NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.3214 8.3144 119.9985 56.7935 34.0783 174.7521 2 E 4.4362 8.1572 120.7605 52.0244 32.8524 173.3594 3 S 4.6044 9.3008 122.1976 57.5958 66.6687 174.9519 4 R 3.9545 8.5127 121.3727 59.5720 29.8789 179.2192 5 A 4.2672 7.8781 121.2883 54.4805 18.3820 179.4756 6 K 3.9439 8.2214 118.2395 59.4807 32.2224 178.9174 7 K 4.1206 8.5193 121.7614 58.8496 32.0132 178.3818 8 F 4.0932 8.5473 121.0276 61.4702 39.3349 177.0911 9 Q 4.0305 8.2509 117.4493 59.0070 28.3294 178.8367 10 R 3.8739 7.9715 118.5361 59.6760 30.2357 178.2798 11 Q 3.9165 8.0067 116.6314 58.0294 29.0566 176.3304 12 H 4.6551 7.9483 113.9706 53.9168 31.5217 173.2556 13 M 4.7348 7.9164 118.6339 53.7138 33.4936 176.4818 14 D 4.7297 9.0532 122.8639 52.8794 40.8563 175.8377 15 S 4.3998 8.3520 117.0496 60.0651 63.6115 175.1429 16 D 4.8771 8.0729 117.6714 53.6765 40.9022 175.7533 17 S 4.8481 7.6318 113.1829 55.7537 65.6808 173.7162 18 S 4.1064 8.4737 115.7511 58.1337 62.6832 172.6659 19 P 3.9205 0.0000 0.0000 65.5872 31.1817 177.5790 20 S 4.2995 7.4796 113.9434 56.4971 60.6679 172.0818 21 S 3.9183 7.7815 120.1678 57.6461 63.3990 174.8125 22 S 4.3906 8.5293 119.6837 57.8847 63.4100 175.3404 23 S 4.2380 8.5328 115.1372 60.8872 62.9683 175.1460 24 L 4.3622 7.5238 119.6805 55.4408 42.3399 177.7169 25 Y 3.9945 8.0643 120.7964 61.1981 38.5033 177.6154 26 C 4.1989 8.5090 116.9832 59.9632 39.6590 175.5850 27 N 4.3989 8.3348 117.6180 56.6394 38.0956 177.2531 28 L 3.9960 7.7285 119.8282 57.9986 41.7993 179.4686 29 M 3.6610 7.9136 118.9409 58.4606 31.7192 178.7236 30 M 3.9993 8.0042 119.1017 58.0830 32.0149 178.6549 31 L 4.0301 7.4067 120.4084 57.8090 42.1669 179.1654 32 L 4.0538 7.8273 117.4018 57.1109 41.4967 178.6780 33 R 4.4121 7.7590 115.8490 55.3275 30.2055 176.1078 34 N 4.3074 7.8172 114.3958 54.8545 36.5410 174.6109 35 M 4.4641 8.1674 116.3350 55.5594 31.7719 177.1994 36 T 5.2695 7.6234 107.1475 60.2377 69.6468 172.6896 37 Q 4.7759 8.2396 121.3346 56.5610 29.7457 174.0316 38 G 4.1525 11.0448 113.6179 45.3159 0.0000 173.1332 39 R 3.4424 6.5911 112.7820 54.5533 31.6358 174.4850 40 C 4.7559 8.6651 117.0465 56.0745 40.1744 173.9144 41 K 4.0997 8.7389 127.4846 56.1329 32.4933 174.7914 42 P 4.5927 0.0000 0.0000 65.3836 32.2759 176.7299 43 V 5.0902 7.5391 109.5551 60.0654 35.9387 174.4297 44 N 4.6857 8.9984 120.1903 52.9113 42.8646 173.0356 45 T 4.8974 7.9648 121.2457 61.7106 71.4294 173.0558 46 F 4.7737 9.0491 124.6998 55.6022 42.3844 174.7032 47 V 4.5559 8.8412 122.4269 61.2753 33.4550 175.5562 48 H 5.4422 8.8346 129.5657 53.7372 26.0522 174.1144 49 E 4.8105 7.7151 119.3643 52.7545 34.5891 173.5481 50 P 4.4336 0.0000 0.0000 62.5330 33.1184 177.0806 51 L 4.0254 8.0046 124.7298 58.6967 42.0200 180.0776 52 V 3.8840 7.8765 118.1702 65.1058 30.9720 177.8795 53 D 4.4055 8.0297 118.1951 57.0182 41.0401 178.4814 54 V 3.8060 7.7858 118.3177 66.2035 31.6471 178.0519 55 Q 3.9652 8.5409 118.2182 59.1430 28.5528 178.5746 56 N 4.8082 8.4357 116.6724 55.4694 38.5004 177.4122 57 V 3.7944 7.7982 120.2684 65.9253 31.3443 176.8927 58 C 3.4705 7.6403 115.0904 58.2192 39.7871 174.2440 59 F 4.8316 7.3801 117.6425 57.1333 40.1081 176.0612 60 Q 4.6438 7.6226 122.0400 55.7507 28.1059 176.0217 61 E 4.2449 8.5856 126.0198 56.7717 30.6729 176.2388 62 K 4.2257 8.7754 129.2853 56.4188 32.7945 176.1721 63 V 4.5651 8.0610 119.9913 59.4004 35.9419 175.6225 64 T 3.9489 8.3009 119.0155 63.5165 69.0784 175.7434 65 C 4.5977 8.4798 123.0500 56.5125 41.0729 174.6435 66 K 3.7031 9.4267 123.4000 59.5078 31.7213 177.7017 67 N 4.6029 8.1428 112.4767 52.2707 37.5935 175.7522 68 G 3.9315 8.4721 107.2631 45.8321 0.0000 173.5754 69 Q 4.4756 8.0919 117.6095 54.8079 31.8252 176.3780 70 G 3.7930 8.6902 108.5365 45.0673 0.0000 171.9670 71 N 4.8275 8.3945 115.1031 51.8034 40.6914 175.0533 72 C 5.4520 8.3004 120.7827 55.4040 45.4432 172.6818 73 Y 5.1489 8.6328 117.3919 56.3950 42.1523 173.9345 74 K 5.0977 9.2007 125.2416 54.3065 34.7406 175.6298 75 S 4.5558 8.9393 122.6928 58.5620 63.5598 175.2864 76 N 4.3620 9.7636 121.1452 55.8427 38.5905 175.4922 77 S 4.8971 7.0777 109.5753 56.3224 65.8684 174.2761 78 S 4.2030 8.4262 117.1648 58.5635 62.7830 173.2092 79 M 4.8708 8.9654 126.7217 53.6018 35.4264 174.9433 80 H 4.7359 9.5871 119.6519 55.9844 29.8392 174.8037 81 I 5.2619 9.0841 116.7144 59.4445 41.9354 174.3029 82 T 5.0062 8.9273 118.3022 62.0393 72.2207 173.0911 83 D 5.1953 9.0753 126.5733 53.4728 43.1024 174.7885 84 C 5.5937 9.4038 120.2544 55.2862 44.3876 173.1925 85 R 5.2181 8.9118 122.0817 53.8748 33.4271 174.6683 86 L 3.8109 9.2300 127.3708 55.3360 42.7577 177.0249 87 T 3.9550 8.6243 117.1877 61.6048 69.4782 174.7735 88 N 4.2079 9.1078 122.7115 56.9723 38.9766 176.4753 89 G 3.7013 7.9242 105.0487 47.8210 0.0000 174.1247 90 S 4.2179 7.5255 116.5833 58.4569 63.5020 173.9419 91 R 4.5983 8.0752 120.1004 53.9478 31.9843 173.9125 92 Y 4.3875 8.8433 122.3237 57.7308 39.0245 174.3496 93 P 3.2442 0.0000 0.0000 62.7976 31.6386 175.8809 94 N 4.3285 8.0397 119.3242 53.6466 37.6049 172.8795 95 C 4.7889 8.5489 123.5917 55.0863 39.9414 173.1557 96 A 5.1594 8.4516 126.9656 50.3316 21.4682 174.9523 97 Y 5.1442 9.2484 117.4501 56.3312 42.2842 175.3165 98 R 4.4838 9.0551 122.3137 55.8999 31.9785 175.4327 99 T 4.9786 8.5366 119.8816 62.2058 70.5750 174.4480 100 S 4.6184 9.1924 121.2066 55.5767 64.4300 170.6776 101 P 4.9917 0.0000 0.0000 62.5663 32.2614 175.5327 102 K 4.5677 8.9874 120.5570 56.3973 36.6563 173.7408 103 E 5.2023 8.6285 119.7633 54.7663 31.5576 176.0278 104 R 4.8046 8.9055 122.2276 54.7204 35.4920 174.2307 105 H 4.6777 9.3166 119.6873 55.9458 29.9376 174.7341 106 I 4.6268 8.5468 116.2541 59.5809 40.3958 174.5564 107 I 4.8833 8.2553 124.7259 59.7287 40.1393 174.9811 108 V 4.7032 8.6070 119.7114 59.2489 35.8212 174.6431 109 A 4.9133 8.7490 125.7121 51.4421 20.1455 175.8478 110 C 5.1811 8.6162 119.4986 55.2183 40.1343 173.1962 111 E 4.5740 8.5794 117.6747 56.5273 32.8999 175.2776 112 G 4.0197 9.4711 106.6752 44.7530 0.0000 172.1539 113 S 4.7207 8.0747 112.1859 55.3918 63.7089 171.8654 114 P 4.4335 0.0000 0.0000 62.6763 31.7737 175.8397 115 Y 4.7870 8.4098 121.1605 56.5744 38.6618 174.5842 116 V 4.4255 8.0788 119.4481 58.3559 37.0720 173.5002 117 P 4.2927 0.0000 0.0000 62.9698 31.6531 177.3023 118 V 4.5538 8.6022 115.6889 61.0956 33.8238 175.2784 119 H 4.9382 7.7094 120.1739 55.0054 33.4237 171.8607 120 F 4.4925 8.9522 128.7485 57.7705 39.1063 174.3037 121 D 4.5142 8.2563 126.9473 56.2897 41.9188 175.7634 122 A 4.6194 6.6775 117.2877 51.4652 22.4757 174.8082 123 S 5.1842 8.6659 112.6533 57.1399 66.3869 173.9417 124 V 4.5169 8.7001 113.4637 60.1598 35.7367 175.9257 125 E 3.9778 8.9760 124.8155 58.8613 29.9692 177.2193 126 D 4.5678 7.8419 117.6027 52.7546 40.3553 176.0592 127 S 4.1111 8.3483 116.6766 58.2725 64.3603 174.2374 128 T 3.5219 8.5086 117.0173 63.4039 68.3476 172.1133 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 K 8.31 4.32 0.00 1.89 1.89 0.00 1.54 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.31 1.39 7.81 2 E 8.16 4.44 0.00 2.05 1.78 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 2.34 2.38 0.00 3 S 9.30 4.60 0.00 4.10 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 4 R 8.51 3.95 0.00 1.85 2.05 0.00 3.33 0.00 0.00 3.36 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.66 0.00 5 A 7.88 4.27 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 6 K 8.22 3.94 0.00 1.93 2.00 0.00 1.57 0.00 0.00 1.60 0.00 0.00 3.00 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.51 7.81 7 K 8.52 4.12 0.00 1.94 2.01 0.00 1.76 0.00 0.00 1.71 0.00 0.00 2.91 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.45 1.43 7.81 8 F 8.55 4.09 0.00 3.26 3.28 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 9 Q 8.25 4.03 0.00 2.39 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.58 0.00 0.00 0.00 0.00 0.00 2.56 2.75 0.00 10 R 7.97 3.87 0.00 1.79 2.07 0.00 3.37 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.66 0.00 11 Q 8.01 3.92 0.00 1.61 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.48 0.00 0.00 0.00 0.00 0.00 2.22 2.40 0.00 12 H 7.95 4.66 0.00 1.89 2.61 0.00 5.61 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 M 7.92 4.73 0.00 1.97 2.18 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.69 0.00 14 D 9.05 4.73 0.00 2.70 2.39 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 15 S 8.35 4.40 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 16 D 8.07 4.88 0.00 2.65 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 17 S 7.63 4.85 0.00 4.02 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 18 S 8.47 4.11 0.00 3.80 3.75 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 0.00 0.00 0.00 0.00 19 P 0.00 3.92 0.00 1.86 1.70 0.00 3.58 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 1.79 0.00 20 S 7.48 4.30 0.00 3.76 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 21 S 7.78 3.92 0.00 3.60 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 22 S 8.53 4.39 0.00 4.02 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 23 S 8.53 4.24 0.00 4.03 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 24 L 7.52 4.36 0.00 1.76 1.75 0.93 0.66 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 25 Y 8.06 3.99 0.00 3.09 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 26 C 8.51 4.20 0.00 3.17 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 27 N 8.33 4.40 0.00 3.02 2.93 0.00 0.00 7.14 6.74 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 28 L 7.73 4.00 0.00 1.62 1.56 0.87 0.95 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 29 M 7.91 3.66 0.00 0.80 1.18 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.69 0.00 30 M 8.00 4.00 0.00 1.69 1.82 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 2.33 0.00 31 L 7.41 4.03 0.00 1.81 1.81 0.93 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 32 L 7.83 4.05 0.00 1.57 1.63 0.83 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 33 R 7.76 4.41 0.00 1.91 2.07 0.00 3.58 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.97 0.00 34 N 7.82 4.31 0.00 2.91 2.94 0.00 0.00 6.85 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 35 M 8.17 4.46 0.00 2.03 2.12 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.38 0.00 36 T 7.62 5.27 4.44 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 1.46 0.00 0.00 37 Q 8.24 4.78 0.00 2.09 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.66 0.00 0.00 0.00 0.00 0.00 2.35 2.32 0.00 38 G 11.04 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 39 R 6.59 3.44 0.00 1.75 1.60 0.00 2.87 0.00 0.00 3.18 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.51 0.00 40 C 8.67 4.76 0.00 3.03 3.13 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 41 K 8.74 4.10 0.00 1.83 1.77 0.00 1.74 0.00 0.00 1.59 0.00 0.00 2.94 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.62 1.42 7.81 42 P 0.00 4.59 0.00 2.15 2.10 0.00 3.63 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 2.13 2.14 0.00 43 V 7.54 5.09 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 0.72 0.00 0.00 0.96 0.00 0.00 44 N 9.00 4.69 0.00 2.61 2.29 0.00 0.00 7.08 6.78 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 45 T 7.96 4.90 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 0.88 0.00 0.00 46 F 9.05 4.77 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 47 V 8.84 4.56 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 1.18 0.00 0.00 1.08 0.00 0.00 48 H 8.83 5.44 0.00 3.06 3.24 0.00 5.63 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 49 E 7.72 4.81 0.00 2.01 1.84 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 2.38 2.34 0.00 50 P 0.00 4.43 0.00 2.19 2.01 0.00 3.81 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.18 0.00 51 L 8.00 4.03 0.00 2.01 1.74 1.08 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 52 V 7.88 3.88 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 0.86 0.00 0.00 0.96 0.00 0.00 53 D 8.03 4.41 0.00 2.88 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 54 V 7.79 3.81 2.33 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 1.26 0.00 0.00 1.12 0.00 0.00 55 Q 8.54 3.97 0.00 2.29 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.60 0.00 0.00 0.00 0.00 0.00 2.37 2.60 0.00 56 N 8.44 4.81 0.00 3.03 2.97 0.00 0.00 6.60 6.98 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 57 V 7.80 3.79 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 1.17 0.00 0.00 1.01 0.00 0.00 58 C 7.64 3.47 0.00 2.08 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 0.00 0.00 0.00 0.00 59 F 7.38 4.83 0.00 3.13 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 60 Q 7.62 4.64 0.00 2.24 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.86 0.00 0.00 0.00 0.00 0.00 2.39 2.50 0.00 61 E 8.59 4.24 0.00 2.14 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 0.00 2.31 2.28 0.00 62 K 8.78 4.23 0.00 1.86 1.64 0.00 1.82 0.00 0.00 1.66 0.00 0.00 2.83 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.13 0.76 7.81 63 V 8.06 4.57 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 0.69 0.00 0.00 0.82 0.00 0.00 64 T 8.30 3.95 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 1.17 0.00 0.00 65 C 8.48 4.60 0.00 3.00 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 66 K 9.43 3.70 0.00 1.92 1.91 0.00 1.85 0.00 0.00 1.77 0.00 0.00 3.03 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.48 1.40 7.81 67 N 8.14 4.60 0.00 2.79 2.90 0.00 0.00 6.07 7.00 0.00 0.00 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 G 8.47 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 69 Q 8.09 4.48 0.00 2.13 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.52 0.00 0.00 0.00 0.00 0.00 2.45 2.38 0.00 70 G 8.69 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 71 N 8.39 4.83 0.00 2.80 2.90 0.00 0.00 6.66 7.66 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 72 C 8.30 5.45 0.00 2.85 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 73 Y 8.63 5.15 0.00 2.78 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 74 K 9.20 5.10 0.00 1.74 1.65 0.00 1.60 0.00 0.00 1.96 0.00 0.00 2.71 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.37 1.36 7.81 75 S 8.94 4.56 0.00 3.97 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 76 N 9.76 4.36 0.00 2.73 2.97 0.00 0.00 6.84 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 77 S 7.08 4.90 0.00 3.80 3.74 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 78 S 8.43 4.20 0.00 3.77 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 79 M 8.97 4.87 0.00 2.00 1.98 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.52 0.00 80 H 9.59 4.74 0.00 3.40 3.23 0.00 5.75 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 I 9.08 5.26 1.98 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.75 1.02 0.00 0.00 82 T 8.93 5.01 4.38 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 1.21 0.00 0.00 83 D 9.08 5.20 0.00 2.63 2.60 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 84 C 9.40 5.59 0.00 2.86 2.88 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 85 R 8.91 5.22 0.00 1.81 1.84 0.00 3.18 0.00 0.00 3.13 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.61 0.00 86 L 9.23 3.81 0.00 1.59 1.52 0.29 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 87 T 8.62 3.95 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 1.22 0.00 0.00 88 N 9.11 4.21 0.00 2.67 2.90 0.00 0.00 7.01 7.98 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 89 G 7.92 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 0.00 0.00 0.00 90 S 7.53 4.22 0.00 3.94 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 91 R 8.08 4.60 0.00 1.77 1.99 0.00 2.81 0.00 0.00 3.10 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.53 0.00 92 Y 8.84 4.39 0.00 2.95 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 93 P 0.00 3.24 0.00 1.79 1.09 0.00 3.62 0.00 0.00 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.62 0.00 94 N 8.04 4.33 0.00 2.78 2.87 0.00 0.00 6.96 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 95 C 8.55 4.79 0.00 3.13 3.19 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 96 A 8.45 5.16 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 97 Y 9.25 5.14 0.00 2.93 2.88 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 98 R 9.06 4.48 0.00 1.83 1.90 0.00 3.13 0.00 0.00 3.20 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.64 0.00 99 T 8.54 4.98 4.32 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 1.35 0.00 0.00 100 S 9.19 4.62 0.00 3.86 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 0.00 101 P 0.00 4.99 0.00 2.06 1.91 0.00 3.84 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.05 0.00 102 K 8.99 4.57 0.00 1.82 1.93 0.00 1.29 0.00 0.00 1.67 0.00 0.00 2.90 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.35 1.44 7.81 103 E 8.63 5.20 0.00 1.80 1.82 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 1.94 2.24 0.00 104 R 8.91 4.80 0.00 1.74 1.82 0.00 3.28 0.00 0.00 3.21 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.81 0.00 105 H 9.32 4.68 0.00 3.21 3.24 0.00 5.60 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 0.00 106 I 8.55 4.63 1.88 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 1.30 0.74 1.17 0.00 0.00 107 I 8.26 4.88 1.78 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.61 0.84 0.00 0.00 108 V 8.61 4.70 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 0.72 0.00 0.00 0.81 0.00 0.00 109 A 8.75 4.91 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 0.00 110 C 8.62 5.18 0.00 2.06 1.69 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 0.00 111 E 8.58 4.57 0.00 1.99 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 2.08 2.19 0.00 112 G 9.47 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 0.00 113 S 8.07 4.72 0.00 3.83 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 0.00 114 P 0.00 4.43 0.00 2.30 2.10 0.00 3.84 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.99 0.00 115 Y 8.41 4.79 0.00 2.94 2.97 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 V 8.08 4.43 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 0.70 0.00 0.00 0.90 0.00 0.00 117 P 0.00 4.29 0.00 0.56 0.93 0.00 3.27 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 1.80 1.75 0.00 118 V 8.60 4.55 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 0.61 0.00 0.00 0.86 0.00 0.00 119 H 7.71 4.94 0.00 3.25 3.09 0.00 5.85 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 0.00 120 F 8.95 4.49 0.00 2.70 2.64 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 0.00 121 D 8.26 4.51 0.00 2.63 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 0.00 122 A 6.68 4.62 1.15 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 0.00 123 S 8.67 5.18 0.00 4.02 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 0.00 124 V 8.70 4.52 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 0.66 0.00 0.00 0.93 0.00 0.00 125 E 8.98 3.98 0.00 1.95 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 2.31 2.32 0.00 126 D 7.84 4.57 0.00 2.81 2.65 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 0.00 127 S 8.35 4.11 0.00 3.99 3.94 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 0.00 128 T 8.51 3.52 4.21 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 0.00 0.00 0.00 1.20 0.00 0.00