NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3997 8.2893 120.3510 55.3992 33.1626 174.3741 2 E 4.8437 8.5790 123.7474 54.0340 32.8440 173.5533 3 A 4.7829 8.6291 121.8033 50.0003 23.0026 176.4988 4 K 4.9606 8.9451 118.9985 54.3400 35.7003 174.0486 5 A 4.4067 8.3021 118.2186 51.4728 20.5566 172.9155 6 I 3.0868 7.7604 121.9516 60.6337 37.2973 173.3940 7 A 4.5875 8.7929 128.7252 50.2701 20.1364 175.3952 8 R 4.2298 8.4266 121.6613 57.0462 31.3520 176.0232 9 Y 3.6018 8.1741 116.3098 59.2820 35.2227 171.8668 10 V 3.4538 8.0567 121.3741 64.0135 32.1751 175.2745 11 R 3.8956 7.7106 117.0789 57.0132 27.9045 174.6615 12 I 4.6519 6.9884 114.4867 58.8301 41.9285 173.6506 13 S 4.3199 8.5215 118.2755 57.2988 62.7595 172.4633 14 P 4.0507 0.0000 0.0000 66.1525 31.2917 178.0688 15 R 3.9105 8.1148 116.7542 59.7601 29.6417 178.9229 16 K 4.0711 8.2871 118.3076 59.7208 32.1516 179.7922 17 V 3.8028 7.7719 111.9569 63.7770 31.5528 178.4388 18 R 3.9236 8.6372 118.6753 59.6370 29.7530 178.5040 19 L 3.9463 7.1864 116.0833 58.1207 41.8944 179.8632 20 V 3.8525 7.1999 118.3854 64.4524 31.6819 178.2079 21 V 3.5502 8.2056 119.3295 66.2629 31.3633 177.7050 22 D 4.4386 8.5484 118.6027 57.2101 40.3514 178.5542 23 L 4.1764 8.0926 120.8224 56.8795 41.9990 177.3974 24 I 4.4220 7.6039 110.0997 60.0384 38.0820 174.8012 25 R 3.9229 7.5447 121.7107 57.9555 30.0061 176.6051 26 G 4.0673 8.7631 113.0375 45.6537 0.0000 172.7758 27 K 4.6928 7.5392 117.7905 53.6754 34.4808 175.8649 28 S 4.1817 8.6631 116.5085 59.1514 64.1888 175.4328 29 L 3.8688 8.8388 126.4731 58.5316 41.3806 178.9172 30 E 3.8778 8.2084 118.6876 59.3829 29.6692 178.1860 31 E 3.9430 8.8479 119.2623 59.1043 29.7576 178.6313 32 A 3.9870 8.2836 121.0505 55.3304 18.4051 179.8165 33 R 3.8713 7.9296 116.3478 59.5207 29.9530 179.0546 34 N 4.4317 7.6530 114.5963 56.7122 38.8769 176.9911 35 I 3.8196 8.4062 121.3597 64.3143 37.1779 178.0036 36 L 3.9402 8.2028 119.2801 58.2975 41.4576 179.6364 37 R 3.7256 7.8095 117.1991 59.0005 29.8620 176.5055 38 Y 4.6651 7.6553 112.5310 57.7809 38.8143 175.1684 39 T 4.2981 7.7538 117.9303 62.9903 69.3495 175.7601 40 N 4.7246 8.5182 127.4233 51.5464 37.6784 173.6454 41 K 4.6577 7.4697 119.3030 54.3598 37.0943 177.2087 42 R 3.8502 8.9853 122.8749 59.6264 30.4060 178.7297 43 G 3.8764 8.4108 103.8427 47.9594 0.0000 174.5295 44 A 3.9679 8.1296 122.5316 56.1878 18.3195 178.5394 45 Y 3.8046 8.1393 112.4296 61.2616 38.6325 178.9680 46 F 3.9875 7.4245 116.5307 60.7742 39.8354 177.7164 47 V 3.5371 8.2668 117.1854 66.1937 31.3480 177.6493 48 A 3.8806 8.1573 120.6917 55.3305 18.1200 179.0912 49 K 3.6083 7.8600 117.7463 59.9263 32.0979 179.2280 50 V 3.5680 7.5686 118.6066 64.4087 31.4333 177.5892 51 L 3.8332 8.2613 121.6109 58.1351 41.7851 178.6309 52 E 3.8330 8.4775 119.0302 59.5054 29.6841 178.3852 53 S 4.0181 8.1590 112.8652 61.5766 62.1911 176.1878 54 A 3.8792 8.3893 123.2736 55.1091 18.2215 179.0758 55 A 3.9136 7.8133 118.5677 56.2768 18.3567 178.7805 56 A 3.8662 8.4128 118.1374 55.2814 18.0868 179.3826 57 N 4.1491 8.7349 111.5727 56.9393 39.0308 177.0250 58 A 3.8086 8.7866 119.5611 56.6196 18.3592 179.3615 59 V 3.5315 8.4956 114.0160 65.8953 31.5564 177.9711 60 N 4.2375 8.4410 118.1920 56.8118 39.1764 176.2980 61 N 4.7650 8.6661 115.1699 53.4258 39.7081 175.1180 62 H 4.7427 8.1505 117.4121 57.3922 29.8691 174.8486 63 D 4.3631 7.3283 113.1081 55.0705 37.5676 172.8408 64 M 4.4324 8.3120 128.0689 55.1841 35.1263 175.2769 65 L 3.9251 8.2174 117.9751 54.8042 38.6816 173.7078 66 E 3.9201 8.8237 124.4816 59.3800 29.6616 179.2605 67 D 4.5018 8.1600 116.4451 56.8088 41.2066 177.0682 68 R 4.7064 8.6255 117.0373 55.4518 31.5583 175.5576 69 L 5.5110 7.8353 119.1195 54.3084 43.8598 175.1816 70 Y 5.4059 9.0126 118.1009 55.9445 42.4320 174.2782 71 V 4.1495 7.9212 118.9736 61.3092 30.7871 176.5232 72 K 3.5079 7.9984 126.6884 58.5386 32.0109 175.7560 73 A 4.9384 8.0266 118.8690 50.6146 23.2525 173.7675 74 A 4.7647 7.9327 118.5160 51.2915 22.1856 175.4507 75 Y 4.6756 7.6574 115.9497 56.6361 41.6216 173.0739 76 V 5.0332 8.7525 113.7667 59.8197 34.9273 174.7097 77 D 5.0850 8.5225 122.7155 52.2122 44.3683 175.3802 78 E 4.3151 8.8213 122.5847 56.4577 30.7576 175.6371 79 G 4.1167 8.3046 110.9848 43.4025 0.0000 169.8323 80 P 4.3154 0.0000 0.0000 62.6850 31.1277 176.0757 81 A 4.1855 8.4918 125.3235 51.9597 19.5634 176.2932 82 L 4.5415 9.0561 120.8203 53.1888 43.5850 175.8572 83 K 4.8623 8.6161 124.2347 55.2706 33.4408 176.5387 84 R 4.6923 9.0511 124.1496 53.9004 34.2184 175.0702 85 V 4.0788 8.5601 123.5884 63.0180 32.4367 174.7233 86 L 4.6230 8.8412 130.9057 52.5851 43.5914 173.7878 87 P 4.7091 0.0000 0.0000 62.8554 32.1670 175.7773 88 R 4.7766 8.3524 121.4700 54.1427 34.5179 174.0856 89 A 4.2420 8.6866 124.6591 53.1081 18.8141 177.3758 90 R 3.8553 9.4769 115.4091 56.8337 28.1262 176.7189 91 G 3.8732 7.3537 101.1077 46.8797 0.0000 175.9032 92 R 3.8408 7.8587 119.7311 58.3375 30.7258 173.3610 93 A 3.6404 7.9818 130.2065 52.0665 15.1114 176.6211 94 D 4.9827 9.2219 122.8244 53.5264 44.1260 175.4262 95 I 4.9376 8.0041 112.1794 59.4021 39.7363 174.8635 96 I 4.1742 9.0344 128.4578 59.9079 39.7154 174.7393 97 K 4.8944 8.4457 128.2558 54.4518 33.3359 176.1500 98 K 4.0979 8.8897 126.3696 56.6655 32.7297 177.6494 99 R 4.6320 8.4074 124.7002 55.5045 32.4073 175.7292 100 T 4.6932 8.0657 112.9109 61.0706 71.0120 172.7244 101 S 5.0724 8.6833 123.2219 57.3465 66.8529 172.8828 102 H 5.2540 8.7583 118.2694 54.0330 30.7243 172.6347 103 I 4.2680 8.3014 124.0626 61.1637 38.7477 175.2534 104 T 4.6868 8.4961 121.9489 61.6618 72.5464 173.0453 105 V 4.5320 8.1853 125.1848 60.8723 35.1028 173.7407 106 I 4.6116 8.5383 122.0574 59.1332 39.8397 174.5912 107 L 4.6795 8.9462 127.9941 53.4578 43.8023 176.0363 108 G 4.5245 8.2251 108.8008 44.5566 0.0000 170.7067 109 E 4.9461 8.7353 118.5062 54.9367 31.0467 175.6383 110 K 3.8817 9.5637 127.4050 57.6343 31.6353 178.8990 111 H 4.8212 8.5303 118.8753 54.7419 31.9781 172.2926 112 G 4.0845 7.8876 118.9975 46.3431 0.0000 173.5311 113 K 4.2026 7.8101 127.4987 54.4162 32.8505 174.7891 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 8.29 4.40 0.00 1.98 2.06 0.00 0.00 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.60 0.00 2 E 8.58 4.84 0.00 2.12 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 2.13 2.34 0.00 3 A 8.63 4.78 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 4 K 8.95 4.96 0.00 1.65 1.72 0.00 1.11 0.00 0.00 0.61 0.00 0.00 2.78 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.25 1.20 7.81 5 A 8.30 4.41 1.16 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 0.00 0.00 6 I 7.76 3.09 1.82 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 1.28 0.41 0.83 0.00 0.00 7 A 8.79 4.59 1.20 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 0.00 0.00 0.00 8 R 8.43 4.23 0.00 1.88 1.34 0.00 3.35 0.00 0.00 2.96 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.53 0.00 9 Y 8.17 3.60 0.00 3.17 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 10 V 8.06 3.45 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 -0.22 0.00 0.00 0.87 0.00 0.00 11 R 7.71 3.90 0.00 2.09 2.02 0.00 3.43 0.00 0.00 3.15 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.69 0.00 12 I 6.99 4.65 1.81 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.13 0.77 0.00 0.00 13 S 8.52 4.32 0.00 3.90 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 14 P 0.00 4.05 0.00 2.18 2.03 0.00 3.66 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.15 0.00 15 R 8.11 3.91 0.00 1.87 1.96 0.00 3.18 0.00 0.00 3.34 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.76 0.00 16 K 8.29 4.07 0.00 2.12 1.87 0.00 1.61 0.00 0.00 1.66 0.00 0.00 3.09 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.49 1.54 7.81 17 V 7.77 3.80 2.17 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 0.92 0.00 0.00 0.96 0.00 0.00 18 R 8.64 3.92 0.00 1.98 2.04 0.00 3.18 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.73 0.00 19 L 7.19 3.95 0.00 1.98 1.79 0.94 1.02 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 20 V 7.20 3.85 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 0.96 0.00 0.00 0.96 0.00 0.00 21 V 8.21 3.55 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 1.02 0.00 0.00 0.99 0.00 0.00 22 D 8.55 4.44 0.00 2.93 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 23 L 8.09 4.18 0.00 1.86 1.72 0.94 1.20 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 24 I 7.60 4.42 1.88 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 1.18 0.87 0.92 0.00 0.00 25 R 7.54 3.92 0.00 1.93 1.91 0.00 3.33 0.00 0.00 3.26 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.59 0.00 26 G 8.76 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 27 K 7.54 4.69 0.00 1.90 1.90 0.00 1.99 0.00 0.00 1.73 0.00 0.00 3.01 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.51 1.50 7.81 28 S 8.66 4.18 0.00 4.08 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 29 L 8.84 3.87 0.00 1.83 1.84 0.92 0.64 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 30 E 8.21 3.88 0.00 2.10 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 2.40 2.39 0.00 31 E 8.85 3.94 0.00 2.12 1.96 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 2.33 2.35 0.00 32 A 8.28 3.99 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 33 R 7.93 3.87 0.00 2.06 2.00 0.00 3.37 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 1.64 1.67 0.00 34 N 7.65 4.43 0.00 2.89 2.97 0.00 0.00 7.12 7.18 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 35 I 8.41 3.82 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 1.56 1.25 0.95 0.00 0.00 36 L 8.20 3.94 0.00 1.81 1.73 0.92 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 37 R 7.81 3.73 0.00 1.84 2.14 0.00 3.02 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 1.29 0.72 0.00 38 Y 7.66 4.67 0.00 3.01 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 39 T 7.75 4.30 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 N 8.52 4.72 0.00 2.69 2.77 0.00 0.00 6.99 6.68 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 41 K 7.47 4.66 0.00 1.80 1.66 0.00 1.78 0.00 0.00 1.76 0.00 0.00 2.85 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.40 7.81 42 R 8.99 3.85 0.00 1.87 2.02 0.00 3.25 0.00 0.00 3.45 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.69 0.00 43 G 8.41 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 A 8.13 3.97 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 45 Y 8.14 3.80 0.00 2.87 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 46 F 7.42 3.99 0.00 3.18 3.01 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 47 V 8.27 3.54 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 0.95 0.00 0.00 0.96 0.00 0.00 48 A 8.16 3.88 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 49 K 7.86 3.61 0.00 1.42 1.69 0.00 1.21 0.00 0.00 1.57 0.00 0.00 2.82 0.00 0.00 2.35 0.00 0.00 0.00 0.00 1.32 1.28 7.81 50 V 7.57 3.57 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 0.95 0.00 0.00 0.85 0.00 0.00 51 L 8.26 3.83 0.00 1.78 1.93 0.90 0.82 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 52 E 8.48 3.83 0.00 2.18 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.34 0.00 53 S 8.16 4.02 0.00 3.90 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 54 A 8.39 3.88 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 55 A 7.81 3.91 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 56 A 8.41 3.87 1.30 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 0.00 0.00 0.00 57 N 8.73 4.15 0.00 2.97 2.91 0.00 0.00 7.05 7.38 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 58 A 8.79 3.81 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 59 V 8.50 3.53 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 0.98 0.00 0.00 0.96 0.00 0.00 60 N 8.44 4.24 0.00 2.92 2.84 0.00 0.00 7.30 7.37 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 61 N 8.67 4.77 0.00 2.61 2.57 0.00 0.00 6.89 6.97 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 62 H 8.15 4.74 0.00 3.19 3.25 0.00 5.89 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 D 7.33 4.36 0.00 2.85 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 M 8.31 4.43 0.00 1.99 2.17 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.69 0.00 65 L 8.22 3.93 0.00 1.79 2.04 0.92 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 66 E 8.82 3.92 0.00 2.00 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 2.40 2.38 0.00 67 D 8.16 4.50 0.00 2.70 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 68 R 8.63 4.71 0.00 1.68 1.88 0.00 3.03 0.00 0.00 3.15 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.50 0.00 69 L 7.84 5.51 0.00 1.94 1.90 1.00 0.69 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 70 Y 9.01 5.41 0.00 3.10 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.92 4.15 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 0.82 0.00 0.00 0.99 0.00 0.00 72 K 8.00 3.51 0.00 1.35 1.78 0.00 1.76 0.00 0.00 1.70 0.00 0.00 3.09 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.37 1.48 7.81 73 A 8.03 4.94 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 74 A 7.93 4.76 1.13 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 0.00 0.00 75 Y 7.66 4.68 0.00 2.93 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 76 V 8.75 5.03 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 0.78 0.00 0.00 0.94 0.00 0.00 77 D 8.52 5.09 0.00 2.65 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 78 E 8.82 4.32 0.00 1.93 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 2.26 2.32 0.00 79 G 8.30 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 0.00 0.00 0.00 80 P 0.00 4.32 0.00 2.26 2.18 0.00 3.81 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.25 0.00 81 A 8.49 4.19 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 82 L 9.06 4.54 0.00 1.86 1.61 0.94 1.06 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 83 K 8.62 4.86 0.00 1.64 1.75 0.00 1.69 0.00 0.00 1.71 0.00 0.00 2.96 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.39 1.46 7.81 84 R 9.05 4.69 0.00 1.64 1.76 0.00 3.29 0.00 0.00 3.09 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.68 0.00 85 V 8.56 4.08 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 0.73 0.00 0.00 0.93 0.00 0.00 86 L 8.84 4.62 0.00 1.75 1.52 0.92 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 87 P 0.00 4.71 0.00 1.98 1.97 0.00 3.67 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.08 0.00 88 R 8.35 4.78 0.00 1.91 1.72 0.00 3.24 0.00 0.00 3.58 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.68 0.00 89 A 8.69 4.24 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 90 R 9.48 3.86 0.00 1.92 1.98 0.00 3.36 0.00 0.00 3.23 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.60 0.00 91 G 7.35 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 92 R 7.86 3.84 0.00 2.01 1.95 0.00 3.33 0.00 0.00 3.23 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.57 0.00 93 A 7.98 3.64 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 94 D 9.22 4.98 0.00 2.59 2.61 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.00 4.94 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 1.23 0.66 0.91 0.00 0.00 96 I 9.03 4.17 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 1.23 1.43 0.98 0.00 0.00 97 K 8.45 4.89 0.00 1.66 1.75 0.00 1.80 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.35 1.44 7.81 98 K 8.89 4.10 0.00 1.69 1.78 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.84 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.57 7.81 99 R 8.41 4.63 0.00 1.68 1.96 0.00 3.18 0.00 0.00 3.28 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.81 0.00 100 T 8.07 4.69 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 1.27 0.00 0.00 101 S 8.68 5.07 0.00 3.68 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 0.00 102 H 8.76 5.25 0.00 3.08 3.06 0.00 5.63 0.00 0.00 0.00 0.00 6.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 I 8.30 4.27 1.83 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 1.19 0.53 0.87 0.00 0.00 104 T 8.50 4.69 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 0.59 0.00 0.00 105 V 8.19 4.53 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 0.94 0.00 0.00 0.83 0.00 0.00 106 I 8.54 4.61 1.80 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.50 0.82 0.00 0.00 107 L 8.95 4.68 0.00 1.71 1.54 0.86 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 108 G 8.23 4.52 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 0.00 0.00 0.00 109 E 8.74 4.95 0.00 1.90 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 2.24 2.31 0.00 110 K 9.56 3.88 0.00 1.63 1.55 0.00 0.86 0.00 0.00 0.86 0.00 0.00 2.86 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.32 1.32 7.81 111 H 8.53 4.82 0.00 3.19 3.19 0.00 5.67 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 G 7.89 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 0.00 113 K 7.81 4.20 0.00 1.72 1.50 0.00 1.84 0.00 0.00 1.74 0.00 0.00 2.97 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.24 0.98 7.81