NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.2318 8.3001 120.3496 55.5237 32.1754 174.6444 2 A 4.2987 8.2786 129.9849 49.7359 19.3712 174.5605 3 D 4.4248 8.9481 123.3561 54.5991 43.5465 173.6944 4 T 3.9964 8.5716 124.6978 66.5902 68.9300 174.0549 5 G 3.6536 7.1327 106.8621 43.9525 0.0000 172.0335 6 E 5.5970 8.1512 126.1541 56.1334 31.2261 173.7456 7 V 4.6699 8.5109 120.0156 59.5278 34.5480 174.8734 8 Q 5.3868 8.7915 122.4694 54.4212 32.0752 174.5274 9 F 4.9813 9.5272 123.9949 56.9368 43.4395 172.6949 10 M 5.3592 7.2680 120.4063 53.3273 34.0265 174.7174 11 K 4.5868 9.1008 121.9033 54.2286 35.8790 173.2907 12 P 5.0487 0.0000 0.0000 62.4189 32.3837 175.4642 13 F 4.7496 8.8200 122.4960 55.9302 41.7590 175.2216 14 I 4.7788 8.3386 123.6579 59.7081 37.9295 176.4063 15 S 4.3580 8.8017 121.1500 61.3919 61.8876 175.5035 16 E 3.9977 8.3094 120.9365 58.5934 29.6667 177.8438 17 K 4.4523 7.9967 117.0333 57.6792 32.4072 178.0066 18 S 5.5649 9.0993 114.5583 59.8307 62.1473 175.9234 19 S 4.3982 8.0664 116.3555 61.3760 62.4235 174.9427 20 K 4.7652 7.9292 115.2404 55.4904 34.6746 175.5378 21 S 5.0100 8.6324 112.9517 57.1133 66.8860 173.1479 22 L 4.6185 8.9622 125.6552 53.4730 43.2816 174.8170 23 E 4.7698 8.8287 125.2812 55.6010 30.8590 175.5927 24 I 4.2382 7.3922 123.6121 58.8041 38.6343 174.2666 25 P 4.1790 0.0000 0.0000 62.9340 32.1124 176.8893 26 L 3.9455 8.7825 124.2459 58.3592 41.8011 179.5858 27 G 3.7664 7.9764 103.9563 47.5375 0.0000 174.8373 28 F 4.2810 7.9829 122.2911 60.6091 39.5541 176.8579 29 N 3.6021 8.5844 117.2225 56.4870 38.5168 176.4847 30 E 3.8512 8.3158 119.5118 58.9880 29.6940 177.7378 31 Y 4.4467 7.4728 118.7926 58.5832 39.3287 174.9132 32 F 4.5021 7.2623 113.4916 53.9949 38.4697 171.8011 33 P 4.3101 0.0000 0.0000 62.2205 32.1590 175.9107 34 A 4.6837 7.9691 123.8863 49.7727 22.1201 174.2166 35 P 4.4965 0.0000 0.0000 62.2277 31.9572 176.2928 36 F 4.3403 8.8432 115.7461 56.2925 38.2781 173.4661 37 P 4.5276 0.0000 0.0000 61.8716 32.4305 176.0958 38 I 4.0922 8.1183 119.8373 63.6757 37.6503 175.8278 39 T 5.1528 7.4829 108.2481 59.9036 72.0439 172.5852 40 V 4.4757 9.1583 122.2843 61.2628 35.5354 173.6832 41 D 5.4468 8.2096 124.3811 52.5783 43.7168 175.0892 42 L 5.2109 9.2376 123.1938 53.1947 44.1848 175.3304 43 L 5.0137 9.2362 124.6172 53.2474 44.0895 174.9927 44 D 5.6763 9.1013 123.2417 52.3746 43.3616 176.7765 45 Y 4.2414 8.2224 120.3488 59.7280 38.0221 177.3209 46 S 4.2072 7.9619 114.1780 58.3582 62.6636 173.5042 47 G 3.6562 7.4104 107.2934 45.6297 0.0000 174.2982 48 R 4.3244 7.7615 119.9520 55.4240 32.0984 175.4942 49 S 5.2266 7.7184 114.5073 56.7138 66.3612 173.0543 50 W 4.7387 9.6503 123.2748 55.2343 31.7583 174.8339 51 T 4.8727 8.7542 121.9364 62.9916 68.6904 174.6002 52 V 4.6067 9.2142 120.3609 59.5324 35.5525 174.8080 53 R 4.8838 8.8251 123.6275 55.1837 31.5334 174.6249 54 M 5.3383 8.2788 125.9472 53.7425 35.1506 174.7835 55 K 4.7695 9.1435 123.9260 54.5399 36.8584 175.4729 56 K 4.5671 8.8909 125.1697 54.9208 32.6951 175.8685 57 R 4.3753 8.8261 129.3033 55.1065 31.1827 177.6311 58 G 3.9622 8.2852 118.9195 46.9282 0.0000 174.8090 59 E 4.1561 9.1598 125.1170 56.5244 30.1438 175.7112 60 K 4.4501 7.6396 117.3071 54.7845 34.0896 175.0642 61 V 4.8723 7.1891 110.8620 59.7218 36.1073 174.8035 62 F 5.1323 8.9681 121.2518 56.0137 43.7988 173.8777 63 L 4.6926 8.7883 124.0066 55.4507 42.3039 176.8702 64 T 4.3647 9.4425 118.1304 61.7454 67.6930 176.9790 65 V 3.8952 8.8014 118.3329 62.0466 33.4249 176.5521 66 G 4.1799 9.2688 112.5863 46.2988 0.0000 175.6895 67 W 4.3825 8.3312 129.3936 59.9825 30.4829 177.8343 68 E 3.8120 8.2688 117.2676 59.1610 29.0475 178.6878 69 N 4.3541 8.1629 117.7541 55.8024 38.4653 177.2260 70 F 2.4220 7.4914 121.9719 60.5080 39.6332 177.4510 71 V 3.1410 6.8828 118.7684 64.7093 30.7556 178.5054 72 K 3.8549 7.9212 119.6731 58.8773 31.7033 178.9894 73 D 4.4231 7.7685 117.7472 56.8819 41.3610 176.6987 74 N 4.0913 7.8158 116.2636 53.3958 39.0195 172.4361 75 N 4.0458 7.1569 118.9327 53.2364 36.9691 172.4986 76 L 4.8332 8.1403 122.4207 53.3502 43.6115 175.9441 77 E 4.6559 8.1555 116.6500 54.2562 32.8528 173.6665 78 D 5.5320 8.1103 117.7518 55.2187 41.1772 175.1152 79 G 3.7638 8.7368 115.9905 45.6703 0.0000 174.0979 80 K 4.6199 8.3106 120.1571 56.3005 33.6353 175.9155 81 Y 5.4352 8.7445 120.2400 56.3839 41.8892 174.6000 82 L 5.3428 9.2902 122.2944 53.1147 45.7869 175.2724 83 Q 5.0519 8.6901 121.1240 54.2461 31.3937 174.4946 84 F 5.1155 9.7483 123.6804 55.8210 41.5982 174.5039 85 I 4.8122 8.8339 125.8868 59.9519 39.1276 174.4645 86 Y 4.8961 9.2970 125.1539 58.0824 40.5461 174.6174 87 D 4.6371 8.8150 123.1065 55.1293 39.3578 178.3556 88 R 4.6449 8.9023 119.0274 57.4511 32.5778 173.0695 89 D 4.5765 7.8352 116.0054 53.5782 43.2352 175.2880 90 R 5.0180 8.7672 117.1808 56.9023 31.3194 175.7805 91 T 4.4895 8.2165 110.5709 60.3604 70.9416 173.0451 92 F 5.1360 8.7806 125.3622 55.7148 41.9755 173.9711 93 Y 5.0543 9.0288 122.2033 56.3875 39.3006 174.8276 94 V 4.7716 9.2574 125.1040 61.0777 34.3642 174.2155 95 I 4.8685 8.4499 128.0218 59.5745 39.9718 174.3392 96 I 4.7269 8.6362 127.1942 59.8829 39.0890 174.4510 97 Y 4.2143 8.9127 125.5165 57.1086 39.1320 175.7878 98 G 3.8208 9.4965 116.4690 45.4821 0.0000 173.3227 99 H 5.1098 8.1463 130.2864 56.4035 31.3509 173.7463 100 N 4.4412 7.6586 121.1053 53.6747 42.2387 173.7593 101 M 4.9222 7.9149 113.0008 53.3398 34.5543 174.7484 102 C 4.2954 8.6056 116.1823 60.2163 28.4408 173.7917 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 4.23 0.00 2.00 2.10 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.55 0.00 2 A 8.28 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 3 D 8.95 4.42 0.00 2.59 2.56 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 4 T 8.57 4.00 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 1.24 0.00 0.00 5 G 7.13 3.65 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 6 E 8.15 5.60 0.00 1.97 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 0.00 2.25 2.20 0.00 7 V 8.51 4.67 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 0.85 0.00 0.00 1.04 0.00 0.00 8 Q 8.79 5.39 0.00 1.96 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.86 6.75 0.00 0.00 0.00 0.00 0.00 2.31 2.38 0.00 9 F 9.53 4.98 0.00 2.58 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 10 M 7.27 5.36 0.00 2.05 1.97 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.13 0.00 11 K 9.10 4.59 0.00 2.12 2.05 0.00 1.43 0.00 0.00 1.69 0.00 0.00 2.85 0.00 0.00 2.57 0.00 0.00 0.00 0.00 0.85 0.55 7.81 12 P 0.00 5.05 0.00 2.04 2.20 0.00 3.69 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.29 0.00 13 F 8.82 4.75 0.00 3.18 3.15 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 0.00 14 I 8.34 4.78 1.96 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 1.34 0.67 1.00 0.00 0.00 15 S 8.80 4.36 0.00 4.02 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 16 E 8.31 4.00 0.00 2.04 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 2.33 2.43 0.00 17 K 8.00 4.45 0.00 1.94 1.92 0.00 1.78 0.00 0.00 1.78 0.00 0.00 2.95 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.49 1.52 7.81 18 S 9.10 5.56 0.00 4.49 4.16 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 0.00 0.00 0.00 19 S 8.07 4.40 0.00 4.12 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 0.00 20 K 7.93 4.77 0.00 1.79 1.86 0.00 1.75 0.00 0.00 1.75 0.00 0.00 2.97 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.39 1.52 7.81 21 S 8.63 5.01 0.00 3.93 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 22 L 8.96 4.62 0.00 0.27 1.01 0.03 0.91 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 23 E 8.83 4.77 0.00 2.08 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 0.00 2.25 2.26 0.00 24 I 7.39 4.24 1.75 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 1.18 0.96 1.00 0.00 0.00 25 P 0.00 4.18 0.00 2.02 2.02 0.00 3.40 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 2.08 2.16 0.00 26 L 8.78 3.95 0.00 1.65 1.63 0.89 0.99 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 27 G 7.98 3.77 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 0.00 0.00 0.00 28 F 7.98 4.28 0.00 2.63 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 29 N 8.58 3.60 0.00 2.64 2.76 0.00 0.00 6.60 7.76 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 30 E 8.32 3.85 0.00 1.96 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 2.28 2.25 0.00 31 Y 7.47 4.45 0.00 2.97 2.90 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 32 F 7.26 4.50 0.00 2.92 2.60 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 33 P 0.00 4.31 0.00 1.98 1.90 0.00 3.56 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.93 0.00 34 A 7.97 4.68 1.26 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 0.00 0.00 35 P 0.00 4.50 0.00 2.08 2.06 0.00 3.78 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.93 0.00 36 F 8.84 4.34 0.00 3.19 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 37 P 0.00 4.53 0.00 2.20 2.09 0.00 3.87 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.04 0.00 38 I 8.12 4.09 1.87 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 1.39 1.10 0.95 0.00 0.00 39 T 7.48 5.15 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 40 V 9.16 4.48 1.80 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 0.15 0.00 0.00 0.82 0.00 0.00 41 D 8.21 5.45 0.00 2.70 2.54 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 42 L 9.24 5.21 0.00 1.89 1.76 0.97 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 43 L 9.24 5.01 0.00 1.49 1.69 0.94 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 44 D 9.10 5.68 0.00 3.19 2.90 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 45 Y 8.22 4.24 0.00 3.18 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 46 S 7.96 4.21 0.00 3.46 3.84 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 47 G 7.41 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.76 4.32 0.00 1.40 0.82 0.00 3.02 0.00 0.00 2.98 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.45 0.00 49 S 7.72 5.23 0.00 3.82 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 50 W 9.65 4.74 0.00 3.49 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 51 T 8.75 4.87 4.29 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 1.24 0.00 0.00 52 V 9.21 4.61 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 1.19 0.00 0.00 0.98 0.00 0.00 53 R 8.83 4.88 0.00 1.94 2.01 0.00 3.08 0.00 0.00 3.15 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.80 0.00 54 M 8.28 5.34 0.00 1.93 1.82 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.66 0.00 55 K 9.14 4.77 0.00 1.83 1.69 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.98 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.40 1.51 7.81 56 K 8.89 4.57 0.00 1.69 1.76 0.00 1.58 0.00 0.00 1.76 0.00 0.00 2.59 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.27 1.42 7.81 57 R 8.83 4.38 0.00 1.90 1.88 0.00 3.34 0.00 0.00 3.20 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.54 0.00 58 G 8.29 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 59 E 9.16 4.16 0.00 1.87 1.94 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 2.23 2.30 0.00 60 K 7.64 4.45 0.00 1.55 1.75 0.00 1.47 0.00 0.00 1.87 0.00 0.00 2.88 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.45 1.31 7.81 61 V 7.19 4.87 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 0.76 0.00 0.00 0.74 0.00 0.00 62 F 8.97 5.13 0.00 2.93 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 63 L 8.79 4.69 0.00 1.46 1.61 0.91 0.40 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 64 T 9.44 4.36 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 1.26 0.00 0.00 65 V 8.80 3.90 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 0.86 0.00 0.00 1.05 0.00 0.00 66 G 9.27 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 67 W 8.33 4.38 0.00 3.37 3.41 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 68 E 8.27 3.81 0.00 2.26 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 2.41 2.42 0.00 69 N 8.16 4.35 0.00 3.20 3.20 0.00 0.00 6.65 7.76 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 70 F 7.49 2.42 0.00 2.34 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 0.00 0.00 0.00 71 V 6.88 3.14 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 0.68 0.00 0.00 0.84 0.00 0.00 72 K 7.92 3.85 0.00 1.78 1.83 0.00 1.62 0.00 0.00 1.49 0.00 0.00 2.87 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.51 1.54 7.81 73 D 7.77 4.42 0.00 2.77 3.04 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 74 N 7.82 4.09 0.00 1.48 1.91 0.00 0.00 6.82 7.24 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 75 N 7.16 4.05 0.00 2.83 2.72 0.00 0.00 6.90 7.62 0.00 0.00 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 L 8.14 4.83 0.00 1.72 1.47 0.88 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 77 E 8.16 4.66 0.00 2.10 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 2.23 2.26 0.00 78 D 8.11 5.53 0.00 2.69 2.66 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.74 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 0.00 0.00 0.00 80 K 8.31 4.62 0.00 1.96 1.80 0.00 1.62 0.00 0.00 1.83 0.00 0.00 3.07 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.46 1.73 7.81 81 Y 8.74 5.44 0.00 3.07 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 82 L 9.29 5.34 0.00 1.74 1.04 0.93 0.75 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 83 Q 8.69 5.05 0.00 1.83 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.76 0.00 0.00 0.00 0.00 0.00 2.37 2.48 0.00 84 F 9.75 5.12 0.00 2.85 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 0.00 0.00 0.00 0.00 85 I 8.83 4.81 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 1.21 0.68 0.88 0.00 0.00 86 Y 9.30 4.90 0.00 2.82 2.66 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.82 4.64 0.00 2.76 2.54 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 88 R 8.90 4.64 0.00 1.82 1.86 0.00 3.23 0.00 0.00 3.34 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.68 0.00 89 D 7.84 4.58 0.00 2.66 2.56 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 90 R 8.77 5.02 0.00 1.90 1.94 0.00 3.29 0.00 0.00 3.43 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.77 0.00 91 T 8.22 4.49 4.13 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 1.27 0.00 0.00 92 F 8.78 5.14 0.00 3.02 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 93 Y 9.03 5.05 0.00 2.96 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 94 V 9.26 4.77 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 0.69 0.00 0.00 0.95 0.00 0.00 95 I 8.45 4.87 1.60 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 0.99 0.24 0.22 0.00 0.00 96 I 8.64 4.73 1.96 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.56 0.93 0.00 0.00 97 Y 8.91 4.21 0.00 3.19 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 98 G 9.50 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 99 H 8.15 5.11 0.00 3.18 3.36 0.00 5.79 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 N 7.66 4.44 0.00 2.66 2.81 0.00 0.00 6.74 7.67 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 0.00 101 M 7.91 4.92 0.00 2.12 1.98 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.49 0.00 102 C 8.61 4.30 0.00 2.98 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