NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.8219 8.3393 109.7280 45.2552 0.0000 172.8392 2 I 3.9402 7.9822 113.8923 59.4970 38.6826 173.4774 3 S 4.6311 8.6468 116.5612 56.2464 67.3629 175.0963 4 Y 4.1841 8.6645 120.4725 58.6697 37.6784 177.0922 5 S 4.3667 9.1061 119.8098 59.3022 63.7624 174.3430 6 V 4.4262 7.3842 120.2471 60.7671 33.9926 174.5831 7 E 4.1980 8.5944 125.0886 56.0408 30.1651 176.2170 8 A 4.5077 8.0713 124.3243 50.1761 22.1231 175.2160 9 D 4.5107 8.6302 122.8952 52.7872 41.2800 174.7621 10 P 4.2938 0.0000 0.0000 66.1303 31.0863 177.4728 11 D 4.6144 8.5776 118.1301 56.6479 41.1248 176.7550 12 T 5.3080 8.2269 108.4755 60.2904 70.3057 173.5900 13 T 5.0374 8.1557 116.1541 62.4758 72.7504 173.0498 14 A 4.7423 8.7756 126.0636 50.0697 22.3934 175.2458 15 K 5.2010 8.2159 118.0759 54.9971 36.5030 175.2000 16 A 4.6675 8.7623 120.2283 52.1287 22.9443 175.3152 17 M 5.7401 8.3985 117.3969 54.4273 36.5951 174.2126 18 L 4.8326 8.3530 119.6564 53.0221 45.5278 175.6380 19 R 4.8618 8.3513 120.5225 55.1415 33.1494 175.4914 20 E 3.7534 9.5917 122.9580 57.0792 28.0525 175.7308 21 R 4.0103 8.4983 118.3131 56.5341 31.4424 177.0925 22 Q 5.2593 8.9817 123.6538 54.9028 28.2714 174.6463 23 M 4.6663 8.1301 119.4457 53.7480 34.3030 174.5288 24 S 4.0159 8.6670 114.2490 58.8584 62.9297 174.9317 25 F 4.4027 8.8786 129.7862 61.2283 38.7334 177.2726 26 K 3.5965 7.7960 117.8707 59.4210 31.8026 178.8779 27 H 4.0118 8.1938 116.6624 58.5523 28.4945 178.1057 28 S 4.0924 7.6285 117.0764 61.3991 62.6812 176.5075 29 K 3.6584 7.5390 120.9623 59.3748 31.6595 179.0867 30 A 3.7713 7.2708 119.8444 55.2103 18.2284 179.5100 31 I 3.4520 7.6357 117.9439 64.8952 37.2110 177.8716 32 A 3.8583 8.0638 120.8106 55.5485 17.8681 179.4086 33 R 3.6839 8.0551 116.7217 59.5805 30.4613 178.2707 34 E 3.9300 8.1347 117.9529 58.5899 29.9681 177.9073 35 I 3.9282 7.9152 111.9165 60.3889 38.2992 175.8268 36 K 4.0618 7.0654 122.0691 57.8046 32.4832 177.0812 37 G 3.9836 8.6336 112.0728 45.8080 0.0000 174.1978 38 K 4.3570 7.5603 119.3670 56.1106 33.2932 175.5558 39 T 4.8014 9.4427 117.3088 62.3167 70.4876 175.9420 40 A 4.0661 8.8080 129.1186 55.5157 18.5239 180.3737 41 G 3.6054 8.2748 104.0612 47.8632 0.0000 175.7921 42 E 3.9801 8.0907 120.2025 59.1412 29.5589 178.9106 43 A 4.0625 8.5934 121.1289 55.2340 18.3427 179.7758 44 V 3.5596 7.9403 116.4540 66.3988 31.4560 177.6965 45 D 4.4083 7.8463 117.1593 58.0389 40.8595 177.9911 46 Y 4.1987 8.4357 119.9418 60.7874 38.8067 177.9250 47 L 3.7799 8.7689 120.1120 58.1308 41.8521 179.7260 48 E 4.0015 8.5592 118.3297 59.1347 29.3578 179.1404 49 A 4.0151 8.0111 121.0321 54.7078 18.3246 179.9744 50 V 4.1113 7.1662 117.7885 66.0003 31.5685 178.0672 51 I 3.6870 7.5139 118.0501 64.5288 36.9564 177.7051 52 E 4.1059 7.9344 119.4911 57.0129 29.4711 177.3772 53 G 3.4843 8.1537 106.1010 45.6968 0.0000 173.6125 54 D 4.7248 8.3100 120.5421 53.6523 42.7991 176.4649 55 Q 4.5994 8.0074 120.5123 53.3351 31.1263 171.7291 56 P 4.5279 0.0000 0.0000 61.4291 33.2800 175.3325 57 V 4.3167 8.4158 123.6869 60.8986 32.7416 173.3875 58 P 4.8357 0.0000 0.0000 62.9820 31.9028 176.0393 59 F 4.7432 9.1785 124.7418 56.3764 38.7216 175.5397 60 K 3.5561 8.4465 123.6756 56.8719 33.1041 177.7388 61 Q 4.2139 7.8673 117.5318 57.9005 30.3618 176.0718 62 H 4.7042 7.5841 115.6276 54.4243 27.3790 174.5706 63 N 5.1378 7.8267 115.1277 52.0421 38.4637 175.2792 64 S 4.3697 8.0916 114.6408 60.2947 63.0640 174.6541 65 G 3.9452 9.0118 114.0686 44.9842 0.0000 173.1740 66 V 3.8044 7.6190 120.3367 62.2463 31.8767 175.8332 67 G 3.8469 8.4339 114.2380 46.1383 0.0000 172.7003 68 H 4.8454 8.6958 119.9928 55.6739 30.0352 174.8987 69 K 4.6134 9.3525 121.4601 54.4962 34.4010 177.3608 70 S 4.1117 9.1173 120.3506 61.4576 62.8975 176.0843 71 K 4.1026 7.9632 118.5097 58.0928 32.0784 177.4383 72 V 3.7590 7.5386 119.5820 62.4783 31.9103 174.4296 73 D 4.8135 8.9392 126.2440 53.7692 42.8463 176.0049 74 G 4.0389 10.2223 115.3377 45.1053 0.0000 171.7380 75 W 5.2351 7.5412 127.1767 56.3283 34.3527 172.7537 76 D 4.4476 6.9594 115.2398 54.4471 40.5332 175.7271 77 A 4.7268 7.2294 122.2417 51.1445 20.0494 176.2429 78 G 4.1436 7.8836 106.6805 46.1216 0.0000 172.0433 79 R 4.0008 7.6085 117.6286 54.7775 34.8438 174.4447 80 Y 4.6888 7.7459 113.5516 56.2160 37.9144 175.4604 81 P 4.5714 0.0000 0.0000 62.6371 30.1581 177.2948 82 E 4.0140 8.5907 122.3131 59.3884 29.8874 178.3541 83 K 3.9228 8.2256 120.0255 58.9005 32.3139 177.9498 84 A 4.1593 8.1461 120.0450 55.7986 18.3465 179.5817 85 S 4.1453 8.1776 113.2224 61.8503 62.7750 177.1927 86 K 4.0594 8.3996 121.0908 59.4150 31.7984 179.3260 87 A 4.0446 8.1769 121.0921 55.0226 18.2276 179.6376 88 F 3.9436 8.4228 116.4207 60.2950 39.0489 177.8696 89 L 4.3210 8.1038 118.4559 57.1482 41.3872 179.1191 90 D 4.3567 7.7604 119.6011 56.9945 40.9028 178.3185 91 L 3.9054 7.7872 120.8134 58.2343 42.0061 179.0347 92 L 4.0560 8.4788 119.2364 57.4253 41.4856 178.9484 93 E 3.9602 8.1751 119.4982 58.7463 29.4970 178.4368 94 N 4.3240 8.1510 117.0000 56.3520 39.1659 176.5220 95 A 3.9595 8.0849 122.3670 55.5611 18.4922 179.9148 96 V 3.6602 8.1053 116.6041 65.7517 31.5505 178.5681 97 G 3.5834 7.7781 105.8770 47.9372 0.0000 175.4996 98 N 4.4072 8.7812 119.6431 55.6958 38.5157 177.2349 99 A 4.0073 8.1283 122.2861 55.5228 18.4115 179.5123 100 D 4.6748 8.1767 118.6036 57.1996 40.7631 177.9471 101 H 4.5105 8.1568 115.5004 57.4583 29.8785 175.8277 102 Q 4.5720 7.7595 117.0675 56.1470 29.6437 176.1812 103 G 3.7712 8.3694 109.5411 45.0255 0.0000 173.9177 104 F 4.5393 7.9922 119.0324 56.8335 40.2928 174.5424 105 D 4.9575 8.4857 121.2187 52.0537 39.7874 176.3727 106 G 4.0136 8.6076 112.8974 48.7110 0.0000 173.1450 107 E 3.8552 8.4039 119.1823 58.7876 29.6542 178.7737 108 A 4.3659 7.6144 118.2010 52.8562 18.8066 177.1223 109 M 4.4326 7.9864 117.3066 55.4047 33.8130 175.6103 110 T 4.7039 8.5654 118.5152 62.7220 70.8888 174.8886 111 I 4.3606 8.9827 127.3915 60.8198 35.8980 176.4211 112 K 4.0598 8.8565 128.9740 59.2194 33.0455 176.4536 113 H 5.1242 8.0387 118.4453 54.8019 33.5987 172.8065 114 V 5.3592 8.2695 122.9682 61.4872 34.1014 172.8425 115 A 4.7436 8.5574 125.2382 50.5503 22.6270 174.3863 116 A 5.3399 8.5795 122.4194 50.8584 21.7219 176.2197 117 H 4.9066 9.2211 117.1969 53.8269 33.1918 172.7200 118 K 3.9565 7.8071 125.1594 56.2707 31.8689 176.4859 119 V 3.9418 9.0473 128.0283 62.3830 32.5420 175.8668 120 G 3.9025 6.7369 105.9605 46.3577 0.0000 170.2258 121 E 5.0243 8.0094 117.4616 54.6010 33.7343 175.3812 122 Q 4.2759 9.0909 126.2185 55.2764 29.9621 175.0008 123 Q 4.7672 8.7657 126.4905 56.0622 29.7634 175.7714 124 G 4.9369 10.0297 109.3937 43.5496 0.0000 171.2073 125 R 5.1903 8.5055 119.2535 54.4106 33.3007 173.7596 126 K 4.2811 9.3341 128.1636 53.7193 34.1036 173.6485 127 P 4.6922 0.0000 0.0000 63.0187 32.1694 175.5539 128 R 4.7859 8.9092 121.0727 53.9932 34.1096 174.9155 129 A 4.1349 8.4011 121.9643 53.5168 18.9477 177.2586 130 M 2.9738 9.0728 116.1009 56.4303 29.0954 177.9173 131 G 3.8726 8.3748 103.9048 46.2302 0.0000 173.8173 132 R 4.7970 7.4592 117.8406 54.1981 33.1120 174.5444 133 A 5.3358 8.4148 123.3177 50.2541 22.6162 175.1009 134 S 4.8617 8.8778 113.1579 55.9804 67.2738 173.2064 135 A 4.5467 8.6426 121.9596 52.1851 18.9508 178.1292 136 W 5.1116 8.8405 129.7639 56.3228 31.0589 173.3385 137 N 5.2768 7.9770 120.0297 51.9891 41.0132 175.1199 138 S 4.7222 8.4402 115.9021 56.1112 65.9466 172.5731 139 P 4.7702 0.0000 0.0000 62.5967 32.9196 175.2068 140 Q 4.9722 8.9411 121.9470 54.2302 31.4656 174.7512 141 V 4.8679 9.2046 124.8438 61.1646 34.6384 174.0635 142 D 5.6122 8.7204 125.6690 52.8115 44.8443 175.4858 143 V 4.9317 8.1527 118.9093 60.7420 35.1374 172.6565 144 E 5.0351 8.9706 122.7641 54.7741 32.7207 174.6217 145 L 5.2515 8.6487 122.3250 53.8783 46.3958 174.6260 146 I 4.9615 9.3172 126.4733 59.6579 40.4771 174.5610 147 L 4.9788 8.9520 128.0348 53.8539 43.5758 175.6838 148 E 5.0488 8.8557 122.1281 54.2585 33.2368 174.3815 149 E 4.3294 8.6383 125.1758 55.4987 30.9272 175.6405 150 P 4.3941 0.0000 0.0000 63.2457 31.4324 176.1562 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 G 8.34 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 2 I 7.98 3.94 1.65 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.56 0.74 0.00 0.00 3 S 8.65 4.63 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 4 Y 8.66 4.18 0.00 2.94 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 5 S 9.11 4.37 0.00 4.02 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 6 V 7.38 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 0.81 0.00 0.00 0.58 0.00 0.00 7 E 8.59 4.20 0.00 1.99 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 2.31 2.30 0.00 8 A 8.07 4.51 1.09 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 0.00 0.00 0.00 0.00 0.00 0.00 9 D 8.63 4.51 0.00 2.69 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.29 0.00 2.23 2.19 0.00 3.81 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.01 0.00 11 D 8.58 4.61 0.00 2.90 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 12 T 8.23 5.31 4.31 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 1.37 0.00 0.00 13 T 8.16 5.04 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 14 A 8.78 4.74 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 K 8.22 5.20 0.00 1.46 1.61 0.00 1.26 0.00 0.00 0.61 0.00 0.00 2.21 0.00 0.00 2.58 0.00 0.00 0.00 0.00 0.89 1.12 7.81 16 A 8.76 4.67 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 17 M 8.40 5.74 0.00 1.73 1.86 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.21 0.00 18 L 8.35 4.83 0.00 1.41 1.42 0.66 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 19 R 8.35 4.86 0.00 1.61 1.76 0.00 3.46 0.00 0.00 3.15 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.52 0.00 20 E 9.59 3.75 0.00 1.95 1.94 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 2.23 2.22 0.00 21 R 8.50 4.01 0.00 1.78 1.86 0.00 3.27 0.00 0.00 3.15 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.72 0.00 22 Q 8.98 5.26 0.00 1.94 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.75 0.00 0.00 0.00 0.00 0.00 2.33 2.19 0.00 23 M 8.13 4.67 0.00 2.02 2.06 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.71 0.00 24 S 8.67 4.02 0.00 3.63 3.59 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 25 F 8.88 4.40 0.00 3.04 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 26 K 7.80 3.60 0.00 1.59 1.47 0.00 1.57 0.00 0.00 1.51 0.00 0.00 2.73 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.03 1.35 7.81 27 H 8.19 4.01 0.00 3.30 3.29 0.00 5.63 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 S 7.63 4.09 0.00 4.04 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 29 K 7.54 3.66 0.00 1.51 1.62 0.00 1.42 0.00 0.00 1.40 0.00 0.00 2.37 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.83 0.78 7.81 30 A 7.27 3.77 1.07 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 31 I 7.64 3.45 1.20 0.00 0.00 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 1.28 0.66 -0.06 0.00 0.00 32 A 8.06 3.86 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 33 R 8.06 3.68 0.00 1.84 2.09 0.00 3.10 0.00 0.00 2.97 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.57 0.00 34 E 8.13 3.93 0.00 1.98 2.06 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 0.00 2.37 1.82 0.00 35 I 7.92 3.93 1.86 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.51 0.94 0.00 0.00 36 K 7.07 4.06 0.00 1.74 1.71 0.00 1.85 0.00 0.00 1.68 0.00 0.00 3.02 0.00 0.00 3.32 0.00 0.00 0.00 0.00 1.43 1.39 7.81 37 G 8.63 3.98 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 0.00 0.00 0.00 0.00 0.00 0.00 38 K 7.56 4.36 0.00 2.04 1.73 0.00 1.41 0.00 0.00 1.52 0.00 0.00 2.72 0.00 0.00 2.55 0.00 0.00 0.00 0.00 1.36 1.33 7.81 39 T 9.44 4.80 4.50 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 1.35 0.00 0.00 40 A 8.81 4.07 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 41 G 8.27 3.61 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 0.00 42 E 8.09 3.98 0.00 2.17 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 2.41 2.39 0.00 43 A 8.59 4.06 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 44 V 7.94 3.56 2.25 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 1.14 0.00 0.00 1.02 0.00 0.00 45 D 7.85 4.41 0.00 2.93 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 46 Y 8.44 4.20 0.00 3.11 3.17 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 47 L 8.77 3.78 0.00 1.75 1.75 1.05 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 48 E 8.56 4.00 0.00 2.14 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 2.34 2.65 0.00 49 A 8.01 4.02 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 50 V 7.17 4.11 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 1.32 0.00 0.00 0.30 0.00 0.00 51 I 7.51 3.69 2.01 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.89 0.91 0.00 0.00 52 E 7.93 4.11 0.00 2.07 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 2.38 2.33 0.00 53 G 8.15 3.48 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 0.00 0.00 0.00 54 D 8.31 4.72 0.00 2.62 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 55 Q 8.01 4.60 0.00 2.03 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.97 0.00 0.00 0.00 0.00 0.00 2.40 2.50 0.00 56 P 0.00 4.53 0.00 1.81 1.61 0.00 3.86 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 1.91 1.93 0.00 57 V 8.42 4.32 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 1.40 0.00 0.00 0.93 0.00 0.00 58 P 0.00 4.84 0.00 1.94 2.04 0.00 3.76 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.18 0.00 59 F 9.18 4.74 0.00 2.84 3.06 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 0.00 0.00 0.00 0.00 60 K 8.45 3.56 0.00 1.24 0.80 0.00 1.33 0.00 0.00 1.18 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.30 0.92 7.81 61 Q 7.87 4.21 0.00 1.77 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 7.43 0.00 0.00 0.00 0.00 0.00 1.74 2.16 0.00 62 H 7.58 4.70 0.00 3.01 3.19 0.00 5.70 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 N 7.83 5.14 0.00 3.07 3.51 0.00 0.00 5.85 7.64 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 64 S 8.09 4.37 0.00 4.04 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 65 G 9.01 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 66 V 7.62 3.80 2.25 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 0.65 0.00 0.00 1.08 0.00 0.00 67 G 8.43 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 68 H 8.70 4.85 0.00 2.98 3.15 0.00 5.66 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 K 9.35 4.61 0.00 1.54 1.64 0.00 1.70 0.00 0.00 1.70 0.00 0.00 2.79 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.37 1.23 7.81 70 S 9.12 4.11 0.00 3.98 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 71 K 7.96 4.10 0.00 1.81 1.96 0.00 1.88 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.48 1.47 7.81 72 V 7.54 3.76 2.24 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 0.92 0.00 0.00 0.96 0.00 0.00 73 D 8.94 4.81 0.00 2.64 2.54 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 74 G 10.22 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 75 W 7.54 5.24 0.00 3.26 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 76 D 6.96 4.45 0.00 2.03 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 0.00 0.00 0.00 0.00 77 A 7.23 4.73 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.88 4.14 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 0.00 0.00 0.00 79 R 7.61 4.00 0.00 0.67 1.41 0.00 2.80 0.00 0.00 3.09 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.09 0.00 80 Y 7.75 4.69 0.00 2.85 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 81 P 0.00 4.57 0.00 2.19 1.93 0.00 3.60 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.28 0.00 82 E 8.59 4.01 0.00 2.22 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 0.00 2.39 2.41 0.00 83 K 8.23 3.92 0.00 1.90 1.86 0.00 1.79 0.00 0.00 1.87 0.00 0.00 3.14 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.57 1.56 7.81 84 A 8.15 4.16 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.18 4.15 0.00 4.12 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 86 K 8.40 4.06 0.00 2.00 1.90 0.00 1.70 0.00 0.00 1.68 0.00 0.00 2.98 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.49 1.84 7.81 87 A 8.18 4.04 1.39 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 0.00 0.00 88 F 8.42 3.94 0.00 3.36 3.20 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 89 L 8.10 4.32 0.00 1.95 1.77 0.96 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 90 D 7.76 4.36 0.00 2.95 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 91 L 7.79 3.91 0.00 1.55 1.73 0.85 0.23 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 92 L 8.48 4.06 0.00 1.79 1.74 1.04 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 93 E 8.18 3.96 0.00 2.19 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 0.00 2.32 2.33 0.00 94 N 8.15 4.32 0.00 2.98 2.95 0.00 0.00 6.95 7.76 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 95 A 8.08 3.96 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 96 V 8.11 3.66 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 1.06 0.00 0.00 0.96 0.00 0.00 97 G 7.78 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.78 4.41 0.00 2.89 2.92 0.00 0.00 6.96 7.45 0.00 0.00 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 A 8.13 4.01 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 0.00 100 D 8.18 4.67 0.00 2.91 2.78 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 0.00 101 H 8.16 4.51 0.00 3.17 3.51 0.00 5.90 0.00 0.00 0.00 0.00 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 Q 7.76 4.57 0.00 2.68 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 5.18 0.00 0.00 0.00 0.00 0.00 2.38 2.56 0.00 103 G 8.37 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 0.00 104 F 7.99 4.54 0.00 3.25 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 0.00 105 D 8.49 4.96 0.00 2.80 2.62 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 0.00 106 G 8.61 4.01 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 0.00 0.00 0.00 107 E 8.40 3.86 0.00 2.06 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 0.00 2.43 2.36 0.00 108 A 7.61 4.37 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 0.00 109 M 7.99 4.43 0.00 1.92 2.14 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.45 0.00 110 T 8.57 4.70 4.23 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 1.25 0.00 0.00 111 I 8.98 4.36 1.87 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 1.13 1.11 0.93 0.00 0.00 112 K 8.86 4.06 0.00 1.78 2.01 0.00 1.92 0.00 0.00 1.63 0.00 0.00 2.85 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.48 1.39 7.81 113 H 8.04 5.12 0.00 3.20 3.11 0.00 5.75 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 V 8.27 5.36 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 0.80 0.00 0.00 1.15 0.00 0.00 115 A 8.56 4.74 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 0.00 116 A 8.58 5.34 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 0.00 117 H 9.22 4.91 0.00 3.05 3.13 0.00 5.81 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 K 7.81 3.96 0.00 0.79 1.03 0.00 1.42 0.00 0.00 1.37 0.00 0.00 2.57 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.11 1.04 7.81 119 V 9.05 3.94 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 0.73 0.00 0.00 0.95 0.00 0.00 120 G 6.74 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 0.00 0.00 0.00 121 E 8.01 5.02 0.00 1.77 1.77 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 2.14 2.23 0.00 122 Q 9.09 4.28 0.00 2.11 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 7.00 0.00 0.00 0.00 0.00 0.00 2.35 2.34 0.00 123 Q 8.77 4.77 0.00 1.99 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.58 0.00 0.00 0.00 0.00 0.00 2.37 2.50 0.00 124 G 10.03 4.94 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 0.00 0.00 0.00 125 R 8.51 5.19 0.00 1.78 1.77 0.00 3.30 0.00 0.00 3.18 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.69 0.00 126 K 9.33 4.28 0.00 1.00 1.58 0.00 1.07 0.00 0.00 1.10 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.61 1.11 7.81 127 P 0.00 4.69 0.00 1.89 1.91 0.00 3.48 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.05 0.00 128 R 8.91 4.79 0.00 1.76 1.82 0.00 3.32 0.00 0.00 3.18 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.71 0.00 129 A 8.40 4.13 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 0.00 130 M 9.07 2.97 0.00 2.19 2.20 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 2.49 2.46 0.00 131 G 8.37 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 0.00 0.00 0.00 132 R 7.46 4.80 0.00 1.93 1.92 0.00 3.05 0.00 0.00 3.18 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.55 0.00 133 A 8.41 5.34 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 0.00 134 S 8.88 4.86 0.00 3.94 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 0.00 135 A 8.64 4.55 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 0.00 136 W 8.84 5.11 0.00 3.46 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 0.00 137 N 7.98 5.28 0.00 2.60 2.81 0.00 0.00 7.03 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 0.00 138 S 8.44 4.72 0.00 3.74 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 0.00 139 P 0.00 4.77 0.00 2.27 1.94 0.00 3.50 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.07 0.00 140 Q 8.94 4.97 0.00 1.93 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.75 0.00 0.00 0.00 0.00 0.00 2.23 2.22 0.00 141 V 9.20 4.87 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 1.14 0.00 0.00 1.13 0.00 0.00 142 D 8.72 5.61 0.00 2.77 2.43 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 0.00 143 V 8.15 4.93 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 0.40 0.00 0.00 0.77 0.00 0.00 144 E 8.97 5.04 0.00 2.04 1.75 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 2.18 2.25 0.00 145 L 8.65 5.25 0.00 1.79 1.52 1.06 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 146 I 9.32 4.96 1.95 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.05 0.88 0.00 0.00 147 L 8.95 4.98 0.00 1.39 1.44 0.90 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 148 E 8.86 5.05 0.00 1.94 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 0.00 2.18 2.41 0.00 149 E 8.64 4.33 0.00 2.06 1.93 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 2.58 2.45 0.00 150 P 0.00 4.39 0.00 2.05 2.01 0.00 3.75 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.20 0.00