NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4746 8.2893 120.3549 55.4081 33.3674 174.2589 2 E 4.8796 8.5405 122.6839 54.0806 33.4218 173.0099 3 A 4.6012 9.0873 122.3759 50.1890 23.0751 177.1491 4 K 4.5321 8.5820 119.7556 56.8900 34.3728 176.0127 5 A 4.2456 8.2695 121.6870 50.5812 20.6017 173.9212 6 I 3.0542 9.0895 129.9159 59.6190 36.4806 173.5300 7 A 4.5242 8.0412 128.7887 49.6847 19.0021 175.4785 8 R 3.5902 8.1652 119.3960 57.2639 30.8827 175.9818 9 Y 4.1437 7.6824 113.9825 58.2159 35.0482 173.7516 10 V 2.8536 6.8874 115.9743 63.7229 32.7276 175.5386 11 R 4.3908 7.8383 122.0676 55.6356 28.0675 174.6289 12 I 4.1232 7.0640 115.8405 58.5449 42.0618 174.1280 13 S 4.2209 8.3140 120.7428 58.0920 63.3426 172.3844 14 P 4.1514 0.0000 0.0000 65.9693 30.8488 178.7935 15 R 4.0190 7.7628 117.7162 59.5560 30.6495 178.7641 16 K 4.1712 7.8776 117.8885 59.3933 32.4940 179.6205 17 V 3.8699 8.0294 119.5005 64.3780 31.5771 178.3096 18 R 3.9797 9.2332 120.0148 58.7804 29.5463 178.5290 19 L 3.9265 7.3015 117.1039 58.1955 41.9837 178.7412 20 V 3.5813 8.0195 117.2517 66.1691 31.2101 177.6898 21 V 3.5771 7.9152 116.8454 66.3792 31.3103 177.8380 22 D 4.6913 7.7936 113.4064 55.3256 40.4903 176.4700 23 L 4.6343 8.0242 121.0044 54.8080 42.5700 176.4554 24 I 4.5671 7.9205 107.6429 60.5179 39.2942 175.1883 25 R 3.7505 8.1019 122.4438 57.6173 30.0210 174.5231 26 G 3.8823 8.8077 117.2705 44.6732 0.0000 171.8713 27 K 4.3766 7.9234 119.6421 54.1477 36.4430 174.9365 28 S 4.1215 8.6354 117.1215 59.2512 63.6421 175.2542 29 L 4.0310 8.4790 128.0294 58.4265 41.3234 178.7943 30 E 3.9210 8.2152 118.5586 59.1794 29.7911 177.9670 31 E 3.9385 8.4150 118.3805 58.0259 29.8010 178.2456 32 A 4.0320 8.4254 121.7409 55.1011 18.4631 179.5665 33 R 3.8733 7.9679 116.6416 60.0403 29.9558 178.3303 34 N 4.3543 7.5398 114.1608 56.9921 38.7214 176.8541 35 I 3.7100 8.1066 119.4959 65.1005 36.9422 178.0611 36 L 3.7769 8.2797 120.5101 57.6163 41.4926 179.8706 37 R 3.9421 7.9103 116.9516 58.2503 29.9640 176.4678 38 Y 4.6046 8.2862 114.6345 57.9075 38.8204 176.3560 39 T 4.3156 7.4199 119.0799 61.9365 67.1137 172.5742 40 N 4.7713 8.2495 124.4642 52.8104 37.0551 172.6883 41 K 4.2610 8.1618 116.8651 53.9096 36.7221 175.9323 42 R 3.9730 9.0003 125.1049 59.8459 30.0697 178.2584 43 G 4.2006 8.4699 104.1036 47.5281 0.0000 174.7085 44 A 4.1961 8.5898 122.7414 54.3587 18.3646 178.8418 45 Y 4.1402 8.2696 119.0624 60.5620 39.0716 177.5220 46 F 3.8145 7.6565 118.0760 59.9604 38.9615 177.8296 47 V 3.5473 7.8344 117.8110 65.8586 31.3518 177.3483 48 A 3.9699 7.7435 119.8254 56.2502 18.0666 179.1263 49 K 3.6026 8.0280 113.8085 60.1580 32.1605 179.1080 50 V 3.5320 8.0395 118.5817 65.5080 31.4240 177.9613 51 L 3.8160 8.5397 121.0604 57.9838 41.8607 178.3074 52 E 3.9004 9.0539 119.3979 59.6708 29.4258 179.2039 53 S 4.0761 8.2750 112.8970 61.2005 62.3721 175.9764 54 A 4.0466 8.0784 123.3544 54.7511 17.7981 179.3502 55 A 3.8896 7.6083 118.4348 55.8253 18.7550 179.1077 56 A 3.9548 7.9360 119.0704 55.3128 18.2748 179.1713 57 N 4.1457 8.7919 113.5572 56.6386 38.3987 177.5716 58 A 3.9270 8.3187 122.0963 54.9020 18.4793 179.9010 59 V 3.4436 7.9424 116.9505 66.3856 31.5012 177.3695 60 N 4.5414 8.0844 115.9243 55.6306 38.5460 176.8742 61 N 4.4704 7.9462 119.4000 56.0952 38.8481 175.6591 62 H 4.6107 7.8726 116.2474 57.8642 30.4252 174.9402 63 D 4.6610 7.3755 114.1689 55.5117 37.1735 173.8058 64 M 4.4748 7.9067 125.5552 53.7473 33.8554 173.1192 65 L 3.4491 8.0307 125.8428 54.3358 40.4820 173.1114 66 E 4.0750 8.8327 126.8636 59.5819 29.4471 178.8759 67 D 4.6413 8.1816 112.7790 55.9249 40.8196 176.6066 68 R 4.7185 8.4649 117.6309 55.8039 32.2905 175.1246 69 L 5.7994 8.0749 119.4751 53.7606 44.0959 174.8891 70 Y 4.9358 8.0748 116.7399 56.3897 41.3904 173.9744 71 V 3.9149 8.0599 121.7368 61.8969 30.3888 176.0750 72 K 3.5067 7.7270 127.6867 58.7043 32.7579 175.7970 73 A 4.7893 7.6790 119.1238 50.6311 23.3624 174.9887 74 A 4.4992 8.3443 116.9477 51.6671 21.8330 175.6323 75 Y 4.8463 7.0333 119.0201 55.9564 41.7624 173.5956 76 V 4.8848 8.5684 121.2921 60.2764 33.7151 174.5822 77 D 5.0138 8.7473 123.7973 52.5136 43.8229 174.9487 78 E 4.4862 8.6133 122.6933 55.8915 30.4611 176.5998 79 G 3.8553 8.3462 115.9724 44.2404 0.0000 170.5832 80 P 4.5672 0.0000 0.0000 62.6134 31.4239 176.5244 81 A 4.2955 8.6555 126.6478 51.8441 19.6840 176.5359 82 L 4.4959 9.1051 120.6307 53.0669 43.2172 176.2695 83 K 4.6358 8.6124 124.6375 56.1516 32.8030 176.9805 84 R 4.7157 8.9456 123.9112 54.2157 34.0505 174.7702 85 V 4.4223 8.3677 122.5134 62.0111 32.7600 174.6645 86 L 4.7842 9.0532 130.8433 52.4266 44.1204 173.5522 87 P 4.7342 0.0000 0.0000 62.9425 32.2613 175.6645 88 R 4.8116 8.4318 120.6142 53.7281 33.4621 175.1104 89 A 4.0561 8.3756 121.9701 53.6059 19.0982 177.2259 90 R 3.5178 8.7253 116.5810 58.3597 26.7964 176.7539 91 G 4.0350 8.3340 100.2768 46.3736 0.0000 174.9178 92 R 3.7206 6.9957 118.2708 54.0419 30.5783 171.9734 93 A 3.8522 7.9925 130.2558 51.7600 18.9529 176.3316 94 D 5.2814 9.2807 124.5578 52.4323 45.0259 174.7589 95 I 4.8907 8.0812 112.5141 59.4775 39.3593 175.6959 96 I 3.8804 8.8985 128.9556 61.3199 38.4009 175.6718 97 K 4.7581 8.3472 124.6530 53.9729 32.4093 173.9052 98 K 4.0473 8.6876 121.7699 56.7157 33.0456 176.1445 99 R 4.6906 8.5559 124.6286 55.4355 32.2652 175.6215 100 T 4.8299 8.3608 115.7951 60.5091 70.8006 172.7679 101 S 5.0972 8.3928 120.7717 57.0905 67.8230 172.9173 102 H 5.0076 8.8618 117.6763 54.3052 31.4693 172.8353 103 I 4.3786 8.1593 125.5830 60.3555 37.4559 175.3334 104 T 4.5330 7.9984 124.0242 62.7760 70.2760 174.4585 105 V 4.4222 7.7627 122.9376 61.6604 35.5716 173.0717 106 I 5.1565 8.5237 120.6114 59.4908 40.7815 174.8219 107 L 5.0180 7.9293 126.8082 53.4903 44.5888 174.6314 108 G 4.3413 7.8219 104.0559 46.2034 0.0000 171.7298 109 E 5.8124 8.8436 118.7954 54.0915 31.5866 176.8120 110 K 3.5487 8.8954 122.8703 58.9038 32.1259 178.3621 111 H 4.9538 8.4503 120.7784 53.8445 27.2010 174.0444 112 G 4.4341 6.5588 123.9292 45.9071 0.0000 173.0864 113 K 4.2129 7.3709 127.7374 54.2263 32.4685 178.7846 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 4.47 0.00 2.00 2.07 0.00 0.00 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.65 0.00 2 E 8.54 4.88 0.00 2.04 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 2.17 2.38 0.00 3 A 9.09 4.60 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 4 K 8.58 4.53 0.00 1.62 1.72 0.00 1.69 0.00 0.00 1.72 0.00 0.00 2.80 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.35 1.41 7.81 5 A 8.27 4.25 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 9.09 3.05 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 1.27 0.38 0.82 0.00 0.00 7 A 8.04 4.52 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 8.17 3.59 0.00 1.88 1.14 0.00 2.64 0.00 0.00 2.75 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.51 0.00 9 Y 7.68 4.14 0.00 3.01 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 10 V 6.89 2.85 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 -0.15 0.00 0.00 0.84 0.00 0.00 11 R 7.84 4.39 0.00 1.82 2.11 0.00 3.49 0.00 0.00 3.13 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.41 0.00 12 I 7.06 4.12 1.65 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.71 0.67 0.00 0.00 13 S 8.31 4.22 0.00 3.92 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 4.15 0.00 2.18 2.00 0.00 3.67 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.15 0.00 15 R 7.76 4.02 0.00 1.78 2.02 0.00 3.20 0.00 0.00 3.22 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.77 0.00 16 K 7.88 4.17 0.00 2.07 1.87 0.00 1.67 0.00 0.00 1.89 0.00 0.00 3.08 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.54 1.50 7.81 17 V 8.03 3.87 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 0.80 0.00 0.00 0.95 0.00 0.00 18 R 9.23 3.98 0.00 2.11 1.98 0.00 3.11 0.00 0.00 3.19 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 19 L 7.30 3.93 0.00 1.92 1.73 0.99 0.87 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 20 V 8.02 3.58 2.28 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 1.05 0.00 0.00 0.97 0.00 0.00 21 V 7.92 3.58 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 0.96 0.00 0.00 0.99 0.00 0.00 22 D 7.79 4.69 0.00 2.87 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 23 L 8.02 4.63 0.00 1.64 1.81 0.94 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 24 I 7.92 4.57 1.87 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 1.47 0.82 0.92 0.00 0.00 25 R 8.10 3.75 0.00 1.81 1.92 0.00 3.38 0.00 0.00 3.27 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.64 0.00 26 G 8.81 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 27 K 7.92 4.38 0.00 1.94 1.69 0.00 1.74 0.00 0.00 1.90 0.00 0.00 3.01 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.39 1.38 7.81 28 S 8.64 4.12 0.00 4.08 4.10 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 29 L 8.48 4.03 0.00 1.74 1.78 0.92 0.93 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 30 E 8.22 3.92 0.00 2.10 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 2.40 2.39 0.00 31 E 8.41 3.94 0.00 2.10 2.05 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 2.31 2.35 0.00 32 A 8.43 4.03 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 33 R 7.97 3.87 0.00 2.08 2.01 0.00 3.30 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 1.83 1.82 0.00 34 N 7.54 4.35 0.00 2.80 2.94 0.00 0.00 7.09 7.33 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 35 I 8.11 3.71 1.91 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 1.57 1.22 0.95 0.00 0.00 36 L 8.28 3.78 0.00 1.70 1.76 0.93 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 37 R 7.91 3.94 0.00 1.80 2.11 0.00 3.08 0.00 0.00 3.16 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 1.22 0.00 38 Y 8.29 4.60 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 39 T 7.42 4.32 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 40 N 8.25 4.77 0.00 2.69 2.80 0.00 0.00 7.11 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 8.16 4.26 0.00 1.80 1.68 0.00 1.80 0.00 0.00 1.77 0.00 0.00 2.88 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.40 1.33 7.81 42 R 9.00 3.97 0.00 1.93 2.06 0.00 3.28 0.00 0.00 3.44 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.86 0.00 43 G 8.47 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 0.00 0.00 0.00 0.00 44 A 8.59 4.20 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.27 4.14 0.00 2.76 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 46 F 7.66 3.81 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 47 V 7.83 3.55 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 0.99 0.00 0.00 1.01 0.00 0.00 48 A 7.74 3.97 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 49 K 8.03 3.60 0.00 1.84 1.67 0.00 1.65 0.00 0.00 1.67 0.00 0.00 3.08 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.19 1.02 7.81 50 V 8.04 3.53 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 0.77 0.00 0.00 0.93 0.00 0.00 51 L 8.54 3.82 0.00 1.80 1.96 0.90 1.06 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 52 E 9.05 3.90 0.00 2.23 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 2.31 2.38 0.00 53 S 8.27 4.08 0.00 3.90 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 54 A 8.08 4.05 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 55 A 7.61 3.89 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 56 A 7.94 3.95 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 57 N 8.79 4.15 0.00 2.87 2.93 0.00 0.00 7.07 8.34 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 58 A 8.32 3.93 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 59 V 7.94 3.44 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 1.03 0.00 0.00 0.96 0.00 0.00 60 N 8.08 4.54 0.00 2.82 2.77 0.00 0.00 7.12 6.92 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 61 N 7.95 4.47 0.00 3.26 2.86 0.00 0.00 6.95 8.04 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 62 H 7.87 4.61 0.00 2.97 3.25 0.00 5.85 0.00 0.00 0.00 0.00 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 D 7.38 4.66 0.00 2.82 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 64 M 7.91 4.47 0.00 2.00 2.22 0.00 0.00 0.00 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.51 0.00 65 L 8.03 3.45 0.00 1.77 1.72 0.92 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 66 E 8.83 4.08 0.00 2.04 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 2.40 2.38 0.00 67 D 8.18 4.64 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 68 R 8.46 4.72 0.00 1.92 1.86 0.00 3.26 0.00 0.00 3.16 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.70 0.00 69 L 8.07 5.80 0.00 1.65 1.62 0.93 1.05 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 70 Y 8.07 4.94 0.00 3.05 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 71 V 8.06 3.91 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 0.82 0.00 0.00 1.01 0.00 0.00 72 K 7.73 3.51 0.00 1.26 1.76 0.00 1.91 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.39 1.46 7.81 73 A 7.68 4.79 1.28 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 0.00 0.00 0.00 74 A 8.34 4.50 1.10 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 0.00 0.00 75 Y 7.03 4.85 0.00 2.96 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 76 V 8.57 4.88 2.05 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 0.77 0.00 0.00 0.94 0.00 0.00 77 D 8.75 5.01 0.00 2.64 2.57 0.00 0.00 0.00 0.00 0.00 0.00 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 8.61 4.49 0.00 1.94 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 0.00 2.22 2.37 0.00 79 G 8.35 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 0.00 0.00 0.00 80 P 0.00 4.57 0.00 2.16 2.18 0.00 3.86 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 2.19 2.25 0.00 81 A 8.66 4.30 1.28 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 0.00 0.00 0.00 82 L 9.11 4.50 0.00 1.57 1.62 0.93 1.01 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 83 K 8.61 4.64 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 2.87 0.00 0.00 0.00 0.00 1.44 1.47 7.81 84 R 8.95 4.72 0.00 1.68 1.77 0.00 3.28 0.00 0.00 3.09 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.68 0.00 85 V 8.37 4.42 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 0.80 0.00 0.00 0.93 0.00 0.00 86 L 9.05 4.78 0.00 1.73 1.49 0.92 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 87 P 0.00 4.73 0.00 2.12 2.04 0.00 3.76 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 1.98 2.00 0.00 88 R 8.43 4.81 0.00 1.72 1.88 0.00 3.37 0.00 0.00 3.23 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.66 0.00 89 A 8.38 4.06 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 90 R 8.73 3.52 0.00 1.99 2.06 0.00 3.53 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 1.52 1.55 0.00 91 G 8.33 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 0.00 0.00 0.00 92 R 7.00 3.72 0.00 1.97 1.84 0.00 3.37 0.00 0.00 3.36 7.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.58 0.00 93 A 7.99 3.85 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 94 D 9.28 5.28 0.00 2.54 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 I 8.08 4.89 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 1.34 0.54 0.91 0.00 0.00 96 I 8.90 3.88 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 0.44 0.91 0.00 0.00 97 K 8.35 4.76 0.00 1.59 1.73 0.00 1.77 0.00 0.00 1.70 0.00 0.00 2.90 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.33 1.37 7.81 98 K 8.69 4.05 0.00 1.78 1.78 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.86 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.46 1.58 7.81 99 R 8.56 4.69 0.00 1.75 1.81 0.00 3.06 0.00 0.00 3.63 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.61 0.00 100 T 8.36 4.83 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 1.27 0.00 0.00 101 S 8.39 5.10 0.00 3.66 3.63 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 0.00 102 H 8.86 5.01 0.00 3.05 3.07 0.00 5.62 0.00 0.00 0.00 0.00 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 I 8.16 4.38 1.80 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 1.17 1.10 0.84 0.00 0.00 104 T 8.00 4.53 3.23 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 0.00 0.00 0.86 0.00 0.00 105 V 7.76 4.42 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 0.85 0.00 0.00 0.81 0.00 0.00 106 I 8.52 5.16 1.86 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 1.31 0.74 0.83 0.00 0.00 107 L 7.93 5.02 0.00 1.53 1.68 0.87 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 108 G 7.82 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 0.00 0.00 0.00 0.00 109 E 8.84 5.81 0.00 1.90 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 2.29 2.10 0.00 110 K 8.90 3.55 0.00 1.72 1.78 0.00 1.65 0.00 0.00 1.71 0.00 0.00 3.08 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.47 1.65 7.81 111 H 8.45 4.95 0.00 3.36 3.18 0.00 5.69 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 6.56 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.37 4.21 0.00 1.75 1.54 0.00 1.84 0.00 0.00 1.74 0.00 0.00 2.96 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.25 0.96 7.81