902 7.9434 125.1477 55.3844 32.3151 175.6931 14 D 4.0516 6.7902 110.2623 54.5576 37.6463 173.3501 15 W 4.8414 6.7294 123.4190 56.2187 27.5175 172.4561 16 Y 4.7629 7.8530 123.1567 55.1529 41.6750 174.2574 17 V 4.3299 8.7305 127.5669 61.9574 31.7841 177.3483 18 V 4.1077 8.3948 128.1505 60.6951 30.4925 177.9691 19 D 4.4190 8.0208 119.7186 56.3621 39.9118 178.6489 20 A 3.9451 8.3244 122.3352 54.5183 18.4429 176.2351 21 T 3.7056 7.5904 109.9181 63.2165 67.1018 172.1335 22 G 4.2022 8.9885 122.1132 46.5284 0.0000 174.8995 23 K 4.2671 7.8646 117.7902 57.8838 33.0973 177.3323 24 T 4.2609 8.1288 113.3294 60.9781 68.3080 174.7503 25 L 3.6965 7.2343 121.1219 58.9777 42.4917 178.5489 26 G 3.8163 7.8273 108.0186 47.0785 0.0000 174.2075 27 R 4.2006 7.8099 118.7128 57.9858 30.6914 177.2516 28 L 4.7106 7.6878 113.8200 53.8483 43.0655 178.1944 29 A 4.0455 8.6027 123.1007 55.1217 18.4699 179.7943 30 T 4.0643 7.9971 104.9615 64.1890 68.9644 174.6057 31 E 4.6408 7.5411 117.0745 55.2928 30.8759 177.2350 32 L 3.9414 8.0113 123.2570 58.4355 41.8943 178.1545 33 A 3.9061 8.1523 120.0281 55.6064 18.2404 179.1207 34 R 3.8585 7.9594 115.5547 59.1667 30.2007 179.0010 35 R 3.8996 8.0491 118.8600 59.2725 30.0048 178.0929 36 L 4.2303 7.8910 118.7490 59.0093 40.5421 178.6361 37 R 4.2871 8.1372 118.2600 59.0242 30.3877 175.7854 38 G 4.1637 8.5845 103.8203 47.1761 0.0000 172.7125 39 K 3.6387 8.9482 114.6023 58.6978 32.9284 173.8195 40 H 4.7950 7.0441 111.9283 57.0477 31.9679 175.4904 41 K 4.2723 7.8288 112.5689 57.9297 32.0936 178.4293 42 A 4.1552 7.9929 122.7249 54.1155 18.3916 179.0071 43 E 4.1099 7.6164 112.3540 57.5361 29.2013 176.2843 44 Y 4.7044 7.3627 114.0911 59.2821 41.1106 176.1680 45 T 4.8671 7.3696 114.1371 62.0581 69.9852 172.6185 46 P 4.8362 0.0000 0.0000 61.9360 32.1076 176.9758 47 H 4.8323 7.8756 116.2618 57.8536 35.9119 173.1055 48 V 4.3777 7.3617 117.4730 62.2548 34.4853 175.4477 49 D 4.2611 8.9968 121.9443 56.2794 41.2007 173.5468 50 T 4.1210 7.6189 111.6885 61.7622 67.9590 172.7551 51 G 4.2635 8.0687 111.7696 43.9798 0.0000 170.9747 52 D 4.7059 8.1656 117.4367 53.1327 44.6024 174.6959 53 Y 5.2993 8.1606 123.0183 55.9147 39.0567 173.4828 54 I 4.1412 8.0544 116.6659 60.3288 40.1556 175.5786 55 I 4.5114 8.7224 126.2405 59.5782 38.7667 175.5992 56 V 4.1651 8.5149 127.3305 63.3508 32.1451 174.6996 57 L 4.8154 8.5344 123.9809 56.3041 47.2045 175.2951 58 N 5.4378 8.2094 112.1350 51.5665 42.7857 173.4845 59 A 4.5347 8.4887 119.2835 54.0098 21.3477 177.6408 60 D 4.6949 8.0172 112.2738 55.1140 39.6816 177.3309 61 K 4.2998 7.7912 119.5564 56.2298 30.1245 176.6221 62 V 3.6895 8.1306 115.5034 61.6687 31.7891 180.4665 63 A 3.2421 8.4872 118.3770 50.6140 19.8348 177.6602 64 V 3.5922 7.6975 118.0645 61.6807 32.5323 172.2590 65 T 3.4291 7.8260 107.7109 60.8495 67.3334 170.3724 66 G 3.9560 7.1038 109.7613 45.5127 0.0000 172.3262 67 N 4.2507 8.4508 118.1008 56.0163 39.2407 176.7472 68 K 3.7073 8.3433 117.3928 60.0003 32.6469 178.2546 69 R 3.8659 7.9836 119.9208 58.7296 29.8929 177.3836 70 T 4.6534 7.3457 104.2355 61.2882 68.9940 174.3755 71 D 3.3700 7.4619 117.6767 52.2610 41.1225 174.9296 72 K 4.0947 8.3380 123.6545 55.9444 32.3711 176.2483 73 V 4.2228 8.1828 126.3155 62.8878 32.6396 174.3684 74 Y 5.1070 7.8862 121.5798 56.2065 41.2360 174.8539 75 Y 4.8728 8.6614 119.3284 55.8964 40.1900 174.6579 76 H 4.6051 9.1758 118.7874 55.7479 31.4857 173.7563 77 H 4.2243 8.5686 115.0835 56.1137 26.3149 176.3799 78 T 3.8877 8.2975 110.4822 64.0717 68.7237 174.1021 79 G 3.5719 7.5447 110.5399 45.7702 0.0000 174.1571 80 H 4.9676 8.1268 114.3369 54.5158 29.6106 174.1642 81 I 3.3540 8.8653 107.9931 61.3074 36.9108 175.1109 82 G 3.7975 7.8970 113.7490 45.3219 0.0000 174.8616 83 G 3.6551 7.5492 111.4450 45.1631 0.0000 173.3794 84 I 3.6359 7.8400 115.3917 60.3649 38.2680 177.0113 85 K 4.4951 8.3314 125.5308 55.3759 33.6773 175.8018 86 Q 4.6281 8.3130 116.6409 55.0220 32.3555 175.5184 87 A 4.4455 8.1671 120.4682 52.5114 20.4172 176.5441 88 T 3.5153 7.6457 113.1161 63.1786 68.3277 173.1411 89 F 5.6131 7.7378 122.6269 54.5671 42.7294 176.1130 90 E 4.1614 9.0335 119.7598 60.1003 29.2862 178.9151 91 E 4.3433 8.0223 112.8004 57.4951 29.8094 177.3282 92 M 4.3241 7.9439 118.4607 57.3182 33.2664 176.9404 93 I 3.9368 7.7313 118.2394 63.5976 37.8244 177.3555 94 A 4.0154 7.8511 121.3687 54.6454 17.8746 179.5273 95 R 3.8879 8.0933 115.5053 58.2051 30.4223 176.7843 96 R 4.4718 7.9681 118.2748 53.3642 31.5544 173.9153 97 P 4.3570 0.0000 0.0000 62.8257 29.5696 174.2250 98 E 4.3604 7.8212 122.8133 55.1382 32.2854 175.3932 99 R 4.7958 7.6964 123.8142 56.2061 32.6200 175.2063 100 V 4.2738 8.1800 112.4987 62.5035 36.0438 174.2220 101 I 4.3133 7.5981 118.3625 60.3699 39.0663 174.9349 102 E 4.5655 7.8432 113.3774 57.9517 32.4310 176.5489 103 I 3.6622 7.9279 118.2950 61.7236 38.6899 176.5308 104 A 3.8179 8.3027 124.6775 53.9139 17.4877 179.0827 105 V 3.5450 7.6982 113.5877 65.5948 31.8986 178.0823 106 K 3.9236 8.1320 121.0419 59.3399 32.0690 177.7422 107 G 3.8842 8.0285 104.9129 46.4528 0.0000 174.1259 108 M 4.3397 7.8794 118.0434 56.0570 34.0396 176.5349 109 L 4.4648 7.9998 121.0443 52.6266 40.3559 174.7097 110 P 5.1508 0.0000 0.0000 61.6419 32.5432 176.9517 111 K 4.3453 8.9422 117.3109 58.4200 34.6321 175.4579 112 G 3.5683 7.7287 111.0389 45.5540 0.0000 171.5560 113 P 4.0168 0.0000 0.0000 62.5827 31.9034 176.1231 114 L 3.8197 8.9564 129.4505 56.7171 42.1758 175.8494 115 G 3.5412 7.6699 105.7773 47.4296 0.0000 174.7609 116 R 4.2004 7.6015 115.2538 57.7463 29.3245 176.8679 117 A 4.8307 7.8509 118.9815 52.0639 20.1876 175.5874 118 M 4.8359 7.6347 115.2557 55.4013 32.9276 176.8612 119 F 4.2183 8.6753 115.7780 59.8375 39.5036 176.8408 120 R 4.6295 7.7752 117.8375 55.8649 30.5129 177.5287 121 K 4.0245 8.2220 119.9650 58.5404 32.5130 177.4433 122 L 4.8376 7.9239 116.3492 54.8330 40.4007 178.6145 123 K 3.9159 9.1511 126.4084 57.6691 31.4562 177.3181 124 V 3.4190 8.4450 107.2597 61.9782 29.8297 172.3316 125 Y 3.9791 7.1659 115.9108 58.6867 37.9996 176.0590 126 A 4.7305 9.7708 126.8687 49.3517 21.5037 174.9694 127 G 4.0291 10.0620 123.7898 46.0956 0.0000 173.7182 128 N 3.8422 8.0587 121.0620 53.9292 39.2597 174.4358 129 E 3.6178 8.7810 112.4468 59.6292 29.7088 177.7457 130 H 4.2794 8.2358 117.0417 58.1160 30.0723 174.3042 131 N 5.0692 7.7677 117.7344 53.7618 39.5875 174.3825 132 H 4.6784 8.1608 111.0751 55.3763 28.0760 177.0247 133 A 3.9780 7.8614 120.0898 53.3461 18.5126 178.6946 134 A 4.4142 7.4349 119.4960 51.2392 19.3634 176.3148 135 Q 3.9599 8.1911 117.4142 57.0923 29.1978 177.6881 136 Q 4.0621 8.9143 124.5656 58.6476 28.9662 175.4719 137 P 4.1849 0.0000 0.0000 62.6089 31.7621 176.8733 138 Q 4.1477 8.0931 118.8651 55.2842 27.2148 176.7134 139 V 3.9064 7.8048 115.7463 61.0685 32.6845 176.7959 140 L 4.0503 8.1609 121.2620 54.9141 41.4835 176.7504 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 M 8.30 4.44 0.00 1.99 2.16 0.00 0.00 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.64 0.00 2 K 7.82 4.18 0.00 1.93 1.85 0.00 1.73 0.00 0.00 1.78 0.00 0.00 3.12 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.54 1.62 7.81 3 T 8.67 4.01 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 1.23 0.00 0.00 4 F 8.07 4.86 0.00 2.68 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 5 T 7.12 4.36 4.39 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 1.35 0.00 0.00 6 A 6.39 3.95 0.72 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 7 K 8.70 3.92 0.00 1.70 1.87 0.00 1.71 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.40 1.40 7.81 8 P 0.00 3.98 0.00 1.86 2.08 0.00 3.72 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.87 0.00 9 E 6.76 3.59 0.00 1.99 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 0.00 2.25 2.27 0.00 10 T 7.59 4.43 4.36 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 1.20 0.00 0.00 11 V 7.98 2.99 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 -0.33 0.00 0.00 0.61 0.00 0.00 12 K 7.52 4.34 0.00 1.82 1.79 0.00 1.72 0.00 0.00 1.91 0.00 0.00 3.17 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.39 1.51 7.81 13 R 7.94 4.09 0.00 1.37 1.32 0.00 3.47 0.00 0.00 3.42 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.56 0.00 14 D 6.79 4.05 0.00 2.63 2.80 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 15 W 6.73 4.84 0.00 3.23 2.84 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 16 Y 7.85 4.76 0.00 3.26 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 17 V 8.73 4.33 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 0.85 0.00 0.00 0.94 0.00 0.00 18 V 8.39 4.11 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 0.70 0.00 0.00 0.97 0.00 0.00 19 D 8.02 4.42 0.00 2.80 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 20 A 8.32 3.95 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 21 T 7.59 3.71 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 1.28 0.00 0.00 22 G 8.99 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 23 K 7.86 4.27 0.00 1.89 1.96 0.00 1.63 0.00 0.00 1.65 0.00 0.00 3.09 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.42 1.44 7.81 24 T 8.13 4.26 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 1.26 0.00 0.00 25 L 7.23 3.70 0.00 1.75 1.70 0.93 1.50 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 26 G 7.83 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 27 R 7.81 4.20 0.00 1.89 1.99 0.00 3.27 0.00 0.00 3.22 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.74 0.00 28 L 7.69 4.71 0.00 1.63 1.60 0.90 1.06 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 29 A 8.60 4.05 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 30 T 8.00 4.06 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 1.30 0.00 0.00 31 E 7.54 4.64 0.00 1.91 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 2.19 2.32 0.00 32 L 8.01 3.94 0.00 1.98 1.65 0.91 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 33 A 8.15 3.91 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 34 R 7.96 3.86 0.00 1.86 1.93 0.00 3.16 0.00 0.00 3.24 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 35 R 8.05 3.90 0.00 1.91 2.11 0.00 3.16 0.00 0.00 3.14 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.64 0.00 36 L 7.89 4.23 0.00 1.78 1.91 0.91 1.14 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 37 R 8.14 4.29 0.00 1.91 2.06 0.00 3.36 0.00 0.00 3.19 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.62 0.00 38 G 8.58 4.16 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 K 8.95 3.64 0.00 1.82 1.87 0.00 1.29 0.00 0.00 1.26 0.00 0.00 2.73 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.19 1.19 7.81 40 H 7.04 4.79 0.00 3.15 3.18 0.00 5.64 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 41 K 7.83 4.27 0.00 1.96 2.20 0.00 1.42 0.00 0.00 1.97 0.00 0.00 3.03 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.48 1.54 7.81 42 A 7.99 4.16 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 43 E 7.62 4.11 0.00 2.03 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 0.00 2.27 1.87 0.00 44 Y 7.36 4.70 0.00 2.96 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 45 T 7.37 4.87 4.30 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 1.36 0.00 0.00 46 P 0.00 4.84 0.00 2.20 2.27 0.00 3.49 0.00 0.00 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.05 0.00 47 H 7.88 4.83 0.00 3.07 3.35 0.00 5.69 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 V 7.36 4.38 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 1.01 0.00 0.00 0.99 0.00 0.00 49 D 9.00 4.26 0.00 2.80 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 50 T 7.62 4.12 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 1.21 0.00 0.00 51 G 8.07 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 0.00 0.00 0.00 52 D 8.17 4.71 0.00 2.54 2.48 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 53 Y 8.16 5.30 0.00 3.05 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 54 I 8.05 4.14 1.91 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 1.57 1.03 0.95 0.00 0.00 55 I 8.72 4.51 1.85 0.00 0.00 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 1.09 0.94 0.00 0.00 56 V 8.51 4.17 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 0.78 0.00 0.00 1.06 0.00 0.00 57 L 8.53 4.82 0.00 1.81 1.59 0.98 0.56 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 58 N 8.21 5.44 0.00 2.69 2.68 0.00 0.00 6.59 7.35 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 59 A 8.49 4.53 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 60 D 8.02 4.69 0.00 2.84 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 61 K 7.79 4.30 0.00 1.79 1.84 0.00 1.75 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.46 1.47 7.81 62 V 8.13 3.69 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 0.75 0.00 0.00 0.97 0.00 0.00 63 A 8.49 3.24 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 64 V 7.70 3.59 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 0.98 0.00 0.00 65 T 7.83 3.43 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 66 G 7.10 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 67 N 8.45 4.25 0.00 2.78 2.82 0.00 0.00 6.57 6.75 0.00 0.00 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 K 8.34 3.71 0.00 1.97 2.09 0.00 1.61 0.00 0.00 1.75 0.00 0.00 2.87 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.44 1.56 7.81 69 R 7.98 3.87 0.00 2.06 2.01 0.00 3.09 0.00 0.00 3.42 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.65 0.00 70 T 7.35 4.65 4.16 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 0.00 0.00 0.00 1.26 0.00 0.00 71 D 7.46 3.37 0.00 2.21 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 0.00 0.00 0.00 0.00 72 K 8.34 4.09 0.00 1.85 1.80 0.00 1.36 0.00 0.00 1.48 0.00 0.00 2.83 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.33 1.09 7.81 73 V 8.18 4.22 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 0.85 0.00 0.00 1.04 0.00 0.00 74 Y 7.89 5.11 0.00 3.02 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 75 Y 8.66 4.87 0.00 2.80 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 76 H 9.18 4.61 0.00 3.02 3.31 0.00 5.86 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 H 8.57 4.22 0.00 3.37 3.42 0.00 5.67 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 T 8.30 3.89 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 1.22 0.00 0.00 79 G 7.54 3.57 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 H 8.13 4.97 0.00 3.16 3.15 0.00 5.78 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 I 8.87 3.35 1.94 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.72 0.95 0.00 0.00 82 G 7.90 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 83 G 7.55 3.66 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 0.00 0.00 0.00 84 I 7.84 3.64 1.86 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 1.40 0.70 0.90 0.00 0.00 85 K 8.33 4.50 0.00 1.79 1.88 0.00 1.70 0.00 0.00 1.73 0.00 0.00 2.98 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.51 1.62 7.81 86 Q 8.31 4.63 0.00 2.04 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.34 0.00 0.00 0.00 0.00 0.00 2.25 2.34 0.00 87 A 8.17 4.45 1.13 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 88 T 7.65 3.52 4.12 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 1.18 0.00 0.00 89 F 7.74 5.61 0.00 3.14 2.94 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 0.00 0.00 0.00 90 E 9.03 4.16 0.00 2.23 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 0.00 2.62 2.42 0.00 91 E 8.02 4.34 0.00 2.11 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 0.00 2.53 2.31 0.00 92 M 7.94 4.32 0.00 2.06 2.21 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 2.53 2.67 0.00 93 I 7.73 3.94 1.93 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.48 1.06 0.00 0.00 94 A 7.85 4.02 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.09 3.89 0.00 1.83 2.03 0.00 3.35 0.00 0.00 3.17 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.68 0.00 96 R 7.97 4.47 0.00 1.72 1.92 0.00 3.25 0.00 0.00 3.26 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.52 0.00 97 P 0.00 4.36 0.00 2.20 2.10 0.00 3.77 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.95 0.00 98 E 7.82 4.36 0.00 1.92 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 2.20 2.18 0.00 99 R 7.70 4.80 0.00 1.78 1.87 0.00 3.33 0.00 0.00 3.27 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.42 0.00 100 V 8.18 4.27 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 0.35 0.00 0.00 0.51 0.00 0.00 101 I 7.60 4.31 1.70 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 1.49 0.83 0.87 0.00 0.00 102 E 7.84 4.57 0.00 2.03 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 2.14 2.20 0.00 103 I 7.93 3.66 1.86 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.66 0.87 0.00 0.00 104 A 8.30 3.82 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 0.00 105 V 7.70 3.54 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 0.97 0.00 0.00 0.95 0.00 0.00 106 K 8.13 3.92 0.00 1.83 1.76 0.00 1.62 0.00 0.00 1.80 0.00 0.00 3.00 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.45 1.51 7.81 107 G 8.03 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 0.00 108 M 7.88 4.34 0.00 1.99 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 2.51 2.47 0.00 109 L 8.00 4.46 0.00 1.58 1.52 0.84 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 110 P 0.00 5.15 0.00 2.16 2.33 0.00 3.29 0.00 0.00 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.92 0.00 111 K 8.94 4.35 0.00 1.71 1.84 0.00 1.74 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.32 1.38 7.81 112 G 7.73 3.57 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 P 0.00 4.02 0.00 2.04 2.00 0.00 3.75 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.13 0.00 114 L 8.96 3.82 0.00 1.69 1.70 0.89 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 115 G 7.67 3.54 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 R 7.60 4.20 0.00 1.98 2.24 0.00 3.03 0.00 0.00 3.26 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.59 0.00 117 A 7.85 4.83 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 0.00 118 M 7.63 4.84 0.00 1.81 1.91 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 2.43 2.54 0.00 119 F 8.68 4.22 0.00 3.01 3.02 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 0.00 120 R 7.78 4.63 0.00 1.82 1.81 0.00 3.11 0.00 0.00 3.21 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.53 0.00 121 K 8.22 4.02 0.00 1.71 1.81 0.00 1.61 0.00 0.00 1.58 0.00 0.00 3.08 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.38 1.33 7.81 122 L 7.92 4.84 0.00 2.19 1.98 0.95 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 123 K 9.15 3.92 0.00 2.12 2.13 0.00 1.89 0.00 0.00 1.78 0.00 0.00 3.02 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.67 1.83 7.81 124 V 8.44 3.42 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 0.63 0.00 0.00 0.84 0.00 0.00 125 Y 7.17 3.98 0.00 3.04 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 0.00 126 A 9.77 4.73 1.23 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 0.00 0.00 0.00 0.00 0.00 0.00 127 G 10.06 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 0.00 128 N 8.06 3.84 0.00 2.96 2.70 0.00 0.00 7.26 7.17 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 0.00 129 E 8.78 3.62 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 2.37 2.30 0.00 130 H 8.24 4.28 0.00 3.07 3.47 0.00 5.86 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 N 7.77 5.07 0.00 2.81 2.70 0.00 0.00 7.20 7.30 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 0.00 132 H 8.16 4.68 0.00 3.20 3.21 0.00 5.68 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 A 7.86 3.98 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 A 7.43 4.41 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 0.00 135 Q 8.19 3.96 0.00 2.25 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.94 6.89 0.00 0.00 0.00 0.00 0.00 2.50 2.38 0.00 136 Q 8.91 4.06 0.00 2.06 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.71 0.00 0.00 0.00 0.00 0.00 2.35 2.31 0.00 137 P 0.00 4.18 0.00 1.81 1.87 0.00 3.61 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 1.90 2.04 0.00 138 Q 8.09 4.15 0.00 1.96 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 7.02 0.00 0.00 0.00 0.00 0.00 2.30 2.30 0.00 139 V 7.80 3.91 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 0.61 0.00 0.00 0.84 0.00 0.00 140 L 8.16 4.05 0.00 0.67 0.68 0.99 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00