NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 S 4.4877 8.3349 115.4116 58.2056 64.3380 172.8426 4 R 4.5544 8.2242 121.6188 53.8744 34.1272 172.8881 5 R 4.5262 8.2844 119.2543 54.7924 34.0214 174.0664 6 M 4.0977 8.6878 125.0560 56.0729 32.8732 175.1475 7 L 4.5653 8.4201 126.1466 56.6897 43.6603 175.9520 8 H 5.0669 7.4031 110.0658 55.4585 31.1103 173.2328 9 T 4.6580 8.3347 115.2375 61.8866 71.5495 172.8663 10 M 5.0789 8.5944 125.5733 53.6178 34.3456 174.7122 11 I 4.3810 8.2200 118.6226 58.9882 41.2572 174.4351 12 R 4.7756 7.8682 122.7638 55.2334 31.2695 176.4360 13 V 4.8168 8.6792 115.7372 59.8655 34.8162 176.2804 14 G 4.1400 9.9019 112.7842 46.1567 0.0000 173.9108 15 D 4.4243 7.8877 117.9675 51.3281 43.6215 175.2320 16 L 3.9410 7.9401 129.2271 58.4387 42.2962 178.3974 17 D 4.3244 7.8984 118.3511 57.1696 40.8969 178.5217 18 R 3.8956 8.0241 119.2245 59.4418 30.1093 178.5901 19 S 4.2217 8.0777 112.6382 61.4892 62.4312 175.9570 20 I 3.8232 8.0645 122.7585 64.3981 36.7945 178.1004 21 K 3.8738 8.2511 120.3118 59.5172 31.9737 178.3388 22 F 3.9857 8.1155 120.3180 61.7795 39.3769 176.8286 23 Y 3.9254 8.1921 116.3771 60.7294 37.5956 178.4939 24 T 4.6060 8.0293 112.3393 64.0825 69.1726 177.0580 25 E 3.9467 8.2300 121.7103 58.3136 29.8218 178.6751 26 R 4.0010 7.7583 116.5956 57.6388 30.4143 177.2786 27 L 4.3675 7.5113 114.4286 53.9452 42.7883 177.2443 28 G 3.9971 8.2442 106.8388 45.7790 0.0000 173.6629 29 M 4.2561 7.9713 119.8156 54.6718 33.5716 175.2621 30 K 4.8506 8.5676 119.5319 54.8435 35.9158 175.5975 31 V 4.0052 8.3437 122.7007 63.5303 31.5214 175.3467 32 L 4.5057 9.2405 129.1586 56.6374 42.4657 176.9490 33 R 4.6413 7.5518 112.2255 55.5937 32.2848 173.2461 34 K 5.3138 8.7816 118.2952 54.6540 36.2375 176.3522 35 W 4.9823 9.4620 132.3541 56.4912 33.3578 172.6479 36 D 4.9200 8.3982 127.0988 52.4275 42.8716 176.3499 37 V 3.9089 8.1330 126.1716 59.7066 31.3432 173.7556 38 P 4.3469 0.0000 0.0000 64.2596 31.8550 178.5701 39 E 3.9075 8.0094 117.7536 58.6886 29.6824 176.7487 40 D 4.6533 7.7087 115.6628 53.1852 41.4571 176.1339 41 K 2.4800 7.4093 118.4853 56.4131 30.1265 174.0583 42 Y 5.3431 6.4081 113.6942 56.1756 42.0355 174.1233 43 T 5.2421 9.3721 116.3539 62.0226 72.9046 172.9532 44 L 5.3526 9.6278 125.8281 53.0823 45.0060 175.6576 45 V 4.8623 8.5072 121.7998 61.2383 35.1681 173.8840 46 F 5.1404 9.1847 126.3767 55.8521 41.1399 174.8371 47 L 5.1465 8.7421 123.0278 53.3946 46.2815 176.2205 48 G 3.7979 8.2395 106.8834 46.9414 0.0000 173.0850 49 Y 4.6303 8.8151 115.9942 58.5233 38.5119 175.2063 50 G 4.2472 7.7045 106.6410 44.2360 0.0000 170.7684 51 P 4.4908 0.0000 0.0000 62.1961 31.8674 177.3223 52 E 4.1599 8.6673 119.0034 59.8037 29.5227 178.7966 53 M 4.2047 8.0564 117.5467 57.5460 32.0984 176.8875 54 S 4.7178 8.0686 109.5839 57.5586 64.0931 173.5737 55 S 4.7263 7.6150 116.0693 57.4700 66.8231 172.3468 56 T 4.8646 8.3728 118.7356 62.7922 69.8780 174.5736 57 V 4.6232 8.6273 119.0163 59.4569 36.2933 173.4946 58 L 4.9786 8.6982 122.8808 53.5528 44.5691 174.8958 59 E 4.3896 8.9683 127.4497 54.2501 31.8190 174.2176 60 L 4.9480 8.5399 127.4920 53.4491 44.2276 175.4918 61 T 4.9871 8.6149 120.0448 61.9212 71.4102 172.3345 62 Y 5.2560 9.2777 128.3617 56.0303 41.3047 173.7641 63 N 5.1802 8.2437 123.8100 51.2937 40.6756 174.1791 64 Y 4.0469 8.6220 122.6873 59.5137 38.3581 177.8430 65 G 3.9252 8.7503 112.1623 45.4715 0.0000 173.3581 66 V 3.9757 7.7425 121.1610 61.7870 31.7258 176.1441 67 T 4.4711 8.0241 117.3194 62.2005 69.8064 174.1460 68 S 4.6730 6.7997 113.4357 57.9741 64.9409 174.0574 69 Y 4.6223 8.3534 121.8478 55.8705 41.3047 175.2388 70 K 4.4443 8.4242 121.7200 55.6971 34.7257 175.3330 71 H 4.8077 8.3172 117.5882 54.1111 30.4215 174.9008 72 D 4.7462 8.5020 123.2492 53.0143 40.6281 175.4779 73 E 4.4678 8.6326 115.6029 56.4817 29.1491 177.0313 74 A 4.4487 8.0508 121.5001 53.8501 20.4454 177.7126 75 Y 4.2349 8.2139 116.4580 57.8140 39.0317 175.1438 76 G 3.4156 6.8207 115.1134 45.1607 0.0000 173.6785 77 H 4.6358 6.6693 114.4537 54.6390 31.6760 173.3445 78 I 4.7013 8.0094 118.9043 59.7354 39.5371 174.8015 79 A 5.2202 8.6511 126.7118 50.3015 21.3407 175.8565 80 I 4.4871 8.8277 123.2591 59.3078 40.3454 175.0159 81 G 4.1829 8.6623 114.4694 45.7175 0.0000 173.1102 82 V 4.5793 8.7481 117.7259 59.5862 36.0643 176.6226 83 E 3.9650 8.7830 120.5550 58.9225 29.9254 177.3587 84 D 4.4395 7.5686 117.9656 51.8088 42.8649 175.4175 85 V 3.5498 8.2463 127.2726 65.6243 31.7969 177.5528 86 K 3.9167 8.0431 118.1839 60.0391 32.3602 178.5859 87 E 3.9115 8.4538 120.5688 58.7474 29.4905 178.5179 88 L 3.9164 7.8274 120.3167 58.2047 42.1003 179.1103 89 V 3.5706 8.1505 118.3198 65.7916 31.3745 177.7903 90 A 3.9644 8.0681 120.5769 55.2465 17.9109 179.1190 91 D 4.2773 8.2380 116.5149 57.6808 41.3179 178.2152 92 M 4.1035 8.3573 119.5653 58.5162 31.9886 178.6927 93 R 3.8965 8.3155 118.9788 59.3253 30.0301 178.0647 94 K 3.8043 7.8720 118.3558 59.5610 32.0163 177.2788 95 H 4.7866 7.4804 112.9632 55.1328 29.2367 174.6421 96 D 4.5109 7.9890 118.3309 55.1934 38.6170 174.0327 97 V 3.9259 7.7872 119.5446 62.1051 32.3147 174.1743 98 P 4.4470 0.0000 0.0000 62.7690 32.5502 175.0945 99 I 4.4792 8.3390 125.2961 59.9860 37.8518 174.9959 100 D 4.7026 9.2485 128.5205 56.9602 42.0038 175.9568 101 Y 4.9793 7.9348 117.3911 56.4727 42.5283 173.3604 102 E 4.6465 7.5523 125.9617 54.8633 32.6898 174.4166 103 D 4.4976 8.1427 127.0618 52.4331 40.7966 176.5010 104 E 4.1534 8.7085 118.1315 59.0774 29.7373 178.9110 105 S 4.1516 8.0629 112.3281 59.4897 63.4166 175.2382 106 G 3.9134 8.9034 108.9051 45.5291 0.0000 174.0368 107 F 4.5805 8.5539 124.1969 60.8397 40.5955 175.0091 108 M 5.0184 8.7057 116.7457 54.0201 36.0523 173.6386 109 A 5.1664 8.6687 124.6255 50.7588 23.6896 174.8428 110 F 5.3352 9.4812 118.2692 55.8626 42.1075 175.2581 111 V 5.1308 9.0972 115.8579 59.5860 36.0241 174.4319 112 V 4.7824 8.2171 122.3382 61.0762 33.2800 175.5361 113 D 3.3700 8.8131 127.9999 51.4201 40.2885 175.4888 114 P 4.1187 0.0000 0.0000 65.1313 31.2264 177.2533 115 D 4.6197 8.3178 115.5922 54.0827 41.1396 177.0670 116 G 3.7187 8.1195 107.9808 45.0918 0.0000 173.4777 117 Y 4.2489 8.1424 117.6228 57.7353 39.1636 174.2271 118 Y 5.2036 8.6826 119.3057 57.2240 40.4334 174.4957 119 I 5.0701 9.1586 124.0615 59.5918 40.6513 174.0794 120 E 3.9933 9.2240 129.1197 55.0322 31.0399 174.6536 121 L 5.0093 8.6371 127.6491 53.2379 43.9272 175.5917 122 L 4.8372 8.4779 122.9449 52.3534 46.1659 175.3050 123 N 4.6839 8.7955 122.5297 53.8966 39.3350 175.2419 124 E 3.9572 9.1209 128.5497 59.0697 29.7553 178.4547 125 K 3.9086 8.0321 119.2416 59.9888 32.3178 178.7427 126 T 3.8942 8.4480 115.9666 66.7511 68.2676 176.4420 127 M 4.2535 8.3458 120.1816 59.1326 32.3587 178.2862 128 M 4.1070 8.4983 119.1757 58.0614 32.0727 178.5674 129 E 3.9495 8.3640 119.0156 59.3341 29.6714 179.2745 130 K 3.8588 8.0610 119.2588 59.4471 32.2850 178.5370 131 A 3.9929 8.2768 121.3111 55.3006 18.3105 179.2909 132 E 3.9002 8.4018 117.5576 59.2214 29.6191 178.8869 133 A 3.9936 8.0362 120.9867 55.1725 18.3632 179.3282 134 D 4.2891 8.2902 117.5023 57.8071 40.9031 178.9159 135 M 4.1503 8.0611 120.4437 57.7114 31.5542 179.0366 136 K 3.9587 8.0183 118.5396 59.4030 32.0514 178.9231 137 E 3.9825 8.1308 118.3860 59.4347 29.7086 178.3684 138 Q 4.2957 8.2920 115.3730 56.2131 29.0269 176.8761 139 G 3.9014 7.6975 107.2267 45.9700 0.0000 174.2802 140 T 4.3473 8.1289 108.7387 61.1215 69.7978 174.7587 141 A 4.2596 7.7199 130.0403 52.4777 19.3651 175.5789 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 3 S 8.33 4.49 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 4 R 8.22 4.55 0.00 1.83 1.79 0.00 3.20 0.00 0.00 3.18 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.67 0.00 5 R 8.28 4.53 0.00 1.70 1.73 0.00 3.24 0.00 0.00 3.15 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.61 0.00 6 M 8.69 4.10 0.00 2.02 1.98 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.57 0.00 7 L 8.42 4.57 0.00 1.53 1.68 0.88 0.97 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 8 H 7.40 5.07 0.00 3.24 3.32 0.00 5.46 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 T 8.33 4.66 4.22 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 1.18 0.00 0.00 10 M 8.59 5.08 0.00 1.88 2.02 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.36 0.00 11 I 8.22 4.38 0.79 0.00 0.00 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.24 0.17 0.00 0.00 12 R 7.87 4.78 0.00 0.71 1.00 0.00 2.88 0.00 0.00 3.13 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.35 0.00 13 V 8.68 4.82 2.34 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 0.77 0.00 0.00 1.12 0.00 0.00 14 G 9.90 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 15 D 7.89 4.42 0.00 2.66 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 L 7.94 3.94 0.00 1.54 1.42 0.99 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 17 D 7.90 4.32 0.00 2.68 2.68 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 0.00 0.00 0.00 18 R 8.02 3.90 0.00 1.98 2.11 0.00 3.09 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.66 0.00 19 S 8.08 4.22 0.00 4.10 4.10 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 20 I 8.06 3.82 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 1.45 0.56 0.95 0.00 0.00 21 K 8.25 3.87 0.00 1.99 2.04 0.00 1.66 0.00 0.00 1.60 0.00 0.00 3.14 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.60 7.81 22 F 8.12 3.99 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 23 Y 8.19 3.93 0.00 3.15 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 24 T 8.03 4.61 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 1.34 0.00 0.00 25 E 8.23 3.95 0.00 2.01 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 2.32 2.35 0.00 26 R 7.76 4.00 0.00 1.06 1.54 0.00 3.25 0.00 0.00 3.20 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.64 0.00 27 L 7.51 4.37 0.00 1.68 1.80 1.02 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 28 G 8.24 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 0.00 0.00 0.00 29 M 7.97 4.26 0.00 1.74 2.03 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 1.12 0.00 30 K 8.57 4.85 0.00 1.79 1.89 0.00 1.33 0.00 0.00 1.59 0.00 0.00 2.78 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.49 1.34 7.81 31 V 8.34 4.01 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.95 0.00 0.00 32 L 9.24 4.51 0.00 1.69 1.72 1.02 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 33 R 7.55 4.64 0.00 1.92 2.02 0.00 2.85 0.00 0.00 3.25 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.76 0.00 34 K 8.78 5.31 0.00 1.70 1.82 0.00 1.76 0.00 0.00 1.68 0.00 0.00 2.72 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.40 1.46 7.81 35 W 9.46 4.98 0.00 3.49 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 36 D 8.40 4.92 0.00 2.68 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 37 V 8.13 3.91 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.34 0.00 0.00 38 P 0.00 4.35 0.00 2.21 2.20 0.00 3.77 0.00 0.00 3.55 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 39 E 8.01 3.91 0.00 1.86 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 2.27 2.37 0.00 40 D 7.71 4.65 0.00 2.77 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 41 K 7.41 2.48 0.00 1.83 1.59 0.00 1.62 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.31 1.23 7.81 42 Y 6.41 5.34 0.00 3.11 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 43 T 9.37 5.24 4.58 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 1.35 0.00 0.00 44 L 9.63 5.35 0.00 1.82 1.46 1.10 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 45 V 8.51 4.86 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 0.98 0.00 0.00 0.99 0.00 0.00 46 F 9.18 5.14 0.00 3.05 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 47 L 8.74 5.15 0.00 1.40 1.47 0.78 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 48 G 8.24 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 Y 8.82 4.63 0.00 3.05 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 50 G 7.70 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 51 P 0.00 4.49 0.00 2.22 2.19 0.00 3.73 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.99 0.00 52 E 8.67 4.16 0.00 1.90 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 2.28 2.30 0.00 53 M 8.06 4.20 0.00 1.97 2.12 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.57 0.00 54 S 8.07 4.72 0.00 3.94 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 0.00 55 S 7.62 4.73 0.00 3.93 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 56 T 8.37 4.86 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 57 V 8.63 4.62 2.34 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 0.94 0.00 0.00 1.12 0.00 0.00 58 L 8.70 4.98 0.00 1.52 1.38 0.67 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 59 E 8.97 4.39 0.00 1.46 1.45 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 1.67 1.47 0.00 60 L 8.54 4.95 0.00 1.51 1.51 0.94 0.21 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 61 T 8.61 4.99 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 1.19 0.00 0.00 62 Y 9.28 5.26 0.00 3.15 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 63 N 8.24 5.18 0.00 2.67 2.65 0.00 0.00 7.14 7.48 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 64 Y 8.62 4.05 0.00 2.87 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 65 G 8.75 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 66 V 7.74 3.98 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 0.51 0.00 0.00 0.88 0.00 0.00 67 T 8.02 4.47 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 1.24 0.00 0.00 68 S 6.80 4.67 0.00 3.73 3.60 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 69 Y 8.35 4.62 0.00 2.85 2.73 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 70 K 8.42 4.44 0.00 1.82 1.76 0.00 1.54 0.00 0.00 1.70 0.00 0.00 2.88 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.32 1.43 7.81 71 H 8.32 4.81 0.00 3.15 3.28 0.00 5.69 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 D 8.50 4.75 0.00 2.82 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 73 E 8.63 4.47 0.00 1.99 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.32 0.00 74 A 8.05 4.45 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 75 Y 8.21 4.23 0.00 2.98 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 76 G 6.82 3.42 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 0.00 77 H 6.67 4.64 0.00 3.40 3.43 0.00 5.51 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 78 I 8.01 4.70 2.04 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 1.27 0.97 1.02 0.00 0.00 79 A 8.65 5.22 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 80 I 8.83 4.49 1.93 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.01 0.95 0.00 0.00 81 G 8.66 4.18 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 0.00 82 V 8.75 4.58 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 0.71 0.00 0.00 0.96 0.00 0.00 83 E 8.78 3.97 0.00 1.93 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 2.27 2.24 0.00 84 D 7.57 4.44 0.00 2.63 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 V 8.25 3.55 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 0.91 0.00 0.00 86 K 8.04 3.92 0.00 2.00 2.04 0.00 1.55 0.00 0.00 1.74 0.00 0.00 2.89 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.71 1.49 7.81 87 E 8.45 3.91 0.00 2.11 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 2.30 2.35 0.00 88 L 7.83 3.92 0.00 1.80 1.77 0.92 0.85 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 89 V 8.15 3.57 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 1.05 0.00 0.00 0.97 0.00 0.00 90 A 8.07 3.96 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 91 D 8.24 4.28 0.00 2.81 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 92 M 8.36 4.10 0.00 2.12 2.28 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.74 0.00 93 R 8.32 3.90 0.00 1.99 2.10 0.00 3.13 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 94 K 7.87 3.80 0.00 1.96 2.07 0.00 1.83 0.00 0.00 1.68 0.00 0.00 3.01 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.31 1.46 7.81 95 H 7.48 4.79 0.00 3.16 3.32 0.00 6.02 0.00 0.00 0.00 0.00 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 D 7.99 4.51 0.00 2.87 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 97 V 7.79 3.93 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 0.95 0.00 0.00 1.13 0.00 0.00 98 P 0.00 4.45 0.00 2.13 1.98 0.00 3.80 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.11 0.00 99 I 8.34 4.48 1.92 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 1.37 0.86 0.96 0.00 0.00 100 D 9.25 4.70 0.00 2.97 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 Y 7.93 4.98 0.00 3.12 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 0.00 102 E 7.55 4.65 0.00 1.86 1.59 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 2.08 2.23 0.00 103 D 8.14 4.50 0.00 2.81 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 0.00 104 E 8.71 4.15 0.00 1.99 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 2.29 2.28 0.00 105 S 8.06 4.15 0.00 4.02 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 0.00 106 G 8.90 3.91 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 0.00 0.00 0.00 107 F 8.55 4.58 0.00 3.16 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 0.00 108 M 8.71 5.02 0.00 2.16 1.31 0.00 0.00 0.00 0.00 0.00 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.67 0.00 109 A 8.67 5.17 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 0.00 110 F 9.48 5.34 0.00 3.14 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 0.00 111 V 9.10 5.13 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 0.83 0.00 0.00 1.14 0.00 0.00 112 V 8.22 4.78 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 0.52 0.00 0.00 0.89 0.00 0.00 113 D 8.81 3.37 0.00 1.80 2.53 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 0.00 114 P 0.00 4.12 0.00 2.01 2.10 0.00 3.19 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 1.92 1.85 0.00 115 D 8.32 4.62 0.00 2.97 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 0.00 116 G 8.12 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 0.00 117 Y 8.14 4.25 0.00 3.22 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 0.00 118 Y 8.68 5.20 0.00 3.13 3.07 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 0.00 119 I 9.16 5.07 2.10 0.00 0.00 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 1.38 1.36 1.07 0.00 0.00 120 E 9.22 3.99 0.00 1.50 1.58 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 1.75 1.47 0.00 121 L 8.64 5.01 0.00 1.46 1.47 0.91 0.41 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 0.00 122 L 8.48 4.84 0.00 1.39 1.21 0.82 -0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 123 N 8.80 4.68 0.00 2.96 2.90 0.00 0.00 6.60 8.27 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 0.00 124 E 9.12 3.96 0.00 2.06 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 2.30 2.31 0.00 125 K 8.03 3.91 0.00 1.87 1.97 0.00 1.78 0.00 0.00 1.82 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.66 1.55 7.81 126 T 8.45 3.89 4.63 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 1.03 0.00 0.00 127 M 8.35 4.25 0.00 2.35 2.30 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.68 0.00 128 M 8.50 4.11 0.00 2.07 2.11 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.93 0.00 129 E 8.36 3.95 0.00 2.18 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 2.33 2.47 0.00 130 K 8.06 3.86 0.00 1.80 2.03 0.00 1.50 0.00 0.00 1.58 0.00 0.00 3.00 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.39 1.50 7.81 131 A 8.28 3.99 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 0.00 132 E 8.40 3.90 0.00 2.12 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.32 0.00 133 A 8.04 3.99 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 0.00 134 D 8.29 4.29 0.00 2.86 2.73 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 0.00 135 M 8.06 4.15 0.00 2.07 2.24 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 2.84 2.45 0.00 136 K 8.02 3.96 0.00 1.98 1.85 0.00 1.67 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.46 1.56 7.81 137 E 8.13 3.98 0.00 2.09 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 2.35 0.00 138 Q 8.29 4.30 0.00 2.15 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 5.86 0.00 0.00 0.00 0.00 0.00 2.38 2.44 0.00 139 G 7.70 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 0.00 140 T 8.13 4.35 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 141 A 7.72 4.26 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