NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3081 8.3049 120.3237 53.7222 34.5904 175.2724 2 E 3.5774 8.2022 116.3536 56.7484 26.8700 173.7500 3 L 4.2231 7.4798 119.1522 54.8889 43.8749 178.4677 4 T 4.3330 8.8986 115.0495 60.2287 71.2975 174.0836 5 P 4.2676 0.0000 0.0000 65.7772 31.2956 179.1503 6 R 3.9353 7.9636 114.3623 59.3337 29.0950 178.6751 7 E 3.9590 7.6461 117.1811 59.1686 29.6328 179.1246 8 K 4.1294 7.9932 118.1855 59.2531 32.0527 178.9915 9 D 4.3339 8.3438 118.6528 57.3127 41.1630 178.4925 10 K 4.1146 8.1197 118.7628 59.1250 31.9974 179.2958 11 L 4.0605 7.6423 119.7168 57.3472 41.4357 179.2106 12 L 3.9921 7.8670 120.7807 57.9150 42.0710 178.7220 13 L 3.9542 7.7992 119.8859 58.0173 42.2328 178.3497 14 F 4.1244 8.4238 120.6742 61.8609 39.1951 177.2972 15 T 3.7754 8.1152 114.9300 66.4802 68.2239 176.5723 16 A 3.9457 8.1403 122.5483 55.1269 18.3082 179.5763 17 A 3.9440 8.0457 119.1256 54.9517 18.4852 179.8926 18 L 3.7248 7.3665 117.4833 57.6112 41.6623 179.7584 19 V 3.4994 7.4878 118.1323 65.9109 31.4445 177.9266 20 A 3.9313 7.6830 119.9883 55.0974 18.3056 178.9621 21 E 3.8154 8.2582 117.9692 59.7981 29.5178 179.4529 22 R 3.9543 7.8526 117.4635 59.2078 30.2020 179.3320 23 R 3.9307 7.8848 117.6009 58.9840 29.9907 178.7596 24 L 3.9320 8.2147 120.2379 58.1134 41.8676 178.8648 25 A 3.9739 7.7096 119.5295 55.2102 18.3595 179.4694 26 R 4.1057 7.5104 115.4419 57.5657 30.1419 177.7918 27 G 4.0121 7.9965 107.0572 45.0598 0.0000 173.3980 28 L 4.4437 7.3440 118.2025 53.6560 43.0345 176.6433 29 K 4.4972 8.3881 121.0697 55.4800 32.8723 177.0973 30 L 4.4462 8.9674 126.3438 55.0868 43.2463 176.9837 31 N 4.6482 9.0502 119.9854 52.1280 40.4113 174.4015 32 Y 4.1125 8.9169 118.2328 60.8764 38.8324 176.7444 33 P 3.9173 0.0000 0.0000 65.7792 31.4283 178.1271 34 E 3.9094 8.6454 118.4065 59.2324 29.4060 179.5054 35 S 4.0548 7.9764 115.1360 61.5606 62.9392 176.9258 36 V 3.4486 7.4584 120.6343 65.8101 31.1852 177.9210 37 A 3.9337 7.9177 120.4814 54.9379 18.2560 179.3001 38 L 3.8543 7.8903 118.7604 58.5211 42.3346 179.3508 39 I 3.7683 7.6484 119.5777 64.3614 37.1290 178.6190 40 S 4.1570 8.2028 115.8165 61.7165 62.8211 176.7264 41 A 4.0956 8.2598 123.4018 54.8391 18.0419 179.4322 42 F 4.0852 8.1481 118.9638 61.5845 39.4857 177.4241 43 I 3.5696 7.8003 118.8653 64.7114 37.0562 178.2866 44 M 3.9355 7.8869 119.0575 58.5217 31.7292 178.7418 45 E 4.0365 8.0772 118.3340 58.9468 29.5999 179.5370 46 G 3.3144 7.5787 105.7781 47.6309 0.0000 175.6625 47 A 3.2766 7.7155 123.3103 54.4945 17.9262 179.7033 48 R 3.7307 7.3001 116.0669 59.5819 30.1773 178.2743 49 D 4.4925 7.6730 118.0084 55.5091 40.7497 177.3729 50 G 4.0842 7.4569 106.6857 45.2262 0.0000 173.8425 51 K 4.2717 7.5950 118.5099 55.6203 33.0008 177.8210 52 S 4.5254 8.3574 116.4349 57.7725 65.4241 175.5868 53 V 3.5220 7.9982 121.3635 66.0669 30.9245 177.8023 54 A 4.0129 7.9794 119.9885 55.3822 18.1170 179.6298 55 S 4.0386 7.9533 112.9125 61.8983 62.9273 177.0018 56 L 4.1388 7.9379 121.2679 58.1213 41.1291 179.4554 57 M 4.1681 8.1332 117.8047 57.7737 32.0889 177.9249 58 E 4.2744 7.7113 119.0229 58.8332 30.2915 177.9976 59 E 4.2343 8.6571 119.0956 59.4592 29.3121 179.5948 60 G 3.7944 8.5194 105.2311 47.3913 0.0000 174.9256 61 R 4.5890 7.5238 119.1689 56.1561 30.1412 176.3263 62 H 4.8947 7.7162 114.8560 55.4902 30.0262 175.0465 63 V 3.5012 7.7975 121.1145 65.0091 31.5746 176.2607 64 L 4.9751 7.4867 116.8970 52.9348 45.1818 175.6366 65 T 4.6150 8.3882 111.2370 59.2884 71.1110 175.2558 66 R 3.8212 8.4028 121.8931 59.3515 29.9949 177.5067 67 E 4.3246 8.1132 112.8738 57.3250 30.1294 176.5875 68 Q 4.6384 8.3264 118.6029 55.9346 30.1792 175.2087 69 V 5.0590 7.3955 110.5529 59.3295 35.9230 175.3794 70 M 4.3217 8.9790 122.3361 55.0084 33.2343 175.9241 71 E 4.0569 8.5803 121.6008 57.7848 30.4640 176.9997 72 G 4.0733 8.9177 113.6895 45.7021 0.0000 175.7691 73 V 3.7481 7.6445 119.1941 65.5606 31.8018 176.2561 74 P 4.3296 0.0000 0.0000 65.6540 31.2722 178.1772 75 E 4.0879 7.7068 114.8965 58.7243 29.5152 177.5822 76 M 4.3050 7.8453 116.8612 56.1521 32.4545 176.7628 77 I 4.6567 7.3344 120.7229 58.3273 37.5434 173.8918 78 P 4.5231 0.0000 0.0000 65.1384 32.5517 176.1385 79 D 4.9129 7.1382 117.6311 52.9557 42.6925 175.4575 80 I 4.7311 8.4631 119.7372 59.6938 40.9979 174.6941 81 Q 5.6109 8.8320 124.3336 53.3182 32.2604 175.0397 82 V 4.5390 8.1056 119.6620 60.8927 34.5024 172.0670 83 E 5.4310 8.9645 120.9506 54.2677 32.8831 174.7289 84 A 4.5476 8.2831 121.8047 51.2480 23.2273 175.6461 85 T 4.3642 8.2879 116.2579 63.0150 69.0019 175.4427 86 F 4.3784 9.2276 126.8765 55.4512 40.3728 175.4322 87 P 4.3596 0.0000 0.0000 65.2593 31.0775 177.0223 88 D 4.7827 8.1923 116.7826 52.9443 40.1379 177.0332 89 G 3.8738 7.9732 108.5631 45.3509 0.0000 173.0497 90 S 5.2049 8.2304 114.3768 58.3314 63.1894 174.4845 91 K 4.6946 8.8408 122.1407 54.6707 36.8612 174.5123 92 L 4.8836 8.4485 124.2476 53.6316 43.8808 175.4862 93 V 4.4394 8.7870 126.3677 61.4382 33.9120 174.1124 94 T 4.9220 8.6025 124.2960 61.7726 70.9054 173.6262 95 V 4.2446 8.7943 127.6524 61.4248 33.2633 174.2072 96 H 4.5843 8.8735 125.8096 55.9010 28.1313 175.7632 97 N 4.1508 8.9727 120.3301 53.6054 36.4284 173.5852 98 P 4.4743 0.0000 0.0000 64.7657 32.1451 176.9011 99 I 4.6461 7.0576 118.3369 59.1973 38.9210 175.5249 100 I 4.1902 8.0887 117.6829 61.1476 37.5127 174.8120 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 1 M 8.30 4.31 0.00 2.00 2.18 0.00 0.00 0.00 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.55 0.00 2 E 8.20 3.58 0.00 2.12 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 2.22 2.45 0.00 3 L 7.48 4.22 0.00 1.62 1.60 0.89 0.96 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 4 T 8.90 4.33 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 5 P 0.00 4.27 0.00 2.18 2.15 0.00 3.60 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 2.11 2.15 0.00 6 R 7.96 3.94 0.00 2.04 2.19 0.00 2.97 0.00 0.00 3.34 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.72 0.00 7 E 7.65 3.96 0.00 2.14 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 2.31 2.33 0.00 8 K 7.99 4.13 0.00 1.99 1.85 0.00 1.66 0.00 0.00 1.57 0.00 0.00 2.88 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.55 7.81 9 D 8.34 4.33 0.00 2.91 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 10 K 8.12 4.11 0.00 1.97 1.85 0.00 1.74 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.59 1.62 7.81 11 L 7.64 4.06 0.00 1.88 1.75 0.90 0.28 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 12 L 7.87 3.99 0.00 1.76 1.98 0.93 0.53 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 13 L 7.80 3.95 0.00 1.82 1.88 0.92 0.90 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 14 F 8.42 4.12 0.00 3.16 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 T 8.12 3.78 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 1.22 0.00 0.00 16 A 8.14 3.95 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 17 A 8.05 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 18 L 7.37 3.72 0.00 1.75 1.59 0.83 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 19 V 7.49 3.50 2.19 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 0.98 0.00 0.00 0.92 0.00 0.00 20 A 7.68 3.93 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 21 E 8.26 3.82 0.00 2.18 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 2.28 2.34 0.00 22 R 7.85 3.95 0.00 2.05 1.94 0.00 3.25 0.00 0.00 3.14 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.71 0.00 23 R 7.88 3.93 0.00 1.98 1.96 0.00 3.16 0.00 0.00 3.13 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.79 0.00 24 L 8.21 3.93 0.00 1.79 1.80 0.90 1.17 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 25 A 7.71 3.97 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 26 R 7.51 4.11 0.00 1.93 2.00 0.00 3.12 0.00 0.00 3.22 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.81 0.00 27 G 8.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 L 7.34 4.44 0.00 1.66 1.60 0.91 0.62 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 29 K 8.39 4.50 0.00 1.64 1.74 0.00 1.75 0.00 0.00 1.81 0.00 0.00 2.93 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.41 1.46 7.81 30 L 8.97 4.45 0.00 1.57 1.56 0.89 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 31 N 9.05 4.65 0.00 2.87 3.00 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 32 Y 8.92 4.11 0.00 3.08 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 33 P 0.00 3.92 0.00 2.26 2.29 0.00 3.97 0.00 0.00 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.11 0.00 34 E 8.65 3.91 0.00 2.20 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 2.30 2.39 0.00 35 S 7.98 4.05 0.00 3.95 3.86 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 36 V 7.46 3.45 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 0.90 0.00 0.00 0.46 0.00 0.00 37 A 7.92 3.93 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 38 L 7.89 3.85 0.00 1.86 1.63 0.89 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 39 I 7.65 3.77 1.86 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 1.44 0.89 0.92 0.00 0.00 40 S 8.20 4.16 0.00 4.05 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 41 A 8.26 4.10 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 42 F 8.15 4.09 0.00 3.16 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 43 I 7.80 3.57 2.08 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.90 0.97 0.00 0.00 44 M 7.89 3.94 0.00 2.05 2.11 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.82 2.57 0.00 45 E 8.08 4.04 0.00 1.98 1.89 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 2.55 2.49 0.00 46 G 7.58 3.31 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 0.00 47 A 7.72 3.28 0.12 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 0.00 0.00 48 R 7.30 3.73 0.00 1.70 2.03 0.00 3.23 0.00 0.00 3.13 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.64 0.00 49 D 7.67 4.49 0.00 2.83 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 50 G 7.46 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 51 K 7.60 4.27 0.00 1.92 1.81 0.00 1.66 0.00 0.00 1.78 0.00 0.00 3.21 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.48 1.34 7.81 52 S 8.36 4.53 0.00 4.03 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 53 V 8.00 3.52 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 0.97 0.00 0.00 0.32 0.00 0.00 54 A 7.98 4.01 1.33 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 0.00 0.00 55 S 7.95 4.04 0.00 4.08 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 56 L 7.94 4.14 0.00 1.98 1.84 1.11 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 57 M 8.13 4.17 0.00 2.03 2.29 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.94 2.71 0.00 58 E 7.71 4.27 0.00 1.96 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 0.00 2.31 2.47 0.00 59 E 8.66 4.23 0.00 2.28 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 0.00 2.46 2.58 0.00 60 G 8.52 3.79 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 0.00 0.00 0.00 61 R 7.52 4.59 0.00 1.66 1.83 0.00 3.08 0.00 0.00 3.05 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.72 0.00 62 H 7.72 4.89 0.00 3.05 3.19 0.00 5.65 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 V 7.80 3.50 1.87 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 0.57 0.00 0.00 0.24 0.00 0.00 64 L 7.49 4.98 0.00 1.57 1.46 0.88 0.75 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 65 T 8.39 4.62 4.34 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 1.20 0.00 0.00 66 R 8.40 3.82 0.00 1.92 1.98 0.00 3.17 0.00 0.00 3.39 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.64 0.00 67 E 8.11 4.32 0.00 2.11 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.26 0.00 68 Q 8.33 4.64 0.00 2.09 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.97 6.71 0.00 0.00 0.00 0.00 0.00 2.26 2.29 0.00 69 V 7.40 5.06 2.18 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 0.67 0.00 0.00 1.00 0.00 0.00 70 M 8.98 4.32 0.00 1.95 2.01 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 2.92 2.50 0.00 71 E 8.58 4.06 0.00 1.93 1.85 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 2.29 2.31 0.00 72 G 8.92 4.07 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 0.00 0.00 0.00 73 V 7.64 3.75 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 1.03 0.00 0.00 1.03 0.00 0.00 74 P 0.00 4.33 0.00 2.22 2.25 0.00 3.61 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 2.12 2.13 0.00 75 E 7.71 4.09 0.00 2.14 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.33 0.00 76 M 7.85 4.30 0.00 1.77 2.27 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.37 0.00 77 I 7.33 4.66 1.93 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 1.59 1.36 0.98 0.00 0.00 78 P 0.00 4.52 0.00 2.14 2.33 0.00 3.88 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 2.11 1.99 0.00 79 D 7.14 4.91 0.00 2.67 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 80 I 8.46 4.73 1.87 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 1.22 0.72 0.92 0.00 0.00 81 Q 8.83 5.61 0.00 1.89 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.68 0.00 0.00 0.00 0.00 0.00 2.23 2.15 0.00 82 V 8.11 4.54 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 0.67 0.00 0.00 0.95 0.00 0.00 83 E 8.96 5.43 0.00 1.87 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 2.24 2.15 0.00 84 A 8.28 4.55 1.03 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 0.00 0.00 85 T 8.29 4.36 4.20 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 0.00 0.00 0.00 1.22 0.00 0.00 86 F 9.23 4.38 0.00 3.25 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 87 P 0.00 4.36 0.00 2.09 2.15 0.00 3.87 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 2.09 2.10 0.00 88 D 8.19 4.78 0.00 2.78 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 89 G 7.97 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 0.00 0.00 0.00 90 S 8.23 5.20 0.00 3.81 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 91 K 8.84 4.69 0.00 1.10 1.31 0.00 1.48 0.00 0.00 1.65 0.00 0.00 2.81 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.49 0.76 7.81 92 L 8.45 4.88 0.00 1.87 1.55 0.94 0.88 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 93 V 8.79 4.44 2.18 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 1.00 0.00 0.00 1.16 0.00 0.00 94 T 8.60 4.92 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 1.02 0.00 0.00 95 V 8.79 4.24 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.98 0.00 0.00 96 H 8.87 4.58 0.00 3.10 3.22 0.00 5.90 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 N 8.97 4.15 0.00 2.81 2.80 0.00 0.00 6.47 7.87 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 98 P 0.00 4.47 0.00 2.19 2.30 0.00 3.82 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.00 0.00 99 I 7.06 4.65 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.63 0.88 0.00 0.00 100 I 8.09 4.19 1.87 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 1.25 0.62 0.91 0.00 0.00