NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3087 8.2644 123.5829 52.4313 19.8133 175.2144 3 R 4.1239 8.4543 113.6575 57.3463 30.4670 176.5467 4 R 4.1441 8.3348 118.0505 57.2174 32.0661 175.5979 5 R 4.5636 7.3873 116.3630 54.3436 32.0959 177.7104 6 R 3.7621 8.7081 120.8954 57.2445 30.2154 173.5254 7 A 3.5756 7.6812 124.3213 52.1716 18.8978 176.0535 8 E 4.6220 8.4908 120.8509 53.8889 32.0479 176.2953 9 V 3.6147 8.4193 123.3479 63.2191 32.0704 175.2338 10 R 4.1782 8.2847 125.5009 55.7579 30.8239 175.4521 11 Q 4.3780 8.4294 125.5402 55.0045 30.2203 174.7248 12 L 4.5556 8.1847 123.6252 53.1206 44.2043 175.9137 13 Q 4.3445 8.2318 121.1568 53.7952 28.6903 173.1846 14 P 4.4093 0.0000 0.0000 61.9658 32.4689 175.6595 15 D 4.6436 8.4772 119.1251 54.5148 41.8601 177.1276 16 L 4.2037 8.5293 121.6353 56.4751 42.3767 178.3035 17 V 3.9167 7.9808 116.1910 64.1191 32.4739 175.9492 18 Y 4.3945 8.4403 116.0415 58.6883 38.9364 174.6698 19 G 4.1802 9.6820 106.5911 44.3012 0.0000 171.5300 20 D 4.6485 7.4765 118.2730 52.4241 44.6550 176.7553 21 V 3.7289 8.3779 118.9166 64.0445 31.0380 178.7530 22 L 3.9919 8.9295 120.7981 58.1935 41.5896 178.9371 23 V 3.1761 7.8976 117.9685 66.0717 31.2202 177.8985 24 T 3.6622 7.7484 108.5000 64.9142 69.0022 176.1542 25 A 3.9282 7.7244 124.3755 54.0732 18.2755 179.4586 26 F 4.3647 7.8123 118.6118 61.5818 39.5716 177.5973 27 I 3.3764 7.0505 118.7610 64.1743 36.5245 178.0545 28 N 4.3063 7.9898 116.8408 56.4591 38.5514 177.3509 29 K 4.0864 7.3147 116.2356 58.6622 32.1449 179.1532 30 I 3.7922 7.0050 119.9132 62.8111 37.3431 176.5091 31 M 3.9353 8.1360 120.0972 56.3254 32.4718 176.0736 32 R 4.7009 9.1480 127.0601 54.4760 30.6665 175.0723 33 D 5.7418 9.0747 128.1328 54.7898 43.5074 177.3243 34 G 3.9762 7.9621 105.9352 47.1597 0.0000 174.7457 35 K 4.6355 7.5391 112.7644 53.9585 32.8826 177.2920 36 K 3.8025 8.0424 122.6485 60.1773 32.1942 176.7425 37 N 4.3272 8.2841 115.8564 56.3604 38.2486 176.6267 38 L 4.1849 8.0653 121.0625 57.4315 42.0710 178.6137 39 A 4.1058 7.9714 120.2445 54.7035 18.4437 179.2983 40 A 4.1508 8.0729 119.6991 55.4294 18.4885 180.1023 41 R 4.1224 7.7287 116.7794 59.4858 29.6632 179.2676 42 I 4.0718 7.6359 118.0728 63.6064 36.9249 178.2899 43 F 4.2342 7.8504 120.6541 61.7103 39.3144 176.8379 44 Y 4.0237 7.8929 116.0581 60.8561 37.5533 177.7618 45 D 4.4633 8.6724 119.2170 57.0004 41.1223 178.5317 46 A 4.1394 7.7058 120.9325 55.4389 18.4175 179.4971 47 C 4.0941 7.6470 114.9173 62.6940 27.8240 176.4516 48 K 4.0837 8.0659 120.0064 58.5296 31.6648 178.1960 49 I 4.3738 7.6276 119.2760 61.4617 37.1812 177.0980 50 I 4.1469 7.8152 123.7316 63.6457 37.5262 178.1182 51 Q 4.3397 7.9807 117.3112 58.7268 28.6047 178.2670 52 E 4.1271 7.4906 119.3190 59.4481 29.8342 179.2199 53 K 4.2712 7.5452 116.0457 58.0656 32.2234 177.6328 54 T 4.4966 7.9098 114.0757 60.5587 70.2574 175.2320 55 G 3.9807 8.6546 122.1989 45.8496 0.0000 172.4788 56 Q 4.7131 7.3709 116.1541 52.7988 32.7995 176.4944 57 E 4.2035 8.5445 119.7945 55.9105 30.4591 175.9868 58 P 4.7116 0.0000 0.0000 63.3603 30.2661 177.0196 59 L 4.2290 7.8344 120.0100 55.4285 43.5615 177.3099 60 K 4.4177 7.8316 118.2520 58.1480 32.4862 178.2750 61 V 3.5850 7.4115 117.9114 65.8358 31.2448 177.4127 62 F 4.2152 8.0760 119.8364 60.6040 39.2340 177.0490 63 K 3.7831 7.5606 118.3997 58.8047 31.6270 177.5768 64 Q 4.1748 7.9342 117.1339 56.2587 29.2072 176.0720 65 A 4.4347 7.1172 118.9639 53.3746 19.4010 178.2741 66 V 3.7607 7.0019 116.3660 64.4251 32.3034 177.3289 67 E 3.8757 7.4950 118.5924 59.3366 29.3982 178.3994 68 N 4.5127 8.1202 113.9889 54.9749 38.6652 175.5038 69 V 4.2723 7.0341 118.1536 62.1505 32.3743 175.2924 70 K 4.1821 7.8899 119.3051 55.6310 31.4714 175.1346 71 P 4.4822 0.0000 0.0000 62.3974 31.3314 176.2562 72 R 4.0674 8.9241 124.3571 58.9675 30.2577 175.7587 73 M 5.3648 8.0701 114.6662 52.2780 35.2951 174.3139 74 E 4.8658 8.7346 119.9380 54.5549 33.7734 174.8296 75 V 4.5756 8.5019 115.0181 60.9136 32.7752 175.6828 76 R 4.7598 8.9370 125.2355 54.3015 32.5597 176.2605 77 S 4.6520 8.6377 116.6956 59.0512 63.6863 172.9271 78 R 4.3890 8.1170 121.0630 55.2572 33.4109 173.2998 79 R 3.9733 8.2230 124.8428 54.9671 31.2153 174.9441 80 V 3.5756 7.7824 127.6409 61.6991 32.2993 175.8452 81 G 4.2876 7.7385 114.6907 47.0062 0.0000 172.4491 82 G 3.9060 10.6169 114.9610 45.3512 0.0000 172.2261 83 A 4.3081 6.9588 119.7253 51.4336 21.6838 174.6946 84 N 5.0153 8.1430 116.6785 50.3589 40.3086 174.3137 85 Y 4.1555 7.8781 121.9514 58.2932 38.9370 176.4691 86 Q 4.4124 7.9944 117.4711 54.1888 30.8524 174.4701 87 V 4.1913 8.6580 124.1197 62.1783 32.4635 173.5712 88 P 5.1598 0.0000 0.0000 62.7071 32.8688 176.1669 89 M 4.1520 7.3783 114.4060 55.8519 36.0745 173.6022 90 E 4.3179 8.7499 117.7745 56.5169 30.9449 177.1027 91 V 4.2103 7.8623 123.7814 60.5949 32.0579 174.9415 92 S 4.2176 8.5391 122.8923 58.2040 63.7436 173.5263 93 P 4.1643 0.0000 0.0000 66.6517 30.4740 178.8137 94 R 3.9194 8.0306 115.8377 58.3085 30.0238 178.1119 95 R 4.1702 8.4534 118.3584 59.1273 30.6032 178.5848 96 Q 3.7507 7.5744 117.4018 58.7785 28.8958 179.6711 97 Q 3.8287 8.0270 120.4538 59.3639 29.0935 177.8670 98 S 4.0550 8.0614 115.7075 62.6818 62.7660 176.0135 99 L 3.4330 8.2720 121.7335 55.6561 40.8774 179.1472 100 A 4.1815 7.8178 120.6452 55.6492 18.7162 179.4740 101 L 4.1062 8.3459 117.5217 58.2917 41.7167 179.7687 102 R 3.8845 7.5915 118.2528 59.2718 29.9601 178.3842 103 W 4.5317 8.2601 118.8100 59.9854 29.0075 178.1774 104 L 4.1131 8.8623 119.1742 58.2897 41.0106 180.0523 105 V 3.6981 8.3760 118.0453 65.8593 31.4929 178.1598 106 Q 4.0494 8.5061 118.0124 58.8163 28.5929 178.1596 107 A 4.1098 8.5820 120.2862 54.6816 18.4213 179.3590 108 A 4.1571 7.8546 119.8688 55.4752 18.4894 179.6299 109 N 4.3729 7.6607 113.2014 56.1563 38.5696 177.3189 110 Q 4.1334 7.9082 118.9202 57.5376 29.2787 176.8271 111 R 3.9616 7.2588 118.5521 55.9217 30.7502 175.3637 112 P 4.3448 0.0000 0.0000 63.7130 31.9292 176.4657 113 E 3.9908 7.4252 120.3377 57.0982 29.4671 177.2184 114 R 4.2475 8.5938 121.9464 56.9468 30.8165 176.9189 115 R 4.6480 7.5563 117.7753 53.9027 33.3631 176.4824 116 A 3.9951 8.6304 124.5812 55.1376 18.3977 179.7711 117 A 4.0646 7.9102 118.8802 55.5565 18.5780 179.7857 118 V 3.5769 7.8782 110.0652 64.8260 31.4805 178.8751 119 R 4.2039 7.7005 117.2783 59.5470 29.7959 179.1863 120 I 3.8467 7.4969 117.9686 64.1760 37.4276 178.3734 121 A 4.1742 8.4388 122.1584 55.6551 18.4808 179.4817 122 H 4.2203 9.2140 115.6670 58.5668 28.8451 177.0960 123 E 4.2979 8.4692 120.4586 57.5182 29.3508 177.1915 124 L 4.4690 7.8055 117.4896 55.8066 42.0327 178.0885 125 M 4.0680 7.6184 119.1558 58.0297 32.6685 178.0314 126 D 4.6411 8.2164 118.4464 56.8866 41.0928 178.6239 127 A 4.1810 7.6984 120.0199 54.3854 18.5410 179.3065 128 A 4.0207 7.1578 119.6025 54.6674 18.5446 179.2780 129 E 4.0257 8.3569 116.8114 60.3324 30.4907 177.8332 130 G 4.1152 6.7913 104.5932 45.3787 0.0000 175.0812 131 K 4.4282 8.5696 113.0757 55.8978 34.1912 177.7957 132 G 4.0321 7.9836 108.4468 45.2947 0.0000 173.7576 133 G 3.7799 8.3593 104.1347 47.3802 0.0000 176.0153 134 A 4.0787 7.9198 122.4378 54.5746 18.4047 179.7304 135 V 3.5103 7.6862 116.7761 66.1103 31.2515 178.1061 136 K 4.0147 7.7021 116.7527 58.3151 31.6387 178.6594 137 K 3.5765 7.3635 116.8354 56.8636 32.7721 178.2759 138 K 3.5530 7.1210 119.9380 59.2839 32.3006 178.7245 139 E 3.9812 8.3033 119.0795 59.1581 29.4727 178.6624 140 D 4.3114 7.5152 117.5057 56.4765 41.1764 178.0756 141 V 3.8544 7.4926 118.8296 65.5099 31.4052 177.7635 142 E 4.0269 7.9457 117.3940 59.1632 29.1556 178.7631 143 R 4.0742 8.1172 118.2632 59.6273 30.1772 178.6657 144 M 4.0779 7.6410 116.8522 57.6775 31.9844 177.1055 145 A 4.3296 7.2732 119.2762 52.7412 19.3280 176.2025 146 E 3.9681 8.8616 120.3755 58.2019 28.1780 177.2866 147 A 4.0004 7.7406 118.2209 55.1164 18.8416 178.5882 148 N 4.7630 8.6574 112.8844 53.5120 38.7380 176.8453 149 R 4.0156 7.6821 120.7595 57.8559 30.1110 176.9146 150 A 3.8010 7.6859 120.6507 55.9112 18.7839 178.3096 151 Y 4.0585 7.1130 112.7933 56.9274 36.8046 175.8865 152 A 4.5391 7.3624 122.8366 53.0818 20.8653 178.3026 153 H 4.8166 8.1032 109.9883 56.1681 28.1315 175.1313 154 Y 5.1522 7.4767 117.5465 58.1112 38.3161 178.1147 155 R 3.9946 8.8126 121.3309 57.9798 30.5106 176.9343 156 W 4.2995 7.8909 118.1989 56.7859 30.2281 174.3574 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 2 A 8.26 4.31 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 3 R 8.45 4.12 0.00 1.87 1.96 0.00 3.24 0.00 0.00 3.23 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.73 0.00 4 R 8.33 4.14 0.00 1.84 1.88 0.00 3.25 0.00 0.00 3.23 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 5 R 7.39 4.56 0.00 1.90 1.82 0.00 3.20 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.65 0.00 6 R 8.71 3.76 0.00 1.76 1.98 0.00 3.38 0.00 0.00 3.22 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.64 0.00 7 A 7.68 3.58 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 8 E 8.49 4.62 0.00 1.92 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 0.00 2.18 2.24 0.00 9 V 8.42 3.61 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 0.74 0.00 0.00 0.91 0.00 0.00 10 R 8.28 4.18 0.00 1.80 1.79 0.00 3.27 0.00 0.00 3.14 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.60 0.00 11 Q 8.43 4.38 0.00 2.02 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.60 0.00 0.00 0.00 0.00 0.00 2.29 2.43 0.00 12 L 8.18 4.56 0.00 1.65 1.56 0.93 0.86 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 13 Q 8.23 4.34 0.00 2.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.88 0.00 0.00 0.00 0.00 0.00 2.27 2.36 0.00 14 P 0.00 4.41 0.00 2.10 2.12 0.00 3.75 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.14 0.00 15 D 8.48 4.64 0.00 2.85 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 16 L 8.53 4.20 0.00 1.69 1.70 0.95 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 17 V 7.98 3.92 1.82 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 0.45 0.00 0.00 0.59 0.00 0.00 18 Y 8.44 4.39 0.00 3.27 3.03 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 19 G 9.68 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 20 D 7.48 4.65 0.00 2.72 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 21 V 8.38 3.73 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 0.91 0.00 0.00 0.95 0.00 0.00 22 L 8.93 3.99 0.00 1.77 1.98 0.99 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 23 V 7.90 3.18 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 0.82 0.00 0.00 0.81 0.00 0.00 24 T 7.75 3.66 4.19 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 0.00 0.00 0.00 1.31 0.00 0.00 25 A 7.72 3.93 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 F 7.81 4.36 0.00 3.30 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 27 I 7.05 3.38 1.71 0.00 0.00 0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 -0.07 0.85 0.00 0.00 28 N 7.99 4.31 0.00 2.81 2.84 0.00 0.00 7.07 8.47 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 29 K 7.31 4.09 0.00 1.78 1.80 0.00 1.67 0.00 0.00 1.67 0.00 0.00 3.00 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.65 1.61 7.81 30 I 7.00 3.79 1.75 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.19 0.86 0.00 0.00 31 M 8.14 3.94 0.00 2.06 1.95 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 2.66 2.50 0.00 32 R 9.15 4.70 0.00 1.88 1.79 0.00 3.44 0.00 0.00 3.21 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.59 0.00 33 D 9.07 5.74 0.00 2.80 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 34 G 7.96 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 0.00 0.00 0.00 35 K 7.54 4.64 0.00 1.77 1.72 0.00 1.71 0.00 0.00 1.74 0.00 0.00 2.92 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.40 1.55 7.81 36 K 8.04 3.80 0.00 1.80 1.85 0.00 1.73 0.00 0.00 1.82 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.53 1.56 7.81 37 N 8.28 4.33 0.00 2.78 2.89 0.00 0.00 6.77 6.74 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 38 L 8.07 4.18 0.00 1.78 1.65 0.94 1.16 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 39 A 7.97 4.11 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 40 A 8.07 4.15 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.73 4.12 0.00 1.94 2.06 0.00 3.16 0.00 0.00 3.21 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.74 0.00 42 I 7.64 4.07 1.90 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 1.44 1.17 0.96 0.00 0.00 43 F 7.85 4.23 0.00 2.95 2.95 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 0.00 44 Y 7.89 4.02 0.00 3.21 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 45 D 8.67 4.46 0.00 2.75 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 46 A 7.71 4.14 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 47 C 7.65 4.09 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 48 K 8.07 4.08 0.00 2.05 1.87 0.00 1.68 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.48 1.71 7.81 49 I 7.63 4.37 2.01 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.19 0.97 0.00 0.00 50 I 7.82 4.15 2.06 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 1.73 0.83 0.92 0.00 0.00 51 Q 7.98 4.34 0.00 2.03 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 7.09 0.00 0.00 0.00 0.00 0.00 2.39 2.41 0.00 52 E 7.49 4.13 0.00 1.99 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 2.35 2.50 0.00 53 K 7.55 4.27 0.00 1.91 1.86 0.00 1.69 0.00 0.00 1.63 0.00 0.00 3.01 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.54 1.61 7.81 54 T 7.91 4.50 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 1.24 0.00 0.00 55 G 8.65 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 0.00 0.00 0.00 56 Q 7.37 4.71 0.00 2.01 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 6.76 0.00 0.00 0.00 0.00 0.00 2.28 2.43 0.00 57 E 8.54 4.20 0.00 2.04 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 2.44 2.39 0.00 58 P 0.00 4.71 0.00 2.29 2.17 0.00 3.83 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.13 0.00 59 L 7.83 4.23 0.00 1.72 1.71 0.78 0.69 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 60 K 7.83 4.42 0.00 2.03 1.77 0.00 1.66 0.00 0.00 1.75 0.00 0.00 3.00 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.44 1.53 7.81 61 V 7.41 3.58 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 0.91 0.00 0.00 1.01 0.00 0.00 62 F 8.08 4.22 0.00 3.02 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 63 K 7.56 3.78 0.00 2.00 1.89 0.00 1.49 0.00 0.00 1.56 0.00 0.00 2.94 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.42 1.45 7.81 64 Q 7.93 4.17 0.00 2.19 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.52 0.00 0.00 0.00 0.00 0.00 2.25 2.35 0.00 65 A 7.12 4.43 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 66 V 7.00 3.76 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.13 0.00 0.00 67 E 7.50 3.88 0.00 2.18 1.86 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 2.27 2.36 0.00 68 N 8.12 4.51 0.00 2.92 2.86 0.00 0.00 6.63 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 69 V 7.03 4.27 2.15 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 1.12 0.00 0.00 1.02 0.00 0.00 70 K 7.89 4.18 0.00 1.94 2.11 0.00 1.90 0.00 0.00 1.88 0.00 0.00 2.99 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.45 1.67 7.81 71 P 0.00 4.48 0.00 2.41 2.62 0.00 3.94 0.00 0.00 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.09 0.00 72 R 8.92 4.07 0.00 1.93 1.99 0.00 3.18 0.00 0.00 3.34 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.73 0.00 73 M 8.07 5.36 0.00 2.04 1.92 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 2.51 2.36 0.00 74 E 8.73 4.87 0.00 2.11 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 0.00 2.30 2.38 0.00 75 V 8.50 4.58 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 0.80 0.00 0.00 1.00 0.00 0.00 76 R 8.94 4.76 0.00 1.98 1.99 0.00 3.17 0.00 0.00 3.17 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.66 0.00 77 S 8.64 4.65 0.00 3.90 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 78 R 8.12 4.39 0.00 1.81 1.68 0.00 2.61 0.00 0.00 2.52 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.44 0.00 79 R 8.22 3.97 0.00 1.67 1.63 0.00 3.33 0.00 0.00 2.99 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.42 0.00 80 V 7.78 3.58 1.60 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 0.61 0.00 0.00 0.52 0.00 0.00 81 G 7.74 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 0.00 0.00 0.00 0.00 82 G 10.62 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 0.00 0.00 0.00 83 A 6.96 4.31 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 84 N 8.14 5.02 0.00 2.51 2.78 0.00 0.00 7.29 7.46 0.00 0.00 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 7.88 4.16 0.00 2.70 2.23 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 0.00 86 Q 7.99 4.41 0.00 2.09 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.21 7.00 0.00 0.00 0.00 0.00 0.00 2.25 2.31 0.00 87 V 8.66 4.19 2.36 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 1.39 0.00 0.00 1.19 0.00 0.00 88 P 0.00 5.16 0.00 2.17 2.10 0.00 4.23 0.00 0.00 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.16 0.00 89 M 7.38 4.15 0.00 2.07 2.22 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.37 0.00 90 E 8.75 4.32 0.00 1.84 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 2.29 2.29 0.00 91 V 7.86 4.21 2.23 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 0.77 0.00 0.00 1.04 0.00 0.00 92 S 8.54 4.22 0.00 3.77 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 93 P 0.00 4.16 0.00 2.23 2.32 0.00 3.69 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.07 0.00 94 R 8.03 3.92 0.00 1.76 2.03 0.00 3.17 0.00 0.00 3.13 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.68 0.00 95 R 8.45 4.17 0.00 1.76 2.02 0.00 3.09 0.00 0.00 3.13 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.56 0.00 96 Q 7.57 3.75 0.00 2.28 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.70 0.00 0.00 0.00 0.00 0.00 2.62 2.74 0.00 97 Q 8.03 3.83 0.00 2.10 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.68 0.00 0.00 0.00 0.00 0.00 2.35 2.37 0.00 98 S 8.06 4.06 0.00 3.85 3.85 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 0.00 0.00 0.00 99 L 8.27 3.43 0.00 1.25 0.13 0.74 0.53 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 0.00 100 A 7.82 4.18 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 0.00 101 L 8.35 4.11 0.00 1.85 1.92 0.99 1.00 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 0.00 102 R 7.59 3.88 0.00 1.87 1.85 0.00 3.05 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.66 0.00 103 W 8.26 4.53 0.00 3.68 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 0.00 104 L 8.86 4.11 0.00 2.17 2.08 0.98 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 105 V 8.38 3.70 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 1.00 0.00 0.00 0.80 0.00 0.00 106 Q 8.51 4.05 0.00 2.40 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.54 0.00 0.00 0.00 0.00 0.00 2.44 2.65 0.00 107 A 8.58 4.11 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 0.00 0.00 108 A 7.85 4.16 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 0.00 0.00 0.00 0.00 0.00 0.00 109 N 7.66 4.37 0.00 2.84 2.92 0.00 0.00 7.16 7.54 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 0.00 110 Q 7.91 4.13 0.00 2.09 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.71 0.00 0.00 0.00 0.00 0.00 2.41 2.67 0.00 111 R 7.26 3.96 0.00 2.10 1.92 0.00 3.26 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.86 0.00 112 P 0.00 4.34 0.00 2.19 2.17 0.00 3.79 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 2.00 2.00 0.00 113 E 7.43 3.99 0.00 1.92 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 2.35 2.38 0.00 114 R 8.59 4.25 0.00 1.80 1.97 0.00 3.16 0.00 0.00 3.23 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.65 0.00 115 R 7.56 4.65 0.00 1.81 1.80 0.00 3.14 0.00 0.00 3.35 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.65 0.00 116 A 8.63 4.00 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 0.00 117 A 7.91 4.06 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 0.00 118 V 7.88 3.58 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 0.87 0.00 0.00 0.90 0.00 0.00 119 R 7.70 4.20 0.00 2.02 2.14 0.00 3.39 0.00 0.00 3.42 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.94 0.00 120 I 7.50 3.85 2.00 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.81 1.30 0.00 0.00 121 A 8.44 4.17 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 H 9.21 4.22 0.00 3.15 3.38 0.00 5.63 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 E 8.47 4.30 0.00 2.29 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 0.00 2.54 2.49 0.00 124 L 7.81 4.47 0.00 1.99 1.71 1.06 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 125 M 7.62 4.07 0.00 2.05 2.24 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 2.79 2.62 0.00 126 D 8.22 4.64 0.00 2.84 2.80 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 0.00 127 A 7.70 4.18 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 0.00 128 A 7.16 4.02 1.41 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 0.00 0.00 129 E 8.36 4.03 0.00 1.91 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 2.31 2.31 0.00 130 G 6.79 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 0.00 131 K 8.57 4.43 0.00 1.77 1.82 0.00 1.60 0.00 0.00 1.70 0.00 0.00 3.19 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.34 1.36 7.81 132 G 7.98 4.03 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 0.00 133 G 8.36 3.78 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 A 7.92 4.08 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 0.00 0.00 135 V 7.69 3.51 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 1.10 0.00 0.00 0.96 0.00 0.00 136 K 7.70 4.01 0.00 1.94 1.75 0.00 1.66 0.00 0.00 1.61 0.00 0.00 2.90 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.51 1.58 7.81 137 K 7.36 3.58 0.00 0.94 0.74 0.00 1.66 0.00 0.00 1.47 0.00 0.00 2.54 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.14 1.25 7.81 138 K 7.12 3.55 0.00 1.84 1.82 0.00 1.88 0.00 0.00 1.64 0.00 0.00 3.23 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.43 1.73 7.81 139 E 8.30 3.98 0.00 1.94 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 2.29 2.42 0.00 140 D 7.52 4.31 0.00 2.73 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 0.00 141 V 7.49 3.85 2.26 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 1.15 0.00 0.00 1.06 0.00 0.00 142 E 7.95 4.03 0.00 2.11 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 2.33 2.64 0.00 143 R 8.12 4.07 0.00 2.01 1.98 0.00 3.11 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.81 0.00 144 M 7.64 4.08 0.00 2.17 2.31 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 2.65 2.99 0.00 145 A 7.27 4.33 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 0.00 146 E 8.86 3.97 0.00 2.17 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 2.29 2.23 0.00 147 A 7.74 4.00 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 0.00 148 N 8.66 4.76 0.00 2.97 3.17 0.00 0.00 6.68 7.54 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 0.00 149 R 7.68 4.02 0.00 1.86 2.04 0.00 3.40 0.00 0.00 3.20 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.64 0.00 150 A 7.69 3.80 0.59 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 0.00 0.00 151 Y 7.11 4.06 0.00 2.83 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 0.00 152 A 7.36 4.54 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 0.00 153 H 8.10 4.82 0.00 3.35 3.36 0.00 5.48 0.00 0.00 0.00 0.00 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 Y 7.48 5.15 0.00 3.06 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 0.00 155 R 8.81 3.99 0.00 1.89 2.07 0.00 3.31 0.00 0.00 3.32 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 2.12 0.00 156 W 7.89 4.30 0.00 3.69 3.24 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