NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 17 K 4.2354 8.1685 119.9921 56.3144 34.3224 176.2729 18 A 3.7887 8.3892 120.0264 54.9200 18.0176 178.3472 19 Q 3.9050 8.1504 116.3176 59.1452 29.4250 176.7401 20 Q 3.9188 8.0750 120.1018 59.3317 28.9360 178.0470 21 E 3.8922 8.1675 120.2177 59.2102 29.6594 178.6314 22 E 4.2175 8.1635 120.0935 58.7218 29.4022 179.4888 23 R 3.8959 8.1616 118.3087 59.3860 30.1936 179.1257 24 L 3.7883 7.6957 118.4505 57.7489 41.3812 179.4978 25 E 4.1865 8.5430 119.1658 59.1729 29.3539 179.5769 26 G 3.7543 8.5620 106.2288 47.9627 0.0000 175.8718 27 I 3.9207 8.0389 122.5168 64.0026 37.0274 178.2724 28 N 4.3942 8.7258 117.8157 56.4724 38.2425 177.4617 29 K 3.9754 8.3200 118.7627 59.4553 32.5142 178.7118 30 Q 4.1709 8.2503 119.7279 59.5628 28.9169 178.7786 31 F 4.0697 8.7845 118.7121 60.0838 38.6681 176.8797 32 L 4.4527 8.1774 116.6710 55.8209 41.5238 176.9125 33 D 4.8633 7.8167 117.2014 53.8094 43.2612 175.8079 34 D 4.4235 7.7691 120.8814 53.2348 41.8646 174.8101 35 P 4.2494 0.0000 0.0000 65.7336 31.4466 178.1295 36 K 3.8714 7.9789 114.8766 57.7513 31.8630 176.3238 37 Y 4.9134 8.0030 112.9890 57.8133 40.3332 177.0353 38 S 4.2145 7.6059 113.4290 61.0294 62.4807 174.3957 39 N 4.6113 8.1446 115.1949 53.3986 38.5286 173.8010 40 D 4.8344 8.1510 120.3946 52.2806 41.8354 176.6161 41 E 4.2451 8.8550 124.6981 57.8938 30.1996 176.8700 42 D 4.8425 9.2579 119.5601 53.7270 42.5944 177.4436 43 L 3.9268 7.9903 122.4554 58.0390 41.7797 177.0312 44 P 4.2702 0.0000 0.0000 65.8978 31.4470 178.8265 45 S 4.1317 7.9809 113.3090 61.3063 62.7921 176.6428 46 K 3.6575 8.5471 121.5202 59.4934 31.8431 179.2259 47 L 4.1778 8.2307 119.4339 58.0098 41.6256 179.5898 48 E 3.9752 8.0387 118.3254 59.4085 29.5533 179.3137 49 A 4.0108 7.8444 120.4999 55.1306 18.3254 179.7542 50 F 4.7461 8.5746 116.8247 60.3590 38.9446 177.9365 51 K 3.9231 8.3631 119.6827 59.4355 31.8259 178.8182 52 V 3.5114 7.3980 116.6197 65.9515 31.6924 177.5231 53 K 4.0890 7.9647 118.6695 59.8195 32.2301 177.9531 54 Y 3.6778 8.3020 119.9063 60.9103 38.3929 177.9483 55 M 4.0788 7.7753 118.2251 57.5527 32.0625 177.6581 56 E 4.0915 7.7267 117.8157 56.6229 30.1067 176.8042 57 F 4.5650 6.5824 117.5367 56.6555 39.6574 175.3256 58 D 4.4576 8.5444 122.3080 54.1389 39.9388 175.6020 59 L 4.7360 8.0127 126.1735 52.9659 43.8091 176.2632 60 N 4.7666 8.7652 119.1662 51.2795 38.7665 176.3920 61 G 3.5564 8.5934 107.1870 47.9114 0.0000 173.5908 62 N 4.5584 8.3983 116.3654 53.1620 39.3410 175.2812 63 G 3.9565 9.0135 105.7194 46.3967 0.0000 172.7836 64 D 5.5203 8.6154 119.4237 51.6722 44.6685 175.3643 65 I 4.4326 8.3846 121.4287 60.1573 38.4190 175.8558 66 D 4.9299 8.6294 127.1042 52.6845 40.7585 177.1819 67 I 3.6586 8.5074 119.5838 64.8039 37.8575 178.1231 68 M 4.0643 7.9928 118.9834 58.3183 31.8239 178.5246 69 S 4.0777 8.6467 113.6607 61.1059 62.5349 175.9265 70 L 3.8184 7.9171 123.1599 57.9236 41.8481 178.8230 71 K 3.8599 8.2663 119.8548 59.3731 32.0666 178.6461 72 R 3.8603 7.8698 118.7638 59.7214 30.0537 178.3010 73 M 4.0283 7.9240 118.2919 58.6080 31.9443 178.8537 74 L 4.0218 8.0242 118.9590 57.8176 41.7508 179.5434 75 E 3.9974 8.3218 118.6691 59.2243 29.2161 179.3726 76 K 4.1400 8.0724 117.5369 58.5689 32.2059 178.3879 77 L 4.4451 7.7022 117.3776 54.3584 41.8223 177.3256 78 G 3.9000 7.9223 107.1728 45.8187 0.0000 174.7984 79 V 4.3983 7.7341 118.1526 59.6668 31.1163 173.3098 80 P 4.4252 0.0000 0.0000 62.5522 32.2674 176.9988 81 K 4.7343 8.1515 119.5755 53.9517 36.1698 176.9888 82 T 4.1970 8.9813 114.1101 61.2686 70.8991 175.1550 83 H 4.0080 8.7766 120.8163 59.6724 29.6867 176.8145 84 L 3.9167 7.9524 121.1470 58.3556 41.9379 178.5381 85 E 3.9315 8.2443 118.3350 59.5887 29.3998 179.4503 86 L 4.0289 8.1196 118.8757 57.2299 41.6408 179.6867 87 K 4.1531 7.7817 120.0143 59.1605 31.8398 179.5302 88 R 4.0431 7.9045 116.8979 59.1301 29.6823 179.0268 89 L 4.1176 7.7962 118.7657 57.9164 41.6837 179.5000 90 I 3.7839 8.2368 120.0810 64.3360 36.7805 178.3497 91 R 3.9008 8.2621 119.0830 59.6301 29.9578 178.1004 92 E 4.2015 7.8408 115.6802 58.0098 29.6533 177.7784 93 V 4.3243 7.7435 109.2527 60.8816 33.4439 175.3615 94 S 5.6386 8.4008 114.2574 56.3639 63.6140 173.7046 95 S 4.6828 8.8428 117.6214 58.0402 64.2817 174.1990 96 G 4.4015 7.8747 112.0194 44.2397 0.0000 173.1880 97 S 4.3507 8.4476 114.6537 58.2738 63.4489 174.3787 98 E 4.4250 8.6862 117.3030 57.2607 29.8391 177.0746 99 E 4.8275 8.0338 118.8671 56.5448 30.8821 175.3412 100 T 5.1763 7.7903 108.1894 60.0402 72.4387 173.6637 101 F 5.0642 9.6036 127.2364 56.5337 41.0589 175.1679 102 S 4.9266 8.7696 121.1486 56.6649 64.4009 175.1187 103 Y 2.9769 8.2928 120.7827 60.3788 38.2812 177.9024 104 S 3.6780 7.7679 114.7366 61.3165 63.2131 175.9602 105 D 4.2137 7.8202 122.5111 56.8859 40.5154 178.3944 106 F 3.8026 7.5228 121.3116 61.1627 39.3067 177.1738 107 L 3.1248 7.4042 118.6115 57.6373 41.0547 179.6132 108 R 4.0683 7.8437 116.8661 59.5274 30.0541 178.5458 109 M 4.1570 7.7387 116.8908 59.0035 32.3810 177.9513 110 M 3.9828 7.2324 117.4917 57.3855 32.2425 176.8200 111 L 4.2084 7.6123 118.4418 53.8881 42.7442 173.7594 112 G 3.7815 9.4689 104.1707 44.8375 0.0000 172.7418 113 K 4.4505 8.2065 116.5965 54.8137 32.9522 176.8137 114 R 3.4811 9.0551 122.2783 59.1575 29.0161 178.6238 115 S 4.2140 8.1170 114.2473 60.9664 63.2323 175.4516 116 A 4.2505 8.8424 124.6435 53.6428 18.0767 178.9902 117 I 3.7196 7.7815 117.9793 63.9027 38.1535 177.8261 118 L 4.0560 7.9004 119.4152 57.5872 41.4963 179.4633 119 R 4.1040 7.9360 117.6489 58.9612 29.9782 178.5493 120 M 4.3565 8.1954 118.7645 57.4642 31.9113 177.9434 121 I 4.0479 7.7469 112.7560 62.8023 37.5433 177.9192 122 L 4.1427 7.7754 120.5909 57.8816 41.5023 178.4240 123 M 4.3294 7.9599 117.0820 55.9295 32.5058 176.2051 124 Y 4.0957 7.4372 121.3334 57.2676 39.4916 174.9831 125 E 4.2908 7.0950 123.9243 54.1601 32.2067 174.6901 126 E 3.9171 8.4986 124.9391 55.8444 30.5403 176.4548 127 K 4.1351 8.4571 123.4304 56.6408 32.3093 176.5440 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 17 K 8.17 4.24 0.00 1.94 2.03 0.00 1.47 0.00 0.00 1.81 0.00 0.00 2.95 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.37 1.59 7.81 18 A 8.39 3.79 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 19 Q 8.15 3.91 0.00 2.07 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.81 0.00 0.00 0.00 0.00 0.00 2.44 2.35 0.00 20 Q 8.08 3.92 0.00 2.14 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.92 0.00 0.00 0.00 0.00 0.00 2.41 2.46 0.00 21 E 8.17 3.89 0.00 2.14 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 2.26 2.29 0.00 22 E 8.16 4.22 0.00 2.16 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 2.32 2.51 0.00 23 R 8.16 3.90 0.00 1.99 1.97 0.00 3.13 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.89 0.00 24 L 7.70 3.79 0.00 1.60 1.00 0.62 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 25 E 8.54 4.19 0.00 2.16 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 2.32 2.55 0.00 26 G 8.56 3.75 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 0.00 0.00 0.00 27 I 8.04 3.92 2.28 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.91 1.06 0.00 0.00 28 N 8.73 4.39 0.00 2.95 2.94 0.00 0.00 7.00 7.58 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 29 K 8.32 3.98 0.00 1.90 1.93 0.00 1.74 0.00 0.00 1.66 0.00 0.00 3.00 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.52 1.66 7.81 30 Q 8.25 4.17 0.00 2.21 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.80 0.00 0.00 0.00 0.00 0.00 2.32 2.41 0.00 31 F 8.78 4.07 0.00 3.18 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 32 L 8.18 4.45 0.00 1.86 1.77 0.99 1.02 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 33 D 7.82 4.86 0.00 2.82 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 34 D 7.77 4.42 0.00 2.52 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 35 P 0.00 4.25 0.00 2.14 2.05 0.00 3.58 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.06 0.00 36 K 7.98 3.87 0.00 1.39 1.20 0.00 1.52 0.00 0.00 1.28 0.00 0.00 2.82 0.00 0.00 2.88 0.00 0.00 0.00 0.00 0.81 1.13 7.81 37 Y 8.00 4.91 0.00 3.09 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 S 7.61 4.21 0.00 3.98 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 39 N 8.14 4.61 0.00 2.77 2.84 0.00 0.00 6.73 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 40 D 8.15 4.83 0.00 2.78 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 41 E 8.86 4.25 0.00 2.13 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 2.29 2.28 0.00 42 D 9.26 4.84 0.00 2.84 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 43 L 7.99 3.93 0.00 1.78 1.83 0.92 1.11 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 44 P 0.00 4.27 0.00 2.21 2.11 0.00 3.60 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.22 0.00 45 S 7.98 4.13 0.00 3.96 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 46 K 8.55 3.66 0.00 1.92 1.85 0.00 1.83 0.00 0.00 1.76 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.35 1.61 7.81 47 L 8.23 4.18 0.00 1.85 1.98 0.97 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 48 E 8.04 3.98 0.00 2.08 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 2.46 2.47 0.00 49 A 7.84 4.01 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 F 8.57 4.75 0.00 3.20 3.34 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 51 K 8.36 3.92 0.00 2.05 2.06 0.00 1.57 0.00 0.00 1.54 0.00 0.00 2.88 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.35 1.20 7.81 52 V 7.40 3.51 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.99 0.00 0.00 53 K 7.96 4.09 0.00 2.05 2.20 0.00 1.37 0.00 0.00 1.58 0.00 0.00 3.15 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.73 1.35 7.81 54 Y 8.30 3.68 0.00 3.13 2.98 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 55 M 7.78 4.08 0.00 1.97 2.24 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.84 0.00 56 E 7.73 4.09 0.00 1.56 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 2.18 2.33 0.00 57 F 6.58 4.57 0.00 2.75 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 58 D 8.54 4.46 0.00 2.63 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 59 L 8.01 4.74 0.00 1.63 1.55 0.89 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 60 N 8.77 4.77 0.00 2.93 2.97 0.00 0.00 7.18 6.84 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 61 G 8.59 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 N 8.40 4.56 0.00 2.71 2.97 0.00 0.00 7.11 7.98 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 63 G 9.01 3.96 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 0.00 0.00 0.00 64 D 8.62 5.52 0.00 2.63 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 65 I 8.38 4.43 2.13 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.62 0.83 0.00 0.00 66 D 8.63 4.93 0.00 2.82 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 67 I 8.51 3.66 1.96 0.00 0.00 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 1.48 1.52 0.95 0.00 0.00 68 M 7.99 4.06 0.00 2.07 2.11 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.57 0.00 69 S 8.65 4.08 0.00 3.92 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 70 L 7.92 3.82 0.00 1.88 1.67 0.67 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 71 K 8.27 3.86 0.00 1.94 1.96 0.00 1.72 0.00 0.00 1.59 0.00 0.00 3.04 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.53 1.59 7.81 72 R 7.87 3.86 0.00 2.03 2.08 0.00 3.15 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 73 M 7.92 4.03 0.00 2.09 2.14 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.59 0.00 74 L 8.02 4.02 0.00 1.65 1.91 0.83 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 75 E 8.32 4.00 0.00 2.17 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 2.32 2.60 0.00 76 K 8.07 4.14 0.00 1.93 1.88 0.00 1.70 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.57 7.81 77 L 7.70 4.45 0.00 1.78 1.71 0.95 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 78 G 7.92 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 79 V 7.73 4.40 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 0.84 0.00 0.00 0.93 0.00 0.00 80 P 0.00 4.43 0.00 2.21 2.03 0.00 3.83 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.98 0.00 81 K 8.15 4.73 0.00 1.66 1.65 0.00 1.74 0.00 0.00 1.88 0.00 0.00 3.00 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.30 1.31 7.81 82 T 8.98 4.20 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 1.25 0.00 0.00 83 H 8.78 4.01 0.00 3.25 3.37 0.00 5.88 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 84 L 7.95 3.92 0.00 1.81 1.66 0.92 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 85 E 8.24 3.93 0.00 2.30 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 86 L 8.12 4.03 0.00 1.77 1.63 0.87 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 87 K 7.78 4.15 0.00 1.98 1.83 0.00 1.65 0.00 0.00 1.91 0.00 0.00 2.92 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.38 1.32 7.81 88 R 7.90 4.04 0.00 1.92 1.99 0.00 3.16 0.00 0.00 3.22 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.88 0.00 89 L 7.80 4.12 0.00 1.88 1.62 0.85 0.79 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 90 I 8.24 3.78 2.04 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.73 1.07 0.00 0.00 91 R 8.26 3.90 0.00 1.94 1.98 0.00 3.49 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 1.66 1.70 0.00 92 E 7.84 4.20 0.00 2.03 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 2.61 2.49 0.00 93 V 7.74 4.32 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 0.74 0.00 0.00 1.19 0.00 0.00 94 S 8.40 5.64 0.00 3.99 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 95 S 8.84 4.68 0.00 4.01 3.96 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 96 G 7.87 4.40 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 0.00 97 S 8.45 4.35 0.00 4.04 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 98 E 8.69 4.43 0.00 2.34 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.33 0.00 99 E 8.03 4.83 0.00 1.93 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 2.25 2.23 0.00 100 T 7.79 5.18 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 0.00 101 F 9.60 5.06 0.00 3.03 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 0.00 102 S 8.77 4.93 0.00 4.12 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 0.00 103 Y 8.29 2.98 0.00 2.06 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 0.00 104 S 7.77 3.68 0.00 4.26 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 0.00 105 D 7.82 4.21 0.00 2.19 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 0.00 106 F 7.52 3.80 0.00 2.66 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 0.00 107 L 7.40 3.12 0.00 0.81 0.59 -0.37 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 108 R 7.84 4.07 0.00 1.88 2.09 0.00 3.24 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 1.98 2.07 0.00 109 M 7.74 4.16 0.00 2.27 2.23 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.48 0.00 110 M 7.23 3.98 0.00 0.97 0.71 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 1.05 1.74 0.00 111 L 7.61 4.21 0.00 1.61 1.72 0.32 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 112 G 9.47 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 0.00 0.00 0.00 113 K 8.21 4.45 0.00 1.99 1.94 0.00 1.55 0.00 0.00 1.88 0.00 0.00 3.11 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.51 1.52 7.81 114 R 9.06 3.48 0.00 2.07 2.30 0.00 2.98 0.00 0.00 3.41 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.73 0.00 115 S 8.12 4.21 0.00 4.08 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 0.00 116 A 8.84 4.25 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 0.00 117 I 7.78 3.72 2.02 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.59 0.95 0.00 0.00 118 L 7.90 4.06 0.00 1.85 1.72 0.93 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 119 R 7.94 4.10 0.00 2.09 2.05 0.00 3.16 0.00 0.00 3.19 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.78 0.00 120 M 8.20 4.36 0.00 2.02 2.25 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.50 0.00 121 I 7.75 4.05 1.90 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 1.82 0.76 0.89 0.00 0.00 122 L 7.78 4.14 0.00 1.84 1.88 0.99 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 123 M 7.96 4.33 0.00 2.10 2.26 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.91 2.74 0.00 124 Y 7.44 4.10 0.00 2.97 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 0.00 125 E 7.09 4.29 0.00 1.89 1.71 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 1.92 2.05 0.00 126 E 8.50 3.92 0.00 2.07 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 2.35 2.42 0.00 127 K 8.46 4.14 0.00 1.74 1.67 0.00 1.68 0.00 0.00 1.64 0.00 0.00 3.02 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.35 1.43 7.81