NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 K 4.2396 8.3149 119.9973 56.6875 34.5520 175.9963 3 L 4.1441 7.7420 120.9399 51.6980 41.9658 176.4229 4 S 4.4167 9.5935 120.2613 58.0623 66.0650 174.8215 5 Q 3.9851 8.5386 123.0708 59.1563 28.9546 177.5482 6 D 4.3758 8.1966 118.8114 57.5479 41.1981 178.2214 7 E 4.0445 8.0977 118.6549 59.6382 29.5566 179.3838 8 I 3.8983 8.0040 119.7997 64.3974 37.1005 178.3659 9 D 4.2855 8.2973 119.7886 57.4241 40.7229 178.2394 10 D 4.3912 7.9465 119.0929 57.5091 40.7987 178.7362 11 L 3.8624 7.9968 120.4995 58.0969 41.9914 179.1801 12 K 3.7932 7.9872 118.3330 59.3875 32.0862 178.8738 13 E 3.9059 8.2414 119.5410 59.3653 29.5391 179.0776 14 V 3.7821 8.0329 118.2710 65.6949 31.5313 177.7018 15 F 3.8839 8.5807 120.9139 61.3602 38.9468 177.0343 16 E 3.9114 8.5754 118.2309 59.1561 29.2539 178.7030 17 L 3.8322 7.8214 120.1180 58.6427 41.9931 179.3373 18 F 4.1983 8.6071 117.3294 60.1987 38.9301 176.6184 19 D 4.5242 8.7827 117.2475 55.4338 40.9646 176.8868 20 F 4.4831 7.7647 118.8126 60.2903 40.4319 177.2907 21 W 4.6886 8.3635 117.5505 59.0778 28.9800 176.3931 22 D 4.7791 7.9345 116.7434 52.6703 39.0488 175.5660 23 G 3.4889 7.9409 110.7408 46.2546 0.0000 173.7064 24 R 4.2291 8.1504 125.6209 56.2054 29.8715 176.4656 25 D 4.5683 8.8806 122.6222 54.0259 40.1946 175.5030 26 G 4.0376 9.2054 106.3755 46.6012 0.0000 173.5086 27 A 5.0999 8.1635 120.1641 50.2950 22.6144 176.5167 28 V 4.5835 8.7183 120.4404 60.5656 34.5198 174.5847 29 D 4.9939 8.9681 126.8644 54.8785 41.4513 176.8171 30 A 4.2140 9.5627 127.6704 54.3037 18.8149 179.1431 31 F 4.3598 8.9766 117.0232 60.0022 39.7289 176.3463 32 K 4.3770 8.2612 118.8207 56.3497 32.5900 178.0724 33 I 3.8301 7.6718 121.4182 64.5787 37.0765 177.7423 34 G 3.5045 7.8807 105.7486 47.9088 0.0000 175.2003 35 D 4.3523 7.7567 120.7894 56.8855 40.6207 178.8295 36 V 2.8210 7.5460 118.9208 66.1398 31.4897 178.0317 37 C 4.3706 8.0755 116.3075 62.6347 27.9073 176.3163 38 R 4.5383 8.3256 121.6878 59.1155 29.4973 178.8673 39 C 4.3054 7.9476 114.8480 62.2636 28.1741 175.3041 40 L 4.4270 7.2306 117.3605 54.6672 41.6085 177.3770 41 G 4.1652 7.9616 107.5020 45.0587 0.0000 173.5005 42 I 4.5310 7.7796 112.9339 59.2292 40.0762 174.6493 43 N 5.1196 8.1975 117.7219 50.9362 38.4734 172.4170 44 P 4.4525 0.0000 0.0000 61.9615 33.1194 178.3026 45 R 4.0771 8.5546 120.1974 56.0923 31.9201 177.8400 46 N 3.9163 9.2565 119.7554 56.4471 38.4904 177.5495 47 E 4.1249 8.4130 120.6911 59.2691 29.6182 178.4145 48 D 4.3581 7.9426 118.4473 57.6756 40.8554 179.2552 49 V 3.5159 7.4692 112.5508 64.3208 31.4819 178.5475 50 F 4.6753 8.1115 118.9068 60.1098 38.5171 177.6134 51 A 4.1365 7.9807 119.3876 54.6157 18.2157 179.0545 52 V 4.0980 7.0812 108.7035 61.0870 31.9107 176.6888 53 G 4.1371 7.8677 107.0105 45.0455 0.0000 174.8224 54 G 3.6852 8.6853 110.5362 45.4140 0.0000 173.9369 55 T 4.5047 8.3887 113.0811 60.6928 70.8629 174.0627 56 H 5.0885 8.6410 116.6175 55.9090 29.4295 175.0887 57 K 3.8620 7.4727 118.7412 54.7068 34.8511 175.0213 58 M 4.1387 7.3199 123.6122 56.7216 32.3234 177.2092 59 G 4.0077 9.6984 110.9252 45.5106 0.0000 174.6213 60 E 4.1641 7.9610 118.5564 58.9234 30.1911 176.5859 61 K 4.6870 7.4965 117.0330 55.4455 35.6767 174.4366 62 S 5.2409 8.6461 118.4616 56.5659 66.0721 172.7615 63 L 5.0065 9.0944 125.1643 52.4265 44.5847 174.9806 64 P 5.2557 0.0000 0.0000 61.3436 32.5460 176.9237 65 F 3.2720 8.9740 122.1658 61.5262 38.7663 177.3225 66 E 3.8574 8.1244 114.8574 58.9094 28.4267 178.1862 67 E 4.1373 8.1445 118.9511 58.3646 29.7140 178.3869 68 F 4.0592 7.7129 121.2294 60.5190 39.4895 176.7542 69 L 3.8534 7.6236 120.3914 58.1677 41.7703 177.5641 70 P 4.2175 0.0000 0.0000 64.9180 31.2789 178.5998 71 A 3.8323 7.2860 118.0628 55.1901 18.3160 178.8558 72 Y 4.1706 7.9492 117.9822 61.1514 38.6693 178.2322 73 E 3.8268 8.2180 118.2260 59.3228 29.5718 179.3475 74 G 3.6651 7.8433 104.9633 47.6845 0.0000 175.4107 75 L 4.1449 7.8755 120.9753 57.0620 41.5229 178.8055 76 M 3.8557 7.5928 118.2792 57.6389 32.1403 176.3490 77 D 4.8986 7.7215 116.3509 52.6350 39.9011 175.8315 78 C 4.0618 8.2063 114.5852 58.8040 29.8715 173.1577 79 E 4.0743 8.5569 122.1877 56.2192 29.8819 175.9813 80 Q 4.6857 8.3712 124.4205 53.5510 31.5801 175.8386 81 G 3.8375 8.9994 111.0650 45.2857 0.0000 173.3209 82 T 4.4030 7.6471 112.0192 59.4666 72.3468 175.2587 83 Y 4.1471 8.4246 121.4050 60.9260 38.6874 178.0237 84 A 3.9389 8.0732 120.9857 55.3945 18.5782 179.0535 85 D 4.2383 7.8790 117.2838 57.7519 40.9487 178.8627 86 Y 4.4888 7.5525 117.1021 61.4365 37.9394 178.2878 87 M 4.2051 8.1919 119.9200 58.4309 31.8333 178.3119 88 E 3.9381 8.1783 118.1776 59.2299 29.8722 178.5965 89 A 4.0791 7.8953 120.6292 55.3098 18.4961 179.7570 90 F 4.0631 8.2697 116.3388 60.2470 38.9027 177.8341 91 K 3.9865 8.2023 119.6838 59.4248 31.7137 178.6187 92 T 3.8899 7.5474 108.9639 63.4494 68.6880 175.3159 93 F 4.8118 7.8690 118.7821 56.1903 39.9942 174.8048 94 D 4.7797 7.4787 119.1023 53.3365 41.1113 176.2615 95 R 4.1742 8.8587 127.0686 58.4096 30.2016 177.3132 96 E 4.6073 8.2605 112.9802 54.9648 30.1210 176.2593 97 G 4.5655 8.4390 105.5342 47.2414 0.0000 174.5876 98 Q 4.2526 7.9479 116.7626 55.7748 29.2249 177.0282 99 G 3.4540 9.3616 107.8823 45.6797 0.0000 172.6306 100 F 5.2513 7.8725 116.8529 55.6866 41.3734 174.9694 101 I 5.0230 8.8228 121.4082 59.0464 41.8660 174.6870 102 S 4.6869 8.9227 122.5171 58.0930 63.8820 175.5683 103 G 3.7177 9.3460 110.1681 47.2884 0.0000 176.0079 104 A 4.0807 7.8963 122.4516 54.9544 18.5433 179.3639 105 E 3.9143 8.5642 117.5989 59.2759 29.5052 179.2409 106 L 3.9235 8.1417 120.6407 58.3799 42.1901 179.3825 107 R 3.9218 8.0359 117.9112 59.2029 29.8876 178.4573 108 H 4.1229 8.4101 118.5086 59.5291 29.7830 177.8224 109 V 3.3145 7.7731 114.2897 64.2039 31.1766 178.6708 110 L 4.0117 8.0789 119.1174 56.6924 41.3132 178.5573 111 S 4.9402 8.1578 111.0297 57.9111 64.3224 174.7181 112 G 3.9850 8.2159 110.3836 45.3420 0.0000 172.7884 113 L 4.8048 6.9564 118.1985 52.9745 46.6053 178.3520 114 G 3.6337 8.3510 107.8078 47.3791 0.0000 176.7909 115 E 4.3199 8.5601 115.7946 54.1120 28.0470 174.7116 116 R 4.0324 8.0211 118.5832 56.7506 30.8242 176.0438 117 L 4.6942 8.6412 123.8953 53.6769 43.3021 176.9039 118 S 4.3709 9.4740 116.5905 58.2275 64.1776 175.1237 119 D 4.3935 8.7928 120.4456 57.4274 40.4051 178.9419 120 E 3.9498 8.1076 118.6659 59.5895 29.6170 179.0516 121 E 3.9564 8.2789 118.5382 59.3568 29.4564 179.7391 122 V 3.6463 7.9027 118.3155 66.0254 31.5982 177.7549 123 D 4.3560 8.5289 119.1319 57.4531 40.6402 178.5649 124 E 3.9531 8.4913 120.0256 59.2417 29.6340 178.6928 125 I 3.7920 7.9336 118.7824 64.0239 38.0305 177.9816 126 I 3.7712 7.8982 120.9180 64.1693 36.9123 177.8123 127 N 4.2464 8.5536 118.2755 56.9046 38.6529 176.9661 128 L 4.0447 8.3649 119.4417 57.6458 41.8205 178.8214 129 T 4.1650 8.0703 106.9671 61.0053 70.0905 173.7433 130 D 4.2485 7.8250 120.7713 55.1486 40.1045 173.4010 131 L 4.4244 7.9276 120.2275 53.9630 43.1343 175.3484 132 Q 4.6774 8.4590 123.6872 54.1114 31.4251 174.6658 133 E 4.6779 8.3425 117.7886 54.9718 31.7038 175.9756 134 D 4.8122 8.4427 120.0291 52.3699 41.4457 176.9185 135 L 3.9520 8.3680 117.7574 57.7622 41.6260 177.8573 136 E 4.3188 8.3111 116.1592 55.7301 29.5890 176.0363 137 G 3.9536 8.3475 107.7302 46.6621 0.0000 173.1467 138 N 5.4629 8.6390 116.2938 51.3267 41.6639 174.6570 139 V 4.7667 9.1440 114.1505 59.5488 35.9045 175.3960 140 K 4.7194 8.6669 122.5051 54.5770 31.7939 177.2504 141 Y 4.0276 8.1328 125.7311 59.6414 37.8025 177.6631 142 E 4.0167 7.5038 120.8839 59.2850 29.6742 178.4482 143 E 3.9593 8.0276 117.8789 59.4331 29.6474 178.9323 144 F 4.2454 7.8332 119.3689 61.3293 39.4603 177.2569 145 V 3.4134 8.2617 118.1944 65.9546 31.3638 178.1008 146 K 4.0613 8.3006 118.1914 59.5330 32.0061 179.5609 147 K 3.9733 8.1962 118.7931 59.1943 31.7106 179.6924 148 V 3.3858 7.3053 117.5835 66.2639 31.5350 177.6248 149 M 4.2418 7.8046 117.2244 58.6655 31.9214 178.5760 150 T 4.1151 7.9405 108.4427 62.0219 69.3634 175.6102 151 G 3.9654 7.5441 106.8472 44.0693 0.0000 171.7027 152 P 4.0994 0.0000 0.0000 65.2899 31.4525 176.0948 153 Y 4.3865 7.4443 120.9976 57.6163 37.2137 173.6291 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 K 8.31 4.24 0.00 1.86 1.99 0.00 1.50 0.00 0.00 1.64 0.00 0.00 2.90 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.29 1.46 7.81 3 L 7.74 4.14 0.00 1.76 1.73 0.88 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 4 S 9.59 4.42 0.00 4.02 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 5 Q 8.54 3.99 0.00 2.20 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.89 0.00 0.00 0.00 0.00 0.00 2.44 2.49 0.00 6 D 8.20 4.38 0.00 2.84 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 7 E 8.10 4.04 0.00 2.37 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 2.41 2.40 0.00 8 I 8.00 3.90 1.94 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.05 1.04 0.00 0.00 9 D 8.30 4.29 0.00 2.92 2.70 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 10 D 7.95 4.39 0.00 2.94 2.75 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 11 L 8.00 3.86 0.00 1.59 1.93 0.60 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 12 K 7.99 3.79 0.00 1.96 1.64 0.00 1.09 0.00 0.00 1.23 0.00 0.00 2.56 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.78 1.32 7.81 13 E 8.24 3.91 0.00 2.04 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 2.31 2.30 0.00 14 V 8.03 3.78 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 1.11 0.00 0.00 1.00 0.00 0.00 15 F 8.58 3.88 0.00 3.03 3.22 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 0.00 0.00 0.00 16 E 8.58 3.91 0.00 2.27 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 2.42 2.56 0.00 17 L 7.82 3.83 0.00 1.77 1.98 0.72 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 18 F 8.61 4.20 0.00 3.12 3.05 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 19 D 8.78 4.52 0.00 1.99 2.63 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 0.00 0.00 0.00 20 F 7.76 4.48 0.00 3.05 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 21 W 8.36 4.69 0.00 3.34 3.10 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 22 D 7.93 4.78 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 23 G 7.94 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.15 4.23 0.00 1.70 1.85 0.00 3.15 0.00 0.00 4.01 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.65 0.00 25 D 8.88 4.57 0.00 2.78 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 26 G 9.21 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 27 A 8.16 5.10 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 28 V 8.72 4.58 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 0.95 0.00 0.00 -0.05 0.00 0.00 29 D 8.97 4.99 0.00 2.88 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 30 A 9.56 4.21 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.98 4.36 0.00 3.17 3.26 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 32 K 8.26 4.38 0.00 2.03 1.89 0.00 1.96 0.00 0.00 1.76 0.00 0.00 3.17 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.61 1.85 7.81 33 I 7.67 3.83 1.82 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 1.27 0.55 0.67 0.00 0.00 34 G 7.88 3.50 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 0.00 35 D 7.76 4.35 0.00 2.77 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 36 V 7.55 2.82 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 0.84 0.00 0.00 0.11 0.00 0.00 37 C 8.08 4.37 0.00 3.21 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 38 R 8.33 4.54 0.00 1.98 2.00 0.00 3.16 0.00 0.00 3.24 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.59 0.00 39 C 7.95 4.31 0.00 3.20 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 40 L 7.23 4.43 0.00 1.90 1.80 0.38 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 41 G 7.96 4.17 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 0.00 42 I 7.78 4.53 1.89 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 1.62 0.73 0.97 0.00 0.00 43 N 8.20 5.12 0.00 2.71 2.78 0.00 0.00 6.98 8.02 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 44 P 0.00 4.45 0.00 2.10 2.01 0.00 3.82 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.96 0.00 45 R 8.55 4.08 0.00 2.01 2.14 0.00 3.16 0.00 0.00 3.17 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 46 N 9.26 3.92 0.00 2.86 2.47 0.00 0.00 6.80 7.42 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 47 E 8.41 4.12 0.00 2.26 1.97 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 2.37 2.46 0.00 48 D 7.94 4.36 0.00 2.85 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 49 V 7.47 3.52 1.88 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 0.67 0.00 0.00 0.44 0.00 0.00 50 F 8.11 4.68 0.00 3.21 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 51 A 7.98 4.14 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 52 V 7.08 4.10 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 0.71 0.00 0.00 0.91 0.00 0.00 53 G 7.87 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 54 G 8.69 3.69 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 0.00 0.00 0.00 55 T 8.39 4.50 4.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 56 H 8.64 5.09 0.00 3.15 3.46 0.00 5.92 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 K 7.47 3.86 0.00 1.57 1.71 0.00 1.70 0.00 0.00 1.64 0.00 0.00 3.19 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.15 1.24 7.81 58 M 7.32 4.14 0.00 1.98 1.80 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.23 0.00 59 G 9.70 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 60 E 7.96 4.16 0.00 2.01 2.04 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 2.31 2.27 0.00 61 K 7.50 4.69 0.00 1.84 1.65 0.00 1.71 0.00 0.00 1.79 0.00 0.00 2.79 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.47 1.47 7.81 62 S 8.65 5.24 0.00 3.93 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 63 L 9.09 5.01 0.00 1.97 1.76 0.84 1.18 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 64 P 0.00 5.26 0.00 2.46 2.08 0.00 4.01 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 2.29 2.13 0.00 65 F 8.97 3.27 0.00 2.14 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 66 E 8.12 3.86 0.00 2.17 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 2.30 2.38 0.00 67 E 8.14 4.14 0.00 2.26 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 2.41 2.40 0.00 68 F 7.71 4.06 0.00 3.37 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 69 L 7.62 3.85 0.00 1.15 1.44 0.98 1.28 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 70 P 0.00 4.22 0.00 2.15 2.04 0.00 3.71 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.10 0.00 71 A 7.29 3.83 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 Y 7.95 4.17 0.00 3.14 3.22 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 0.00 0.00 0.00 73 E 8.22 3.83 0.00 1.91 1.92 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 2.29 2.58 0.00 74 G 7.84 3.67 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 0.00 0.00 0.00 75 L 7.88 4.14 0.00 1.82 1.68 0.88 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 76 M 7.59 3.86 0.00 1.84 1.71 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.33 0.00 77 D 7.72 4.90 0.00 2.73 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 78 C 8.21 4.06 0.00 3.21 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 79 E 8.56 4.07 0.00 1.93 1.88 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 2.27 2.31 0.00 80 Q 8.37 4.69 0.00 2.03 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.75 0.00 0.00 0.00 0.00 0.00 2.26 2.31 0.00 81 G 9.00 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 0.00 0.00 0.00 82 T 7.65 4.40 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 1.13 0.00 0.00 83 Y 8.42 4.15 0.00 3.13 3.04 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 84 A 8.07 3.94 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 85 D 7.88 4.24 0.00 2.45 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 86 Y 7.55 4.49 0.00 3.12 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 87 M 8.19 4.21 0.00 2.02 1.98 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.86 0.00 88 E 8.18 3.94 0.00 1.95 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 2.30 2.32 0.00 89 A 7.90 4.08 1.31 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 0.00 0.00 90 F 8.27 4.06 0.00 2.66 1.83 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 91 K 8.20 3.99 0.00 2.12 1.96 0.00 1.71 0.00 0.00 1.73 0.00 0.00 3.04 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.49 1.57 7.81 92 T 7.55 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 1.11 0.00 0.00 93 F 7.87 4.81 0.00 3.17 3.14 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 94 D 7.48 4.78 0.00 2.84 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 95 R 8.86 4.17 0.00 1.91 2.02 0.00 3.24 0.00 0.00 3.33 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.69 0.00 96 E 8.26 4.61 0.00 2.12 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 2.28 2.54 0.00 97 G 8.44 4.57 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 98 Q 7.95 4.25 0.00 2.18 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.74 0.00 0.00 0.00 0.00 0.00 2.45 2.41 0.00 99 G 9.36 3.45 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 0.00 0.00 0.00 0.00 100 F 7.87 5.25 0.00 2.98 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 0.00 101 I 8.82 5.02 2.11 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 1.37 1.63 1.01 0.00 0.00 102 S 8.92 4.69 0.00 3.92 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 0.00 103 G 9.35 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 0.00 104 A 7.90 4.08 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 0.00 105 E 8.56 3.91 0.00 2.18 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 2.39 2.36 0.00 106 L 8.14 3.92 0.00 1.66 1.75 0.92 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 107 R 8.04 3.92 0.00 2.01 1.94 0.00 3.16 0.00 0.00 3.07 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.83 0.00 108 H 8.41 4.12 0.00 3.19 3.40 0.00 5.78 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 V 7.77 3.31 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.10 0.00 0.00 0.74 0.00 0.00 110 L 8.08 4.01 0.00 1.71 1.73 1.04 0.82 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 0.00 111 S 8.16 4.94 0.00 4.09 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 0.00 112 G 8.22 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 0.00 113 L 6.96 4.80 0.00 1.79 1.51 0.91 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 114 G 8.35 3.63 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 0.00 0.00 0.00 0.00 0.00 0.00 115 E 8.56 4.32 0.00 1.97 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 2.33 2.34 0.00 116 R 8.02 4.03 0.00 1.70 2.06 0.00 3.21 0.00 0.00 3.24 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.88 0.00 117 L 8.64 4.69 0.00 1.62 1.60 0.94 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 118 S 9.47 4.37 0.00 4.04 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 0.00 119 D 8.79 4.39 0.00 2.71 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 0.00 120 E 8.11 3.95 0.00 2.06 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 2.40 2.47 0.00 121 E 8.28 3.96 0.00 2.19 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 2.34 2.33 0.00 122 V 7.90 3.65 2.08 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 1.02 0.00 0.00 1.02 0.00 0.00 123 D 8.53 4.36 0.00 2.83 2.70 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 0.00 124 E 8.49 3.95 0.00 2.09 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 2.30 2.31 0.00 125 I 7.93 3.79 1.92 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.21 1.19 0.00 0.00 126 I 7.90 3.77 2.07 0.00 0.00 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 1.11 0.35 0.90 0.00 0.00 127 N 8.55 4.25 0.00 2.77 3.02 0.00 0.00 7.25 6.24 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 0.00 128 L 8.36 4.04 0.00 1.64 1.69 0.89 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 129 T 8.07 4.17 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 1.26 0.00 0.00 130 D 7.82 4.25 0.00 2.78 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 0.00 131 L 7.93 4.42 0.00 1.74 1.49 0.94 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 132 Q 8.46 4.68 0.00 2.14 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.66 0.00 0.00 0.00 0.00 0.00 2.21 2.30 0.00 133 E 8.34 4.68 0.00 2.20 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 0.00 2.28 2.27 0.00 134 D 8.44 4.81 0.00 2.91 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 0.00 135 L 8.37 3.95 0.00 1.61 1.75 0.91 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 136 E 8.31 4.32 0.00 1.87 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 2.21 2.24 0.00 137 G 8.35 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 0.00 138 N 8.64 5.46 0.00 2.89 2.87 0.00 0.00 6.83 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 V 9.14 4.77 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 0.74 0.00 0.00 0.95 0.00 0.00 140 K 8.67 4.72 0.00 1.52 1.45 0.00 1.01 0.00 0.00 0.61 0.00 0.00 2.60 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.28 1.02 7.81 141 Y 8.13 4.03 0.00 2.42 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 0.00 142 E 7.50 4.02 0.00 1.89 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 2.42 2.62 0.00 143 E 8.03 3.96 0.00 2.17 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 2.37 2.29 0.00 144 F 7.83 4.25 0.00 3.02 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 0.00 145 V 8.26 3.41 2.35 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 1.24 0.00 0.00 1.09 0.00 0.00 146 K 8.30 4.06 0.00 2.03 1.84 0.00 1.72 0.00 0.00 1.59 0.00 0.00 2.75 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.39 1.87 7.81 147 K 8.20 3.97 0.00 1.76 1.82 0.00 1.84 0.00 0.00 1.74 0.00 0.00 2.91 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.53 7.81 148 V 7.31 3.39 1.74 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 0.62 0.00 0.00 0.24 0.00 0.00 149 M 7.80 4.24 0.00 2.13 2.27 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.93 2.79 0.00 150 T 7.94 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 1.25 0.00 0.00 151 G 7.54 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 0.00 152 P 0.00 4.10 0.00 1.19 1.87 0.00 3.73 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 1.65 1.76 0.00 153 Y 7.44 4.39 0.00 2.93 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