NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 T 4.4606 8.1749 117.3152 63.5005 70.1340 172.9196 3 R 4.3471 8.9823 126.6633 53.9527 32.7282 173.5371 4 R 4.8042 8.7086 124.0346 55.5923 32.7631 175.9895 5 V 4.8734 9.1084 122.2482 61.1270 34.6279 174.1599 6 A 4.8743 9.0864 131.2675 51.8067 19.8065 175.8554 7 I 4.9971 9.2083 123.6125 59.4784 40.2829 175.1403 8 G 4.6420 9.3105 113.5404 44.7849 0.0000 171.4103 9 T 5.8442 8.4222 111.4594 59.4583 72.5698 172.3087 10 D 5.1137 8.1319 120.9312 52.1547 42.2482 176.0308 11 H 4.1890 8.8843 112.9661 58.7582 28.7611 175.8001 12 P 4.2396 0.0000 0.0000 64.6741 31.3477 176.7079 13 A 4.3570 7.5893 119.9286 52.3235 19.5056 178.6149 14 F 4.0708 8.1263 118.5020 61.0070 39.5146 177.1119 15 A 3.9605 8.2100 122.0893 54.2324 18.4432 177.7608 16 I 4.3020 7.4255 108.3155 60.6785 38.1715 177.2435 17 H 4.0328 7.8447 120.3219 59.2229 28.0244 177.3747 18 E 3.6240 7.2774 120.5732 58.6591 29.2642 178.8064 19 N 3.6873 7.5269 116.2776 56.0717 38.6380 177.1804 20 L 3.8625 7.4554 120.1964 57.6173 41.5189 179.6438 21 I 3.6482 7.4691 119.7249 64.3242 37.0564 178.2562 22 L 3.9204 7.5640 121.0653 58.3626 41.6641 178.5847 23 Y 4.3735 7.8234 116.1585 60.9866 38.0539 178.3367 24 V 3.7160 7.9646 119.2029 66.0994 31.6610 178.2751 25 K 4.1215 7.9255 118.0204 59.5791 31.6654 179.1848 26 E 4.1110 8.2629 117.5912 58.9581 29.3888 178.8722 27 A 4.1900 7.7489 119.8264 52.1160 18.8062 177.1608 28 G 4.6142 7.1288 107.8499 44.4927 0.0000 173.4570 29 D 4.4738 8.4468 121.5988 57.2771 40.6698 178.2266 30 E 4.0305 8.0466 116.6209 58.7187 30.8206 177.0374 31 F 5.0689 7.9622 120.1281 56.9693 39.8771 175.4213 32 V 4.4912 8.8880 124.8657 60.1753 33.5124 172.8663 33 P 4.9409 0.0000 0.0000 62.8434 32.4310 176.1029 34 V 4.3385 9.1217 123.7662 61.1290 33.9845 173.5385 35 Y 4.7491 8.6426 130.5065 57.3185 39.7517 174.9932 36 C 4.6843 9.0010 124.3185 59.5144 30.0201 174.6325 37 G 3.5444 5.7220 108.6957 42.2868 0.0000 172.1229 38 P 4.3951 0.0000 0.0000 62.8559 31.6314 176.3736 39 K 4.6523 8.4717 117.8421 56.6865 32.9269 175.7715 40 T 4.1804 6.9798 107.3940 59.3086 71.8300 173.4838 41 A 3.7774 7.8712 122.8092 52.7408 18.9328 177.8759 42 E 4.0650 7.5806 113.8101 55.7004 30.2273 177.1372 43 S 3.9503 8.4158 117.1417 58.9633 63.2980 174.0067 44 V 4.5929 8.1958 116.7700 59.7222 35.5152 173.9871 45 D 4.9314 8.4315 119.8911 52.7091 42.3943 176.9752 46 Y 4.3944 8.7539 123.7005 60.1928 37.6149 177.0393 47 P 4.4108 0.0000 0.0000 65.0530 31.4690 178.2945 48 D 4.1721 7.7919 117.6120 57.4200 40.7069 178.7880 49 F 4.1227 8.0897 117.4460 59.9757 39.0983 177.4734 50 A 4.0420 8.5780 121.0560 55.3310 18.2035 179.3631 51 S 3.9808 8.3328 111.7514 61.6183 62.2901 176.0878 52 R 3.8224 7.6983 120.7857 59.6468 29.7482 178.5624 53 V 3.5840 7.8738 117.3722 66.0406 31.5952 177.7800 54 A 4.0563 8.5276 120.9053 55.2498 18.0855 179.4829 55 E 3.9492 8.9016 117.4220 59.7681 29.5415 179.3502 56 M 4.0408 7.8392 118.7520 58.3783 32.0162 179.0738 57 V 3.7202 7.8960 117.9908 65.9429 31.5623 177.7147 58 A 3.9909 8.1137 119.5190 55.4053 18.3687 179.2500 59 R 4.1099 8.0858 113.0451 56.1481 30.2795 177.3653 60 K 3.9245 7.6404 117.1718 57.1223 30.0261 176.7392 61 E 4.1380 8.2356 122.0453 58.3874 29.7717 177.1644 62 V 4.5984 7.2367 109.5316 59.3668 35.7562 174.6828 63 E 4.0013 8.7864 123.0943 58.6986 30.2126 176.6245 64 F 5.4873 8.5499 115.9842 55.7596 44.0111 174.2299 65 G 4.6459 9.4567 107.4028 44.5103 0.0000 171.8998 66 V 4.9249 8.9982 120.6318 60.7924 34.7460 174.1603 67 L 5.3087 9.0514 127.8380 52.8552 44.7944 175.2332 68 A 5.1516 8.8877 125.1914 50.3757 21.8380 174.6053 69 A 5.0943 7.9772 124.5151 50.6470 22.4476 175.6404 70 G 3.8333 9.1347 99.4951 49.0006 0.0000 176.1164 71 S 4.4546 8.0864 115.6022 56.8629 64.7227 175.6357 72 G 3.9306 8.0696 108.6066 45.8864 0.0000 175.3800 73 I 3.7009 7.5517 120.7743 64.3288 36.9986 178.3278 74 G 3.0477 7.6222 105.8855 47.8976 0.0000 175.0209 75 M 4.1200 7.7448 121.2299 58.4246 31.7350 179.0041 76 S 4.1661 8.2000 113.9393 61.1318 63.0246 176.6540 77 I 3.7363 7.6768 122.5615 64.1688 37.2390 177.8336 78 A 4.1764 8.4192 121.6012 55.3040 18.3669 179.4614 79 A 4.0070 8.2392 119.3473 55.4707 18.2494 179.3339 80 N 4.5280 7.7811 112.9076 55.3195 38.7211 177.1277 81 K 4.2770 7.8029 119.2753 56.9060 32.4692 176.8685 82 V 3.9732 7.2836 120.3871 60.7302 31.8563 173.4348 83 P 4.5856 0.0000 0.0000 64.5690 31.5404 176.8580 84 G 3.9503 9.2777 111.1341 45.2213 0.0000 173.6672 85 V 4.1132 7.3572 119.5289 62.0665 32.5311 175.6328 86 R 4.6976 9.6681 125.4310 54.4844 32.4998 173.5020 87 A 5.2351 9.3257 126.1140 50.0318 20.9664 175.6528 88 A 4.6054 9.0624 125.3801 49.8874 21.5215 175.2488 89 L 4.6334 8.6128 125.7020 55.2044 42.4921 175.6635 90 C 5.1114 8.8315 124.8042 58.2665 30.5400 173.9223 91 H 4.8612 8.5501 114.9141 54.5028 29.7410 172.7660 92 D 4.5227 7.3330 119.3497 51.8125 42.9447 175.1284 93 H 4.0186 8.7404 117.9639 59.6060 29.5835 176.2128 94 Y 3.9681 8.0471 120.8563 60.9898 38.7741 177.9579 95 T 3.8094 8.6579 110.8159 64.6550 68.7896 176.1863 96 A 4.0212 7.8994 123.0250 54.8059 18.3446 179.5098 97 A 3.8145 7.9627 119.2933 55.7187 18.4551 179.9375 98 M 3.7902 8.0052 117.6056 58.0453 31.7560 179.1609 99 S 4.1537 8.1539 114.9219 61.3225 63.1292 176.8896 100 R 3.8457 7.5368 120.9048 58.9324 30.0824 178.9764 101 I 3.9054 7.9607 119.7689 64.5419 36.8935 178.0291 102 H 4.1405 8.4120 115.6334 57.7841 29.2285 176.2265 103 N 4.6372 8.1659 114.2240 52.3406 39.6975 174.0351 104 D 4.2034 8.1560 116.2817 54.2101 39.5998 173.3889 105 A 4.2738 8.0446 120.0440 52.9008 19.1746 177.7697 106 N 5.3604 9.1798 117.8238 52.8433 39.7464 174.3086 107 I 5.2591 8.0035 120.8965 59.4975 41.3281 174.3060 108 V 4.2458 8.0541 125.9834 59.8713 33.5557 174.3670 109 C 5.3325 8.9496 122.2287 58.0519 31.2215 173.4158 110 V 4.6422 8.7479 115.2610 59.5560 36.3006 174.5769 111 G 4.2496 8.3435 110.0999 43.8678 0.0000 174.4659 112 E 4.1337 9.7256 128.8034 58.6357 29.8927 177.7485 113 R 4.3305 8.2283 116.7280 56.8940 30.7347 177.0428 114 T 4.3309 7.7353 107.5951 62.2260 70.3083 174.5003 115 T 4.6240 7.6490 118.5131 60.7825 70.7667 174.9881 116 G 3.8226 8.4574 112.7799 44.6829 0.0000 174.7718 117 V 3.7187 8.2796 114.6064 64.2383 31.6198 178.8718 118 E 3.8986 8.0908 118.0389 59.0366 29.3291 179.1815 119 V 3.6490 7.6170 117.9449 65.4792 31.6512 177.9234 120 I 3.6207 7.8671 119.8580 64.2486 36.9933 178.0437 121 R 2.8822 7.9547 119.7104 59.1846 29.6350 178.0232 122 E 3.8290 7.8715 118.7396 59.2345 29.5268 178.6817 123 I 3.6316 8.1004 120.0730 64.5087 37.2057 178.4689 124 I 3.6245 7.8466 120.5485 64.3878 36.9864 178.5175 125 I 3.5422 7.6295 120.4839 64.7018 36.9324 178.6446 126 T 3.7724 7.9428 116.4421 66.4678 68.0459 176.2356 127 F 3.9387 8.1215 121.5750 61.5838 39.4243 176.9808 128 L 3.3392 7.4395 116.8094 57.3873 41.3297 179.0883 129 Q 4.2901 7.7208 117.1974 57.5334 28.9603 176.9287 130 T 4.0635 7.3949 117.6340 62.4650 68.9141 172.6863 131 P 4.6452 0.0000 0.0000 61.4469 31.6030 175.7446 132 F 5.3024 8.9235 121.7030 57.8750 39.8816 176.4557 133 S 3.9789 8.1556 122.2781 59.3904 62.8427 175.7187 134 G 3.3921 5.3800 104.3318 45.6660 0.0000 174.1642 135 E 4.0476 7.2766 119.6616 55.4897 31.3274 177.2912 136 E 3.9104 8.6115 122.7812 59.6426 29.8303 179.4799 137 R 3.8980 7.8690 115.4802 59.6883 29.2659 178.3184 138 H 4.3461 7.9035 116.3017 58.5692 28.8757 177.6260 139 V 3.7629 8.0341 120.0509 66.1457 31.4058 177.8176 140 R 3.9250 8.1871 118.3998 59.7820 29.9932 178.7077 141 R 4.0037 8.2209 117.6505 59.2243 30.1689 179.0651 142 I 3.7153 8.1783 120.0741 64.3778 37.0046 178.0649 143 E 3.9695 8.3738 120.1297 59.2480 29.4878 179.0064 144 K 3.9733 8.1578 118.5191 59.3591 32.0296 179.4173 145 I 3.7279 7.6270 120.0522 64.3551 36.9518 178.3783 146 R 4.1771 8.2206 120.4424 58.8785 29.8834 178.4548 147 A 4.0028 8.4362 120.9164 54.8801 18.0720 179.7725 148 I 3.6975 7.5468 117.8975 64.4837 36.9523 177.9991 149 E 4.1339 8.1695 119.1747 59.5239 29.4049 179.2915 150 A 4.0579 8.2971 121.1532 55.1791 18.2740 179.6029 151 S 4.2464 7.9922 110.8526 60.5575 63.1175 175.0928 152 H 4.7995 7.9648 117.4468 55.3612 29.8119 173.5893 153 A 4.2995 7.7199 128.8421 52.2153 18.9042 177.0182 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 T 8.17 4.46 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 1.22 0.00 0.00 3 R 8.98 4.35 0.00 1.47 2.12 0.00 2.95 0.00 0.00 2.56 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.49 0.00 4 R 8.71 4.80 0.00 1.82 1.91 0.00 3.09 0.00 0.00 3.30 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.66 0.00 5 V 9.11 4.87 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 1.04 0.00 0.00 1.34 0.00 0.00 6 A 9.09 4.87 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 7 I 9.21 5.00 2.17 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 1.25 1.27 1.10 0.00 0.00 8 G 9.31 4.64 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 0.00 0.00 0.00 9 T 8.42 5.84 4.33 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 1.33 0.00 0.00 10 D 8.13 5.11 0.00 2.94 3.01 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 11 H 8.88 4.19 0.00 3.44 3.75 0.00 5.46 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 P 0.00 4.24 0.00 2.33 2.22 0.00 3.54 0.00 0.00 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.87 0.00 13 A 7.59 4.36 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 14 F 8.13 4.07 0.00 3.11 3.25 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 15 A 8.21 3.96 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 16 I 7.43 4.30 1.79 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 0.84 0.87 0.00 0.00 17 H 7.84 4.03 0.00 3.03 3.36 0.00 5.26 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 E 7.28 3.62 0.00 1.66 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 2.02 1.60 0.00 19 N 7.53 3.69 0.00 2.63 2.02 0.00 0.00 7.18 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 20 L 7.46 3.86 0.00 1.74 1.69 0.93 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 21 I 7.47 3.65 1.82 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.35 0.85 0.00 0.00 22 L 7.56 3.92 0.00 1.64 1.62 0.93 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 23 Y 7.82 4.37 0.00 2.87 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 24 V 7.96 3.72 2.27 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 1.17 0.00 0.00 0.98 0.00 0.00 25 K 7.93 4.12 0.00 2.00 1.90 0.00 1.72 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.51 1.65 7.81 26 E 8.26 4.11 0.00 2.21 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 2.40 2.68 0.00 27 A 7.75 4.19 0.97 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 28 G 7.13 4.61 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 29 D 8.45 4.47 0.00 2.68 2.77 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 30 E 8.05 4.03 0.00 1.75 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.65 0.00 31 F 7.96 5.07 0.00 3.31 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 32 V 8.89 4.49 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 1.12 0.00 0.00 1.01 0.00 0.00 33 P 0.00 4.94 0.00 2.18 2.10 0.00 3.83 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.18 0.00 34 V 9.12 4.34 2.16 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 0.92 0.00 0.00 1.00 0.00 0.00 35 Y 8.64 4.75 0.00 3.12 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 36 C 9.00 4.68 0.00 2.90 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 G 5.72 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 38 P 0.00 4.40 0.00 2.13 1.78 0.00 3.47 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.65 0.00 39 K 8.47 4.65 0.00 1.80 1.99 0.00 1.77 0.00 0.00 1.89 0.00 0.00 3.09 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.50 1.48 7.81 40 T 6.98 4.18 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 1.14 0.00 0.00 41 A 7.87 3.78 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 42 E 7.58 4.06 0.00 2.03 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 2.17 2.27 0.00 43 S 8.42 3.95 0.00 3.77 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 44 V 8.20 4.59 2.46 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 0.96 0.00 0.00 1.03 0.00 0.00 45 D 8.43 4.93 0.00 2.79 2.37 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 46 Y 8.75 4.39 0.00 3.30 3.33 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 47 P 0.00 4.41 0.00 2.01 2.05 0.00 3.14 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.43 0.00 48 D 7.79 4.17 0.00 2.58 2.26 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 49 F 8.09 4.12 0.00 3.16 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 50 A 8.58 4.04 1.49 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 51 S 8.33 3.98 0.00 3.91 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 52 R 7.70 3.82 0.00 1.97 2.09 0.00 3.00 0.00 0.00 3.29 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.61 0.00 53 V 7.87 3.58 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 1.02 0.00 0.00 1.06 0.00 0.00 54 A 8.53 4.06 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 55 E 8.90 3.95 0.00 1.94 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 0.00 2.54 2.48 0.00 56 M 7.84 4.04 0.00 2.03 2.31 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 2.77 2.73 0.00 57 V 7.90 3.72 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 1.03 0.00 0.00 1.07 0.00 0.00 58 A 8.11 3.99 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 59 R 8.09 4.11 0.00 1.81 1.98 0.00 3.27 0.00 0.00 3.22 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.85 0.00 60 K 7.64 3.92 0.00 1.93 1.92 0.00 1.67 0.00 0.00 1.59 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.34 1.48 7.81 61 E 8.24 4.14 0.00 1.94 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 0.00 2.33 2.29 0.00 62 V 7.24 4.60 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 0.81 0.00 0.00 1.06 0.00 0.00 63 E 8.79 4.00 0.00 1.82 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 1.47 1.92 0.00 64 F 8.55 5.49 0.00 3.16 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 65 G 9.46 4.65 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 0.00 0.00 0.00 66 V 9.00 4.92 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 1.04 0.00 0.00 0.91 0.00 0.00 67 L 9.05 5.31 0.00 1.57 1.55 0.97 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 68 A 8.89 5.15 1.21 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 0.00 0.00 0.00 69 A 7.98 5.09 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 70 G 9.13 3.83 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 0.00 0.00 0.00 71 S 8.09 4.45 0.00 3.92 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 72 G 8.07 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 73 I 7.55 3.70 1.77 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.84 0.87 0.00 0.00 74 G 7.62 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 0.00 0.00 0.00 75 M 7.74 4.12 0.00 2.04 2.26 0.00 0.00 0.00 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.52 0.00 76 S 8.20 4.17 0.00 4.05 4.09 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 77 I 7.68 3.74 2.04 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 1.47 0.69 0.95 0.00 0.00 78 A 8.42 4.18 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 0.00 0.00 0.00 0.00 0.00 0.00 79 A 8.24 4.01 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 N 7.78 4.53 0.00 2.96 2.90 0.00 0.00 7.09 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 81 K 7.80 4.28 0.00 1.89 1.87 0.00 1.71 0.00 0.00 1.64 0.00 0.00 2.98 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.72 1.60 7.81 82 V 7.28 3.97 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 1.09 0.00 0.00 0.94 0.00 0.00 83 P 0.00 4.59 0.00 2.08 2.00 0.00 3.75 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.11 0.00 84 G 9.28 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 85 V 7.36 4.11 2.36 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 0.84 0.00 0.00 0.95 0.00 0.00 86 R 9.67 4.70 0.00 1.72 1.84 0.00 3.20 0.00 0.00 3.13 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.53 0.00 87 A 9.33 5.24 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 88 A 9.06 4.61 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 89 L 8.61 4.63 0.00 1.63 1.60 0.93 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 90 C 8.83 5.11 0.00 2.77 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 91 H 8.55 4.86 0.00 3.20 3.33 0.00 5.60 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 92 D 7.33 4.52 0.00 2.85 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 93 H 8.74 4.02 0.00 3.43 3.36 0.00 5.68 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 Y 8.05 3.97 0.00 3.15 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 95 T 8.66 3.81 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 1.36 0.00 0.00 96 A 7.90 4.02 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 97 A 7.96 3.81 1.18 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 0.00 0.00 98 M 8.01 3.79 0.00 1.60 1.74 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.74 0.00 99 S 8.15 4.15 0.00 4.18 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 0.00 100 R 7.54 3.85 0.00 2.00 1.99 0.00 2.72 0.00 0.00 2.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.49 0.00 101 I 7.96 3.91 1.88 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 1.51 1.29 0.92 0.00 0.00 102 H 8.41 4.14 0.00 3.18 3.32 0.00 5.65 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 N 8.17 4.64 0.00 2.93 2.86 0.00 0.00 6.95 8.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 D 8.16 4.20 0.00 1.58 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 0.00 0.00 0.00 105 A 8.04 4.27 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 N 9.18 5.36 0.00 2.91 3.06 0.00 0.00 6.59 7.10 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 0.00 107 I 8.00 5.26 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 1.58 0.74 0.90 0.00 0.00 108 V 8.05 4.25 0.67 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 0.36 0.00 0.00 0.46 0.00 0.00 109 C 8.95 5.33 0.00 2.76 2.77 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 0.00 110 V 8.75 4.64 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 0.65 0.00 0.00 0.91 0.00 0.00 111 G 8.34 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 0.00 0.00 0.00 0.00 112 E 9.73 4.13 0.00 1.86 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 0.00 2.32 2.42 0.00 113 R 8.23 4.33 0.00 1.93 1.95 0.00 3.18 0.00 0.00 3.27 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.54 0.00 114 T 7.74 4.33 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 1.19 0.00 0.00 115 T 7.65 4.62 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 0.00 116 G 8.46 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 0.00 117 V 8.28 3.72 2.26 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 0.91 0.00 0.00 0.98 0.00 0.00 118 E 8.09 3.90 0.00 1.93 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 2.38 2.28 0.00 119 V 7.62 3.65 2.16 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 0.94 0.00 0.00 0.91 0.00 0.00 120 I 7.87 3.62 2.06 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 1.40 0.64 1.03 0.00 0.00 121 R 7.95 2.88 0.00 0.67 1.59 0.00 2.80 0.00 0.00 2.93 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.67 0.00 122 E 7.87 3.83 0.00 2.15 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 2.33 2.33 0.00 123 I 8.10 3.63 1.94 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.59 0.81 0.00 0.00 124 I 7.85 3.62 1.88 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.51 0.90 0.00 0.00 125 I 7.63 3.54 1.79 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.99 0.89 0.00 0.00 126 T 7.94 3.77 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 0.99 0.00 0.00 127 F 8.12 3.94 0.00 2.94 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 0.00 128 L 7.44 3.34 0.00 0.94 0.19 0.45 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 129 Q 7.72 4.29 0.00 2.07 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.84 0.00 0.00 0.00 0.00 0.00 2.47 2.40 0.00 130 T 7.39 4.06 4.11 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 0.00 0.00 0.00 1.21 0.00 0.00 131 P 0.00 4.65 0.00 2.21 2.08 0.00 3.76 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 1.97 1.96 0.00 132 F 8.92 5.30 0.00 3.15 3.01 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 0.00 133 S 8.16 3.98 0.00 3.92 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 G 5.38 3.39 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 0.00 135 E 7.28 4.05 0.00 1.96 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 2.23 2.19 0.00 136 E 8.61 3.91 0.00 2.00 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 2.37 2.37 0.00 137 R 7.87 3.90 0.00 2.04 2.13 0.00 2.96 0.00 0.00 3.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.50 0.00 138 H 7.90 4.35 0.00 3.51 3.91 0.00 5.65 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 V 8.03 3.76 2.30 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 1.08 0.00 0.00 1.19 0.00 0.00 140 R 8.19 3.92 0.00 1.93 2.13 0.00 3.16 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.70 0.00 141 R 8.22 4.00 0.00 2.11 2.01 0.00 3.37 0.00 0.00 3.23 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.78 0.00 142 I 8.18 3.72 1.86 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.21 0.83 0.00 0.00 143 E 8.37 3.97 0.00 2.10 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 2.32 2.41 0.00 144 K 8.16 3.97 0.00 2.07 1.87 0.00 1.74 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.47 1.73 7.81 145 I 7.63 3.73 2.07 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 1.42 0.99 0.92 0.00 0.00 146 R 8.22 4.18 0.00 1.91 2.12 0.00 3.13 0.00 0.00 3.48 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.51 0.00 147 A 8.44 4.00 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 0.00 148 I 7.55 3.70 2.05 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 1.55 0.79 0.97 0.00 0.00 149 E 8.17 4.13 0.00 2.27 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 2.34 2.46 0.00 150 A 8.30 4.06 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 0.00 151 S 7.99 4.25 0.00 3.98 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 0.00 152 H 7.96 4.80 0.00 3.14 3.33 0.00 5.64 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 A 7.72 4.30 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