NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 3.9195 8.0549 114.0202 61.3455 32.3769 175.9440 2 E 4.2789 8.3503 128.5913 54.9067 30.6891 173.4150 3 W 5.1380 8.4363 124.1196 55.0542 32.4656 176.2639 4 T 4.3889 9.3148 114.4600 61.2514 70.6439 175.6462 5 D 4.4132 8.6797 122.0115 57.3683 40.7743 178.9411 6 K 3.8841 8.1073 119.6175 59.7651 32.1489 178.4251 7 E 4.0086 7.9859 118.1581 59.4130 29.4024 179.4389 8 R 3.7944 8.0359 118.0383 59.5035 30.1495 179.3214 9 S 4.0840 8.2571 114.7812 61.5173 62.8229 176.6759 10 I 3.6880 8.4005 122.8736 64.6315 36.9033 178.4124 11 I 3.7295 8.3837 121.2767 64.4288 36.8616 178.3662 12 S 4.0077 8.4874 114.1450 61.5118 62.1959 175.3179 13 D 4.3253 8.7501 120.8988 57.5760 40.6977 178.0181 14 I 3.6022 7.6012 119.4162 64.8692 37.6188 178.1954 15 F 4.0552 8.2425 117.9682 60.2296 38.4458 177.8641 16 S 4.2066 7.9731 113.4234 61.2777 62.6721 175.4993 17 H 4.8601 7.6871 116.7807 54.2484 29.0614 174.1772 18 M 4.0353 7.3016 121.9059 55.1415 32.6599 177.0582 19 D 4.6983 8.2274 126.4164 52.7414 39.7447 175.5001 20 Y 4.1397 8.4720 122.4844 60.9844 37.9596 177.6424 21 D 4.5088 8.3482 117.8843 56.1335 40.7611 177.0983 22 D 4.6361 8.3402 118.4591 56.1773 41.7579 178.3423 23 I 3.7356 7.5450 119.7928 64.2134 37.2161 178.2289 24 G 3.8218 7.9008 106.4714 47.5797 0.0000 173.8605 25 P 4.2638 0.0000 0.0000 65.0360 31.3889 178.9815 26 K 3.9858 7.7339 116.1553 59.3266 31.9998 179.3672 27 A 3.9630 9.1028 122.0411 55.0411 18.2963 179.5113 28 L 3.9385 8.0821 118.9130 58.1658 42.0207 179.2046 29 S 4.0411 8.5584 115.5395 61.7861 62.7792 176.7812 30 R 3.8363 8.2566 121.4995 59.3638 29.6725 178.1109 31 C 4.1401 8.0242 118.5337 62.5148 31.4872 175.6329 32 L 4.0038 7.8074 121.7761 56.7607 40.8719 179.4973 33 V 3.7933 7.1757 111.3728 63.4229 32.1653 178.3418 34 V 3.4618 7.5972 117.0300 64.6146 32.8372 175.7989 35 Y 3.8148 7.4959 115.5503 54.0138 38.3674 173.8887 36 P 4.7881 0.0000 0.0000 64.5192 31.6311 178.1920 37 W 4.2940 7.7463 115.0026 59.2568 27.8439 177.7439 38 T 4.2218 7.9996 110.5900 63.7992 68.1315 176.2204 39 Q 4.0684 8.4015 122.3792 58.6131 28.4611 178.0744 40 R 3.8315 7.2464 116.7439 59.6429 29.2464 177.8934 41 Y 4.1743 6.5630 113.7171 58.4547 38.7712 175.6352 42 F 4.4259 8.0441 119.1684 56.1854 39.7099 176.5840 43 S 4.1346 8.2121 118.5033 61.6040 62.8469 176.6194 44 G 4.0220 8.1462 106.7728 46.1830 0.0000 175.0214 45 F 4.2793 8.1250 118.9887 59.0998 39.9912 175.7714 46 G 3.9374 7.4178 105.1721 44.1530 0.0000 175.9634 47 N 3.4453 8.4890 127.4500 52.9975 38.1332 173.8791 48 L 4.6526 6.6692 123.6776 54.4285 43.2832 177.4635 49 Y 4.5014 7.2755 118.7541 60.6549 38.1820 175.0586 50 N 4.9656 7.7331 114.3976 50.3987 40.7229 174.1378 51 A 3.8899 8.7501 118.6182 55.7834 18.2443 179.0869 52 E 3.9707 8.3612 116.2956 60.0175 29.3628 179.9155 53 G 3.7053 8.2603 104.0411 47.9994 0.0000 175.3586 54 I 3.8886 7.7644 121.9318 64.4228 36.9809 178.3681 55 M 4.1842 8.2278 118.9342 57.2651 31.6971 177.4037 56 S 4.5695 7.4465 110.9580 57.6219 63.6590 173.8707 57 N 4.5021 8.0183 120.5406 53.0265 39.1280 174.9824 58 A 3.9398 8.5997 130.9215 55.6590 18.5541 178.6547 59 N 3.9544 7.9548 114.1564 56.2921 38.3378 177.7591 60 V 3.7114 7.9004 119.4315 65.4594 31.6477 177.8610 61 A 3.9321 7.9081 119.9005 55.2091 18.2162 179.1178 62 A 3.9354 7.9891 118.9348 55.7808 18.4582 179.4034 63 H 4.3544 8.3407 116.5842 59.0344 29.8546 177.7265 64 G 3.6263 8.4602 108.0928 47.8749 0.0000 175.4601 65 I 3.7609 7.7118 122.5720 64.0367 37.1107 178.3616 66 K 3.9881 7.8765 120.2072 59.5729 31.8855 178.8453 67 V 3.6498 7.9167 117.4525 66.1770 31.5861 177.4362 68 L 4.2192 8.2961 120.0423 58.5409 41.9053 178.6617 69 H 4.6813 8.3799 116.1555 58.5847 28.3964 177.7721 70 G 4.1120 7.9086 106.5396 47.6646 0.0000 175.1987 71 L 5.1531 8.0797 122.3609 56.8431 41.1250 178.6767 72 D 4.5674 8.7968 120.1392 57.6598 40.7006 179.0851 73 R 4.2261 8.2069 115.9410 59.1602 29.3427 178.8422 74 G 3.8912 8.4477 106.7249 47.9926 0.0000 175.2566 75 M 4.1284 7.5190 117.9946 56.0816 31.4045 177.4556 76 K 4.2192 7.3558 118.4517 56.7634 34.1368 176.5405 77 N 4.9510 7.9033 117.2567 52.4899 39.8763 174.9954 78 M 4.4345 7.9156 119.2065 58.2607 32.6407 177.6703 79 D 5.0473 8.0811 115.7466 54.3618 41.9071 175.8111 80 N 5.1495 8.5469 119.4756 52.0507 39.3261 176.4365 81 I 3.9097 8.2057 119.8582 64.0294 37.8564 177.2747 82 A 4.2267 8.0369 121.2454 55.5320 18.3504 179.3376 83 D 4.3429 8.1601 116.6114 57.3675 40.7456 178.6467 84 A 4.0648 7.8327 120.0875 54.1397 18.4491 177.6560 85 Y 4.5595 7.5218 114.3879 58.2156 38.8467 177.7987 86 T 3.9197 7.9703 119.3809 67.1201 68.3439 175.9839 87 D 4.2970 7.9912 119.6673 57.5354 40.9628 178.6064 88 L 3.9529 8.0092 118.9170 57.8779 41.6526 179.2736 89 S 4.4010 8.2480 114.3598 61.2210 62.2926 176.5414 90 T 3.7629 7.7842 118.1330 66.3921 68.1874 176.3897 91 L 3.8874 8.7707 123.4279 58.7007 42.0491 178.8986 92 H 4.2636 9.0010 116.7700 58.4178 28.4788 177.7312 93 S 3.7565 7.8157 115.0142 60.9392 62.1068 175.6822 94 E 4.1622 7.7905 118.7946 57.0735 29.6324 177.3562 95 K 4.2584 7.7232 116.7054 57.5712 33.5402 177.2834 96 L 4.2215 7.6823 116.2423 54.5103 42.7477 176.1398 97 H 4.3448 7.7216 113.6665 55.5908 25.8974 174.9275 98 V 3.4898 7.8798 118.0354 60.8784 32.8331 174.5204 99 D 4.1860 8.6524 127.3751 53.6196 41.1485 175.0410 100 P 2.9700 0.0000 0.0000 65.0732 30.9823 177.5802 101 D 4.3879 8.2825 118.2530 57.2018 41.0290 177.7014 102 N 4.4470 8.0623 116.8315 55.8076 38.5233 177.1825 103 F 4.5567 7.9823 120.2225 60.4726 38.8980 177.7508 104 K 4.0333 7.9953 117.7601 59.2287 32.0275 179.3746 105 L 3.7375 7.7363 118.7705 57.8314 41.4960 179.3180 106 L 4.1250 8.1061 120.0580 58.0785 41.9075 179.0755 107 S 4.1472 7.9727 115.0664 61.6777 62.6580 176.3942 108 D 4.4294 8.2250 121.6387 57.4918 40.5679 178.6529 109 C 4.1882 8.1429 116.8570 62.8363 28.0718 176.0699 110 I 3.7411 8.1466 121.7393 64.9215 36.7217 178.6716 111 T 4.1901 8.3643 116.6120 66.7668 68.1260 176.8893 112 I 3.7466 8.0049 122.0661 63.9972 37.2391 178.6691 113 V 3.4900 8.3523 119.6617 65.7373 31.3106 177.7197 114 L 3.6757 8.0171 120.1917 58.0684 41.6536 178.9256 115 A 3.1061 7.1478 119.9494 54.6091 17.9613 179.4487 116 A 3.8277 7.2081 118.4168 55.0045 18.4965 179.5366 117 K 3.9484 7.5211 116.7196 59.9387 32.6822 178.6290 118 M 4.2185 8.4044 118.3667 55.3579 32.4727 177.9682 119 G 3.7026 8.7891 108.9525 46.1970 0.0000 176.0418 120 H 4.0922 9.2153 121.7722 58.9472 29.5582 176.0179 121 A 4.0793 8.0181 121.2256 54.5227 18.5306 177.9953 122 F 4.4202 8.3286 120.2551 57.3793 37.7030 175.1659 123 T 4.1563 7.3609 116.3879 60.2541 71.4061 175.2901 124 A 3.9063 8.3451 122.4669 55.3356 18.2345 179.6300 125 E 3.8742 8.1048 115.3759 59.6752 29.5597 179.1186 126 T 3.9276 7.2747 115.9333 65.7989 68.5786 176.8416 127 Q 3.6805 7.7016 121.9502 58.7902 29.0069 178.3406 128 G 3.6264 8.2741 106.7728 47.8087 0.0000 175.5853 129 A 4.2064 7.8398 123.6517 54.7989 18.3382 179.5737 130 F 4.5022 8.4701 119.2256 61.6975 39.4795 177.4930 131 Q 3.9172 8.7587 118.2130 58.6416 28.5227 178.2845 132 K 3.8617 8.3515 120.8985 59.7063 32.2143 178.3595 133 F 4.6413 8.6343 120.5468 61.6059 39.2759 177.0875 134 L 3.6268 8.2247 118.6406 57.5124 41.3259 179.2998 135 A 3.8904 8.6605 120.9252 55.0554 18.4217 179.3984 136 A 3.8773 7.8570 119.2189 55.4883 18.4489 180.1260 137 V 3.2026 7.3087 116.5546 65.6697 31.3019 178.5168 138 V 3.2883 7.7746 118.6266 65.7853 31.1568 177.8005 139 S 4.0291 8.1234 111.9449 61.5392 62.1220 175.8034 140 A 4.1318 7.7752 122.9517 55.0964 17.7112 179.6425 141 L 3.9231 7.7252 117.8378 56.9333 41.2000 178.7905 142 G 4.3471 7.4539 103.5012 44.6311 0.0000 175.3560 143 K 4.2340 7.8099 123.9214 59.2938 31.9847 178.1851 144 Q 4.2657 8.1060 115.6555 56.2285 28.3673 175.1314 145 Y 4.2690 7.6079 117.5994 57.0289 38.2511 175.5186 146 H 4.5201 8.4101 119.8191 55.8472 28.6661 173.1555 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 V 8.05 3.92 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 0.76 0.00 0.00 0.51 0.00 0.00 2 E 8.35 4.28 0.00 1.86 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 2.19 2.42 0.00 3 W 8.44 5.14 0.00 3.27 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 4 T 9.31 4.39 4.31 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 1.26 0.00 0.00 5 D 8.68 4.41 0.00 2.82 2.79 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 6 K 8.11 3.88 0.00 1.85 1.86 0.00 1.74 0.00 0.00 1.84 0.00 0.00 2.96 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.53 1.56 7.81 7 E 7.99 4.01 0.00 2.51 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 0.00 2.51 2.51 0.00 8 R 8.04 3.79 0.00 2.05 1.91 0.00 3.14 0.00 0.00 3.13 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.86 0.00 9 S 8.26 4.08 0.00 3.85 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 10 I 8.40 3.69 1.90 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 1.52 0.85 0.91 0.00 0.00 11 I 8.38 3.73 1.59 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.01 0.40 0.00 0.00 12 S 8.49 4.01 0.00 3.81 3.97 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 13 D 8.75 4.33 0.00 2.94 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 14 I 7.60 3.60 1.82 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.59 0.41 0.00 0.00 15 F 8.24 4.06 0.00 2.96 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 16 S 7.97 4.21 0.00 3.97 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 0.00 17 H 7.69 4.86 0.00 3.12 3.32 0.00 5.65 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 M 7.30 4.04 0.00 1.44 1.72 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 1.94 0.00 19 D 8.23 4.70 0.00 2.81 2.50 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.47 4.14 0.00 3.02 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 21 D 8.35 4.51 0.00 2.89 2.75 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 22 D 8.34 4.64 0.00 2.82 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 23 I 7.54 3.74 1.70 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.73 0.79 0.00 0.00 24 G 7.90 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 25 P 0.00 4.26 0.00 2.15 2.09 0.00 3.73 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 2.29 2.18 0.00 26 K 7.73 3.99 0.00 2.05 1.81 0.00 1.72 0.00 0.00 1.69 0.00 0.00 2.92 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.42 1.42 7.81 27 A 9.10 3.96 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 28 L 8.08 3.94 0.00 1.79 1.65 0.92 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 29 S 8.56 4.04 0.00 3.98 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 30 R 8.26 3.84 0.00 1.88 1.93 0.00 3.06 0.00 0.00 3.04 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.55 0.00 31 C 8.02 4.14 0.00 3.25 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 32 L 7.81 4.00 0.00 1.79 1.66 0.78 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.18 3.79 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 0.73 0.00 0.00 0.83 0.00 0.00 34 V 7.60 3.46 1.61 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 -0.31 0.00 0.00 0.74 0.00 0.00 35 Y 7.50 3.81 0.00 2.61 1.43 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 36 P 0.00 4.79 0.00 2.21 2.13 0.00 3.59 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.06 0.00 37 W 7.75 4.29 0.00 3.51 3.47 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.00 4.22 4.45 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 1.17 0.00 0.00 39 Q 8.40 4.07 0.00 2.17 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.77 0.00 0.00 0.00 0.00 0.00 2.39 2.46 0.00 40 R 7.25 3.83 0.00 1.74 1.93 0.00 2.85 0.00 0.00 2.87 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.22 0.00 41 Y 6.56 4.17 0.00 2.12 2.29 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 42 F 8.04 4.43 0.00 2.68 1.62 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 0.00 0.00 0.00 0.00 43 S 8.21 4.13 0.00 3.89 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 44 G 8.15 4.02 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 0.00 0.00 0.00 45 F 8.12 4.28 0.00 3.14 3.12 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 46 G 7.42 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 0.00 0.00 0.00 47 N 8.49 3.45 0.00 2.65 2.67 0.00 0.00 6.60 7.78 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 48 L 6.67 4.65 0.00 1.47 1.53 1.04 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 49 Y 7.28 4.50 0.00 3.02 2.94 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 50 N 7.73 4.97 0.00 2.90 2.95 0.00 0.00 6.12 7.73 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 51 A 8.75 3.89 1.32 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 0.00 0.00 0.00 52 E 8.36 3.97 0.00 2.23 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 2.41 2.47 0.00 53 G 8.26 3.71 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 0.00 0.00 0.00 54 I 7.76 3.89 1.93 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 1.47 0.45 0.86 0.00 0.00 55 M 8.23 4.18 0.00 1.93 2.37 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 2.61 2.57 0.00 56 S 7.45 4.57 0.00 3.91 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 57 N 8.02 4.50 0.00 3.02 2.85 0.00 0.00 7.08 8.56 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 58 A 8.60 3.94 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 59 N 7.95 3.95 0.00 2.56 1.61 0.00 0.00 6.70 7.31 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 60 V 7.90 3.71 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 1.04 0.00 0.00 1.04 0.00 0.00 61 A 7.91 3.93 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 62 A 7.99 3.94 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 63 H 8.34 4.35 0.00 3.52 3.50 0.00 5.79 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 G 8.46 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 0.00 0.00 0.00 65 I 7.71 3.76 2.08 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 1.65 1.48 1.01 0.00 0.00 66 K 7.88 3.99 0.00 2.00 1.90 0.00 1.76 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.51 1.51 7.81 67 V 7.92 3.65 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 0.94 0.00 0.00 0.97 0.00 0.00 68 L 8.30 4.22 0.00 2.04 1.95 0.91 0.83 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 69 H 8.38 4.68 0.00 3.46 3.36 0.00 5.68 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 G 7.91 4.11 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 0.00 0.00 0.00 71 L 8.08 5.15 0.00 2.29 2.40 1.19 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 72 D 8.80 4.57 0.00 3.14 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 73 R 8.21 4.23 0.00 1.82 2.06 0.00 2.21 0.00 0.00 2.97 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.97 0.00 74 G 8.45 3.89 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 0.00 0.00 0.00 0.00 0.00 0.00 75 M 7.52 4.13 0.00 0.90 1.27 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 0.81 0.00 76 K 7.36 4.22 0.00 1.94 1.83 0.00 1.70 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.32 1.61 7.81 77 N 7.90 4.95 0.00 2.68 2.64 0.00 0.00 7.07 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 78 M 7.92 4.43 0.00 1.35 1.91 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.34 0.00 79 D 8.08 5.05 0.00 2.74 2.79 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 80 N 8.55 5.15 0.00 2.80 2.69 0.00 0.00 7.18 7.77 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 81 I 8.21 3.91 2.03 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.02 1.05 0.00 0.00 82 A 8.04 4.23 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 83 D 8.16 4.34 0.00 2.75 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 84 A 7.83 4.06 1.25 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 0.00 0.00 0.00 85 Y 7.52 4.56 0.00 3.02 2.87 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 86 T 7.97 3.92 4.35 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 1.22 0.00 0.00 87 D 7.99 4.30 0.00 2.72 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 88 L 8.01 3.95 0.00 1.90 1.92 1.14 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 89 S 8.25 4.40 0.00 4.18 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 90 T 7.78 3.76 4.39 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 1.18 0.00 0.00 91 L 8.77 3.89 0.00 1.61 1.80 0.89 0.99 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 92 H 9.00 4.26 0.00 3.54 3.72 0.00 5.86 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 S 7.82 3.76 0.00 2.72 3.27 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 94 E 7.79 4.16 0.00 2.03 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 2.26 2.21 0.00 95 K 7.72 4.26 0.00 1.86 1.78 0.00 1.71 0.00 0.00 1.67 0.00 0.00 3.00 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.33 1.39 7.81 96 L 7.68 4.22 0.00 1.73 1.63 0.79 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.72 4.34 0.00 3.35 3.40 0.00 5.74 0.00 0.00 0.00 0.00 8.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.88 3.49 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 0.04 0.00 0.00 0.44 0.00 0.00 99 D 8.65 4.19 0.00 2.76 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 0.00 100 P 0.00 2.97 0.00 2.05 1.86 0.00 3.33 0.00 0.00 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.93 0.00 101 D 8.28 4.39 0.00 2.69 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 0.00 102 N 8.06 4.45 0.00 2.64 2.86 0.00 0.00 6.87 7.75 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 0.00 103 F 7.98 4.56 0.00 3.05 2.87 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 0.00 104 K 8.00 4.03 0.00 1.89 1.83 0.00 1.65 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.47 1.46 7.81 105 L 7.74 3.74 0.00 1.64 0.99 0.70 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.11 4.12 0.00 1.86 1.85 0.99 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 107 S 7.97 4.15 0.00 4.14 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 0.00 108 D 8.23 4.43 0.00 3.02 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 0.00 109 C 8.14 4.19 0.00 3.22 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 0.00 110 I 8.15 3.74 2.15 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.86 1.14 0.00 0.00 111 T 8.36 4.19 4.54 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 1.49 0.00 0.00 112 I 8.00 3.75 1.96 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.28 0.87 0.00 0.00 113 V 8.35 3.49 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 0.90 0.00 0.00 0.96 0.00 0.00 114 L 8.02 3.68 0.00 1.52 1.25 0.60 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 115 A 7.15 3.11 0.80 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 0.00 0.00 0.00 0.00 0.00 116 A 7.21 3.83 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 0.00 117 K 7.52 3.95 0.00 1.85 1.79 0.00 1.74 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.37 1.52 7.81 118 M 8.40 4.22 0.00 2.15 2.18 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.50 0.00 119 G 8.79 3.70 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 0.00 0.00 0.00 120 H 9.22 4.09 0.00 3.10 3.41 0.00 5.93 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 0.00 121 A 8.02 4.08 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 0.00 122 F 8.33 4.42 0.00 2.82 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 0.00 123 T 7.36 4.16 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 1.10 0.00 0.00 124 A 8.35 3.91 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 0.00 125 E 8.10 3.87 0.00 2.19 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 0.00 2.29 2.37 0.00 126 T 7.27 3.93 3.95 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 0.00 0.00 1.02 0.00 0.00 127 Q 7.70 3.68 0.00 1.68 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.55 2.70 0.00 128 G 8.27 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 0.00 0.00 0.00 129 A 7.84 4.21 1.48 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 0.00 0.00 130 F 8.47 4.50 0.00 3.29 3.26 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 0.00 131 Q 8.76 3.92 0.00 2.23 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.51 0.00 0.00 0.00 0.00 0.00 2.50 2.78 0.00 132 K 8.35 3.86 0.00 2.16 2.29 0.00 1.74 0.00 0.00 1.65 0.00 0.00 2.43 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.30 1.41 7.81 133 F 8.63 4.64 0.00 3.29 3.33 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 0.00 134 L 8.22 3.63 0.00 1.69 1.52 0.54 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 135 A 8.66 3.89 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 0.00 136 A 7.86 3.88 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 0.00 137 V 7.31 3.20 1.67 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 0.37 0.00 0.00 0.40 0.00 0.00 138 V 7.77 3.29 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 0.97 0.00 0.00 0.94 0.00 0.00 139 S 8.12 4.03 0.00 3.91 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 0.00 140 A 7.78 4.13 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 0.00 141 L 7.73 3.92 0.00 1.23 0.53 -0.16 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 142 G 7.45 4.35 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 0.00 143 K 7.81 4.23 0.00 2.10 1.86 0.00 1.67 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.47 1.51 7.81 144 Q 8.11 4.27 0.00 1.96 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.56 6.56 0.00 0.00 0.00 0.00 0.00 2.41 2.58 0.00 145 Y 7.61 4.27 0.00 2.86 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 0.00 146 H 8.41 4.52 0.00 3.20 3.24 0.00 5.56 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00