NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 12 T 4.2596 8.1744 115.2433 61.8057 68.4152 172.4963 13 N 4.2237 8.6195 118.7624 53.4730 39.4073 174.2608 14 L 4.5622 9.0865 126.1406 54.6932 43.8429 175.5881 15 L 4.7105 8.0709 120.3952 53.4515 43.5782 176.2228 16 Y 4.4198 8.4878 122.5342 58.1054 39.5640 174.8297 17 T 3.8390 6.8858 117.5424 60.8397 70.1253 173.6234 18 R 3.8542 8.0878 126.2602 57.3686 30.2174 176.0698 19 N 4.3090 7.5579 117.3830 53.6823 38.5243 174.7778 20 D 4.6640 8.4009 129.0811 53.3734 39.5647 176.4578 21 V 4.0572 7.1584 118.3588 62.4539 32.8587 176.0024 22 S 4.1305 8.6415 121.2407 59.3390 63.9917 175.1801 23 D 4.3875 8.9580 124.6734 58.4441 40.4882 178.5742 24 S 4.1476 8.1564 113.3169 60.3911 62.3345 175.1096 25 E 3.8352 8.6842 121.5606 59.8742 29.4067 179.4572 26 K 3.9485 8.7831 118.4840 59.3994 32.0849 179.1797 27 K 3.8501 8.6170 118.5125 59.5940 32.1446 179.0241 28 A 3.9479 8.6508 121.1348 55.6110 18.2426 179.5843 29 T 3.7326 8.1929 113.9004 67.0254 68.6877 176.7457 30 V 3.5494 7.9975 120.0918 66.4142 31.1841 177.9688 31 E 3.9789 8.0556 117.7379 59.0209 29.2421 178.8425 32 L 3.9541 7.7341 120.2863 58.0656 42.1777 179.0854 33 L 3.8801 8.1982 119.1285 58.0655 41.8236 179.2061 34 N 4.5544 8.0538 116.1305 56.1618 38.3512 177.4619 35 R 3.8590 7.6128 120.4567 59.4656 30.2449 178.2943 36 Q 4.0526 7.7923 117.6934 59.0294 28.7660 178.9283 37 V 3.5972 8.1021 119.4047 66.3202 31.4533 177.8573 38 I 3.6949 7.5816 118.6663 64.5490 36.9507 178.1413 39 Q 3.9581 8.0930 119.9909 59.2695 28.9605 178.3923 40 F 3.9121 9.1795 119.0158 60.6074 39.0164 177.4569 41 I 3.7259 8.2972 119.9120 64.7814 36.9009 177.9655 42 D 4.3175 8.1272 118.5238 57.1260 40.9733 177.9228 43 L 3.8028 7.9992 121.3202 57.9361 42.0211 179.1068 44 S 4.0588 8.5264 114.5180 61.5995 63.0376 176.3749 45 L 3.9134 7.9555 122.9981 57.4373 41.2320 179.7387 46 I 3.5229 7.8132 119.7474 64.4448 36.9616 178.4492 47 T 3.7854 8.0045 116.9680 66.6936 68.2356 176.7353 48 K 3.2520 7.5908 120.1219 58.9357 31.6323 179.0605 49 Q 4.0419 7.2374 118.3972 59.1869 29.3106 178.1320 50 A 3.9788 7.8336 121.7920 55.3357 18.2478 178.6486 51 H 3.8626 7.9936 115.7943 59.5886 29.8890 176.8730 52 W 4.6179 8.1011 119.1769 59.2558 28.9933 177.4304 53 N 5.0035 8.1014 114.4269 52.3532 38.5239 174.5431 54 M 5.3593 7.3112 116.9152 53.9904 33.3267 175.4085 55 R 4.4068 8.4165 117.1319 55.9847 34.5057 173.6949 56 G 3.9999 8.9277 104.7036 43.8273 0.0000 172.7415 57 A 3.9549 8.6191 121.4858 53.9771 18.6129 176.9496 58 N 4.1540 8.9771 118.4818 54.3865 37.6724 176.2759 59 F 4.1842 7.7914 118.1202 60.7225 39.3709 175.5460 60 I 2.9025 7.8768 117.1001 64.1431 37.7248 177.6425 61 A 3.7989 7.7645 120.7050 55.0867 18.2141 179.6582 62 V 3.2902 7.3037 116.7370 66.0186 31.0660 177.5367 63 H 3.8032 8.1455 118.3361 59.5085 29.4365 177.0962 64 E 3.8122 8.0792 120.2755 59.2079 29.1219 178.8055 65 M 3.5655 7.8928 118.5561 58.5432 32.1924 178.0656 66 L 3.3045 7.7619 119.1757 57.7489 41.8507 179.0004 67 D 4.1035 7.3439 116.9115 57.1392 41.1776 178.4483 68 G 3.5346 7.4138 105.8956 47.8200 0.0000 175.4529 69 F 3.8219 7.1084 120.3711 60.1330 38.8882 177.3864 70 R 3.9106 7.8362 118.2363 60.1314 29.8681 178.4633 71 T 3.8612 7.8081 114.6357 66.5598 68.3815 176.5546 72 A 4.0775 7.9938 122.2968 55.1229 18.5257 179.2513 73 L 4.2297 8.8048 117.9641 58.4872 41.7887 179.7022 74 I 3.7389 7.9971 119.2362 64.8113 37.0838 177.7201 75 C 4.0054 8.0160 118.8125 62.8892 31.3422 175.0467 76 H 4.0578 8.3128 117.4659 58.9584 28.4350 177.0547 77 L 3.6255 8.4557 121.8979 58.5601 41.8611 179.1010 78 A 3.9967 8.4544 120.5584 55.3998 18.2447 179.7343 79 T 3.8204 7.9607 114.4498 66.8799 68.4026 176.8958 80 M 3.8940 8.1345 120.4226 58.3363 32.0535 178.3488 81 A 3.9426 7.9423 120.8952 55.6034 18.4883 179.6180 82 E 3.9281 8.2825 116.7522 59.3392 29.2555 179.5651 83 R 3.8367 7.6914 117.8948 59.1726 30.4453 178.0799 84 A 4.0864 8.1019 120.6675 55.4192 18.5352 179.7713 85 V 3.7206 7.7866 116.4594 66.3524 31.2784 178.2344 86 Q 4.0703 8.0317 116.8923 58.1209 28.5779 177.4478 87 L 4.4117 7.5449 118.0204 54.4818 42.2100 177.5114 88 G 3.9258 8.1442 108.8068 45.0300 0.0000 174.5673 89 G 4.0801 7.3754 108.0849 44.3997 0.0000 172.4570 90 V 4.2314 8.0293 118.3734 60.5973 33.7815 175.8434 91 A 4.1984 8.6869 130.7944 51.9693 18.8199 176.1334 92 L 4.6862 9.7071 124.8151 53.2364 42.8958 177.2371 93 G 4.2092 8.3863 112.6026 44.6525 0.0000 172.8158 94 T 4.2929 7.8658 110.2840 60.7233 71.2228 174.8397 95 T 3.8898 8.4793 119.3446 67.0291 68.5357 176.4141 96 Q 3.9849 8.1328 118.7303 59.6244 28.5388 178.9347 97 V 3.5971 7.3947 119.5477 65.4317 31.2975 178.0406 98 I 3.6799 7.6908 118.5906 64.5427 37.1456 177.3855 99 N 4.3820 8.6361 117.0180 56.8241 39.0112 175.7530 100 S 4.1530 8.4987 114.6737 60.0818 61.7467 175.0444 101 K 4.0673 6.3623 117.6429 57.4706 32.3013 177.0741 102 T 4.0338 7.6746 115.7136 61.5191 67.4646 172.2373 103 P 4.6857 0.0000 0.0000 62.6771 31.7047 175.2226 104 L 4.7060 7.3242 118.5760 52.5987 43.5307 176.4502 105 K 4.0045 8.5347 123.8023 56.2254 32.7552 176.3740 106 S 4.2323 8.4871 119.4281 58.5438 62.8868 173.1398 107 Y 4.1570 8.5333 128.0172 56.1718 39.3914 172.7300 108 P 4.2917 0.0000 0.0000 63.3878 31.5119 175.8129 109 L 4.7030 8.5762 123.0126 54.7054 41.5835 176.7124 110 D 4.8846 7.8811 114.8563 52.5124 40.7660 174.8547 111 I 4.3417 7.6402 113.5179 60.3376 39.4182 174.1776 112 H 4.9268 8.7009 118.7943 56.6182 31.0890 173.8949 113 N 4.6384 8.1571 116.4234 53.8374 40.5529 175.1889 114 V 3.6975 8.2776 125.7171 66.4144 31.6603 178.5019 115 Q 4.0456 8.6547 118.0835 59.0942 28.5268 178.7133 116 D 4.3662 8.4242 119.2102 57.7591 40.9010 178.4937 117 H 4.3391 8.0792 117.4829 58.2397 28.6492 177.6653 118 L 4.0074 8.5065 121.1427 57.8707 41.5161 179.6702 119 K 4.0663 8.3665 118.4226 59.7244 32.0789 179.1736 120 E 3.9984 8.3550 118.6561 59.3939 29.3565 179.5893 121 L 4.2200 8.7098 119.1324 57.8299 41.6857 178.9984 122 A 4.0385 8.7690 121.8128 55.6981 18.1491 179.2640 123 D 4.3451 8.2129 116.8594 57.8169 41.0677 179.2370 124 R 3.9592 8.0670 117.8656 59.6094 29.9470 178.9007 125 Y 3.7056 8.9383 116.6494 60.7398 37.8184 178.1859 126 A 4.1883 8.3411 122.0036 55.2874 18.5243 179.4719 127 I 3.6110 7.9085 118.3510 64.7245 37.1585 178.8711 128 V 3.4739 7.6140 118.2264 65.7643 31.3581 177.6559 129 A 3.8982 8.7410 121.6686 55.4341 18.3211 179.3493 130 N 4.2593 8.4880 115.1151 56.3824 38.5345 177.1575 131 D 4.2979 8.1286 119.5376 57.4789 41.1334 178.7586 132 V 3.8946 8.0847 121.2545 64.2550 31.0590 178.1781 133 R 3.8707 7.8395 118.7358 59.0617 30.0634 178.4794 134 K 4.0805 7.9167 117.6724 59.4662 31.9035 178.9531 135 A 4.0781 8.2731 121.3563 55.5031 17.8385 179.5882 136 I 3.7504 7.3063 117.3771 64.4728 37.3314 178.0286 137 G 3.6669 8.3471 109.0424 48.6970 0.0000 175.1474 138 E 4.1133 7.5556 114.8659 56.4533 29.4723 176.2844 139 A 4.4219 7.4702 124.0620 51.1831 19.0785 177.7161 140 K 4.0649 8.5612 123.2142 59.2181 32.8131 177.9135 141 D 4.4320 7.9447 118.9049 53.6840 41.8446 175.7116 142 D 4.3871 8.8370 127.6578 57.8860 40.8573 178.5847 143 D 4.3504 8.2007 118.2359 58.0339 41.0186 179.1024 144 T 3.7970 7.7572 114.5825 66.4502 68.3282 176.6355 145 A 3.9521 8.1718 123.1079 55.0243 18.4390 179.0748 146 D 4.2348 8.2307 116.6697 57.6205 41.3778 178.3708 147 I 3.6824 7.9053 120.3972 64.6835 37.1221 178.4528 148 L 4.0064 7.8416 119.2572 57.7789 41.3986 179.7485 149 T 3.8134 8.0039 115.7502 66.4616 68.2439 176.4911 150 A 3.9462 8.0644 122.4456 55.1803 18.3281 179.5937 151 A 3.3798 7.8260 119.0698 55.0424 18.4184 179.8250 152 S 3.9152 8.4572 112.0981 61.4449 62.5458 175.9776 153 R 3.7783 8.3151 121.7837 59.8374 29.6292 178.1361 154 D 3.8201 7.5303 118.1187 57.1403 40.7647 178.6091 155 L 3.6112 7.6023 119.5804 57.8052 41.4807 179.4879 156 D 4.2611 8.2891 119.1243 57.1422 40.6813 178.6198 157 K 4.0233 7.5841 119.6382 59.4896 32.0480 178.8491 158 F 3.7388 7.9599 118.3742 60.2568 38.7357 177.1012 159 L 3.9426 8.0149 120.0860 58.0401 41.8123 178.6607 160 W 4.4367 8.3932 128.0718 60.8173 30.4162 177.8576 161 F 4.0365 8.1131 116.2951 60.5129 38.5648 177.3862 162 I 3.8764 8.6505 120.1600 64.4764 36.9382 178.2377 163 E 3.9805 8.6233 119.5220 59.7338 29.2304 179.6452 164 S 4.3791 8.4849 113.3025 60.8887 62.9345 175.5475 165 N 4.7120 7.6438 117.1727 52.5964 38.9086 175.0476 166 I 4.1954 7.5311 123.2316 60.6371 37.6444 175.7944 167 E 4.1805 8.9648 123.1849 56.5080 29.6237 176.3465 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 12 T 8.17 4.26 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 13 N 8.62 4.22 0.00 2.79 2.72 0.00 0.00 6.87 6.89 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 14 L 9.09 4.56 0.00 1.59 1.60 1.04 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 15 L 8.07 4.71 0.00 1.65 1.59 0.95 0.71 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 16 Y 8.49 4.42 0.00 2.99 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 17 T 6.89 3.84 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 1.06 0.00 0.00 18 R 8.09 3.85 0.00 1.76 1.94 0.00 3.26 0.00 0.00 3.17 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.53 0.00 19 N 7.56 4.31 0.00 2.64 2.68 0.00 0.00 7.16 7.85 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 20 D 8.40 4.66 0.00 2.82 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 V 7.16 4.06 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 0.79 0.00 0.00 0.98 0.00 0.00 22 S 8.64 4.13 0.00 4.08 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 23 D 8.96 4.39 0.00 2.79 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 24 S 8.16 4.15 0.00 3.88 3.76 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 25 E 8.68 3.84 0.00 2.11 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 2.31 2.42 0.00 26 K 8.78 3.95 0.00 1.94 1.89 0.00 1.72 0.00 0.00 1.87 0.00 0.00 2.94 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.44 1.69 7.81 27 K 8.62 3.85 0.00 1.88 1.87 0.00 1.68 0.00 0.00 1.65 0.00 0.00 3.19 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.64 7.81 28 A 8.65 3.95 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 29 T 8.19 3.73 4.37 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 1.18 0.00 0.00 30 V 8.00 3.55 2.21 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 1.02 0.00 0.00 0.99 0.00 0.00 31 E 8.06 3.98 0.00 2.09 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 2.65 2.45 0.00 32 L 7.73 3.95 0.00 1.77 1.83 0.95 0.64 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 33 L 8.20 3.88 0.00 1.66 1.63 0.96 0.51 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 34 N 8.05 4.55 0.00 2.90 2.88 0.00 0.00 6.76 7.68 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 35 R 7.61 3.86 0.00 2.13 1.93 0.00 3.11 0.00 0.00 3.17 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.67 0.00 36 Q 7.79 4.05 0.00 2.02 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.49 0.00 0.00 0.00 0.00 0.00 2.57 2.45 0.00 37 V 8.10 3.60 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 0.99 0.00 0.00 0.90 0.00 0.00 38 I 7.58 3.69 2.08 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 0.68 0.93 0.00 0.00 39 Q 8.09 3.96 0.00 2.34 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.82 0.00 0.00 0.00 0.00 0.00 2.32 2.40 0.00 40 F 9.18 3.91 0.00 3.20 3.11 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 0.00 41 I 8.30 3.73 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 1.06 0.94 0.00 0.00 42 D 8.13 4.32 0.00 2.91 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 43 L 8.00 3.80 0.00 1.60 1.47 0.50 -0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 44 S 8.53 4.06 0.00 4.02 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 45 L 7.96 3.91 0.00 1.89 1.76 0.94 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 46 I 7.81 3.52 1.96 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 1.51 0.87 0.65 0.00 0.00 47 T 8.00 3.79 4.27 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 1.21 0.00 0.00 48 K 7.59 3.25 0.00 1.37 0.74 0.00 0.61 0.00 0.00 0.65 0.00 0.00 2.93 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.00 1.12 7.81 49 Q 7.24 4.04 0.00 2.10 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.95 0.00 0.00 0.00 0.00 0.00 2.44 2.50 0.00 50 A 7.83 3.98 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 51 H 7.99 3.86 0.00 2.80 3.21 0.00 5.96 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 52 W 8.10 4.62 0.00 3.44 3.09 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 53 N 8.10 5.00 0.00 2.85 2.86 0.00 0.00 6.72 7.83 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 54 M 7.31 5.36 0.00 2.12 2.21 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.91 2.93 0.00 55 R 8.42 4.41 0.00 1.86 1.73 0.00 3.10 0.00 0.00 3.28 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.60 0.00 56 G 8.93 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 57 A 8.62 3.95 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 58 N 8.98 4.15 0.00 2.93 2.81 0.00 0.00 6.82 7.71 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 59 F 7.79 4.18 0.00 3.16 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 60 I 7.88 2.90 1.96 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 1.19 0.89 0.00 0.00 61 A 7.76 3.80 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 62 V 7.30 3.29 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 0.74 0.00 0.00 0.89 0.00 0.00 63 H 8.15 3.80 0.00 2.14 2.80 0.00 5.64 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 64 E 8.08 3.81 0.00 1.87 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 2.26 2.38 0.00 65 M 7.89 3.57 0.00 1.81 1.82 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 2.26 1.55 0.00 66 L 7.76 3.30 0.00 1.71 1.42 0.73 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 67 D 7.34 4.10 0.00 2.51 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 0.00 0.00 0.00 0.00 68 G 7.41 3.53 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 0.00 69 F 7.11 3.82 0.00 2.93 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 R 7.84 3.91 0.00 1.75 1.94 0.00 2.93 0.00 0.00 2.96 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.59 0.00 71 T 7.81 3.86 4.41 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 1.23 0.00 0.00 72 A 7.99 4.08 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 0.00 0.00 0.00 0.00 0.00 0.00 73 L 8.80 4.23 0.00 2.13 1.88 1.10 1.23 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 74 I 8.00 3.74 2.05 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 1.44 0.78 0.93 0.00 0.00 75 C 8.02 4.01 0.00 3.02 3.08 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 0.00 0.00 0.00 76 H 8.31 4.06 0.00 3.49 3.25 0.00 5.71 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 77 L 8.46 3.63 0.00 1.81 1.99 1.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 78 A 8.45 4.00 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 79 T 7.96 3.82 4.35 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 0.00 0.00 0.00 1.18 0.00 0.00 80 M 8.13 3.89 0.00 1.91 2.06 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.38 0.00 81 A 7.94 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 82 E 8.28 3.93 0.00 2.24 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.39 0.00 83 R 7.69 3.84 0.00 1.86 2.07 0.00 3.29 0.00 0.00 3.20 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 84 A 8.10 4.09 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 85 V 7.79 3.72 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 1.01 0.00 0.00 0.97 0.00 0.00 86 Q 8.03 4.07 0.00 2.20 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.79 0.00 0.00 0.00 0.00 0.00 2.36 2.58 0.00 87 L 7.54 4.41 0.00 1.76 1.66 0.89 0.97 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 88 G 8.14 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 89 G 7.38 4.08 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 0.00 0.00 0.00 0.00 0.00 0.00 90 V 8.03 4.23 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 0.85 0.00 0.00 0.93 0.00 0.00 91 A 8.69 4.20 1.24 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 0.00 0.00 0.00 92 L 9.71 4.69 0.00 1.62 1.61 0.92 0.80 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 93 G 8.39 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 T 7.87 4.29 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 1.22 0.00 0.00 95 T 8.48 3.89 4.26 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 1.24 0.00 0.00 96 Q 8.13 3.98 0.00 2.25 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.91 0.00 0.00 0.00 0.00 0.00 2.43 2.39 0.00 97 V 7.39 3.60 2.22 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 1.03 0.00 0.00 0.94 0.00 0.00 98 I 7.69 3.68 2.03 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 1.67 0.94 0.98 0.00 0.00 99 N 8.64 4.38 0.00 2.69 2.97 0.00 0.00 7.31 8.21 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 0.00 100 S 8.50 4.15 0.00 4.00 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 0.00 101 K 6.36 4.07 0.00 1.84 1.84 0.00 1.76 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.48 1.39 7.81 102 T 7.67 4.03 4.39 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 1.26 0.00 0.00 103 P 0.00 4.69 0.00 2.22 2.13 0.00 3.80 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.99 0.00 104 L 7.32 4.71 0.00 1.82 1.64 0.94 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 105 K 8.53 4.00 0.00 1.73 1.74 0.00 1.77 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.43 1.44 7.81 106 S 8.49 4.23 0.00 3.91 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 0.00 107 Y 8.53 4.16 0.00 3.05 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 0.00 108 P 0.00 4.29 0.00 1.72 1.84 0.00 2.20 0.00 0.00 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.87 0.00 109 L 8.58 4.70 0.00 1.69 1.75 0.98 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 110 D 7.88 4.88 0.00 2.76 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 0.00 111 I 7.64 4.34 1.79 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.36 0.80 0.00 0.00 112 H 8.70 4.93 0.00 3.30 3.41 0.00 6.13 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 N 8.16 4.64 0.00 2.79 2.95 0.00 0.00 6.75 7.71 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 0.00 114 V 8.28 3.70 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 0.89 0.00 0.00 1.12 0.00 0.00 115 Q 8.65 4.05 0.00 2.27 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.57 0.00 0.00 0.00 0.00 0.00 2.41 2.57 0.00 116 D 8.42 4.37 0.00 2.88 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 0.00 117 H 8.08 4.34 0.00 3.49 3.47 0.00 5.64 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 0.00 118 L 8.51 4.01 0.00 1.90 1.75 1.02 0.93 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 0.00 119 K 8.37 4.07 0.00 1.96 1.88 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.60 7.81 120 E 8.36 4.00 0.00 2.19 1.86 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 2.41 2.13 0.00 121 L 8.71 4.22 0.00 1.94 1.76 0.94 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 122 A 8.77 4.04 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 0.00 0.00 0.00 0.00 0.00 123 D 8.21 4.35 0.00 2.98 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 0.00 124 R 8.07 3.96 0.00 1.91 2.03 0.00 3.46 0.00 0.00 3.26 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.04 0.00 125 Y 8.94 3.71 0.00 3.26 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 0.00 126 A 8.34 4.19 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 0.00 127 I 7.91 3.61 2.02 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 0.67 0.90 0.00 0.00 128 V 7.61 3.47 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 0.66 0.00 0.00 0.76 0.00 0.00 129 A 8.74 3.90 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 0.00 130 N 8.49 4.26 0.00 2.76 2.87 0.00 0.00 6.75 7.69 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 0.00 131 D 8.13 4.30 0.00 2.84 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 V 8.08 3.89 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 1.01 0.00 0.00 1.02 0.00 0.00 133 R 7.84 3.87 0.00 1.94 2.15 0.00 3.23 0.00 0.00 3.31 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 134 K 7.92 4.08 0.00 2.06 1.83 0.00 1.74 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.45 1.62 7.81 135 A 8.27 4.08 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 0.00 136 I 7.31 3.75 1.96 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 1.43 0.86 0.89 0.00 0.00 137 G 8.35 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 0.00 138 E 7.56 4.11 0.00 2.02 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.25 0.00 139 A 7.47 4.42 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 0.00 140 K 8.56 4.06 0.00 1.91 1.98 0.00 1.71 0.00 0.00 1.62 0.00 0.00 3.05 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.43 1.47 7.81 141 D 7.94 4.43 0.00 2.72 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 0.00 142 D 8.84 4.39 0.00 2.71 2.71 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 0.00 143 D 8.20 4.35 0.00 2.84 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 0.00 144 T 7.76 3.80 4.35 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 0.00 0.00 0.00 1.17 0.00 0.00 145 A 8.17 3.95 1.35 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 0.00 0.00 0.00 0.00 0.00 0.00 146 D 8.23 4.23 0.00 2.70 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 0.00 147 I 7.91 3.68 1.99 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 1.49 1.00 0.84 0.00 0.00 148 L 7.84 4.01 0.00 1.86 1.68 0.91 0.54 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 0.00 149 T 8.00 3.81 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 1.18 0.00 0.00 150 A 8.06 3.95 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 0.00 151 A 7.83 3.38 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 0.00 152 S 8.46 3.92 0.00 3.88 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 0.00 153 R 8.32 3.78 0.00 2.01 1.96 0.00 3.09 0.00 0.00 3.12 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.63 0.00 154 D 7.53 3.82 0.00 2.55 1.81 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 0.00 155 L 7.60 3.61 0.00 1.70 1.57 0.62 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 156 D 8.29 4.26 0.00 2.71 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 0.00 157 K 7.58 4.02 0.00 1.73 1.70 0.00 1.63 0.00 0.00 1.67 0.00 0.00 2.66 0.00 0.00 2.89 0.00 0.00 0.00 0.00 0.92 1.39 7.81 158 F 7.96 3.74 0.00 2.80 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 0.00 0.00 0.00 159 L 8.01 3.94 0.00 1.91 1.92 1.09 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 160 W 8.39 4.44 0.00 3.40 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 0.00 161 F 8.11 4.04 0.00 3.17 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 0.00 162 I 8.65 3.88 1.96 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.45 0.90 0.00 0.00 163 E 8.62 3.98 0.00 2.32 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 2.39 2.53 0.00 164 S 8.48 4.38 0.00 3.56 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 0.00 165 N 7.64 4.71 0.00 2.76 2.80 0.00 0.00 7.01 8.74 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 0.00 166 I 7.53 4.20 2.01 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 1.37 0.72 0.98 0.00 0.00 167 E 8.96 4.18 0.00 2.10 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 2.50 2.25 0.00