NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 4.1460 8.0549 114.0568 61.0791 33.0313 174.7787 2 L 4.0510 8.3024 124.3558 51.9156 42.5109 175.9209 3 S 4.4592 9.2929 119.0309 58.0402 66.0452 174.8842 4 E 4.2860 8.7703 121.5414 59.3239 29.2160 178.6416 5 G 3.6562 8.1064 105.4876 47.8039 0.0000 175.4066 6 E 3.9543 8.1432 120.8735 58.8711 29.4473 179.3431 7 W 4.2283 8.2184 119.1510 59.7548 29.0140 178.4790 8 Q 4.1319 8.4595 118.1063 59.1357 28.0323 178.9833 9 L 4.0764 7.7889 120.0568 57.6368 41.6236 179.8611 10 V 3.7696 7.7920 117.7806 66.2596 31.6616 178.2197 11 L 4.3204 8.3685 118.4832 57.5872 41.0048 178.9510 12 H 4.2130 8.7762 119.2020 59.3729 29.8141 177.7548 13 V 3.4959 7.8307 114.3619 63.9888 31.3813 178.3799 14 W 3.9182 8.4732 128.1300 60.1801 30.2777 177.7880 15 A 3.9926 7.9805 120.1851 55.0066 17.9505 179.4999 16 K 3.9160 7.3971 116.5776 59.6370 32.1699 179.5677 17 V 2.8291 7.0777 118.3588 65.8025 30.9296 177.2353 18 E 3.9745 7.4486 115.2403 57.4189 29.4012 178.2762 19 A 4.1710 7.7875 121.4748 54.0362 19.7018 177.7815 20 D 4.6473 7.8251 115.6059 52.2981 43.1589 175.5756 21 V 3.4846 7.8234 123.2883 65.7656 32.1524 176.8178 22 A 4.0511 7.9280 120.0719 55.1413 18.4313 179.7103 23 G 3.5951 8.2741 105.6069 47.6540 0.0000 175.7458 24 H 4.1976 8.2172 118.4402 58.5174 28.6969 178.1343 25 G 3.5689 8.3948 108.0173 47.6659 0.0000 175.6346 26 Q 3.8280 7.8644 121.4151 59.0749 29.1714 177.8037 27 D 4.3118 7.8385 119.6973 57.4378 40.7377 179.0719 28 I 3.6404 7.6328 120.0583 64.4745 37.1335 178.5813 29 L 3.3810 7.7774 119.7490 57.5207 41.1990 179.7523 30 I 3.6994 7.6668 119.8958 64.0938 36.9320 178.3579 31 R 3.7995 7.8834 119.6237 59.2138 29.8320 178.1937 32 L 3.9274 7.8944 120.2319 58.4737 41.9822 179.1295 33 F 4.5684 8.0479 117.6112 60.3784 38.5346 178.0311 34 K 4.0199 8.2218 117.8697 59.5656 32.0396 179.3294 35 S 4.2954 8.1307 114.5191 60.3462 63.9092 174.3800 36 H 4.6255 8.2055 119.1356 52.0331 29.1986 171.9453 37 P 4.6057 0.0000 0.0000 64.5018 30.8776 177.5513 38 E 4.1044 8.2403 116.4124 59.4167 29.4805 179.1565 39 T 3.7895 8.2248 111.4679 64.5891 68.7939 176.2677 40 L 3.6425 7.9258 122.8286 57.6823 41.7750 178.4213 41 E 4.1138 7.7696 117.1962 58.4738 29.6323 178.3861 42 K 4.3542 7.9920 116.9395 57.2670 32.3838 177.1223 43 F 4.6044 8.0281 118.9343 55.6398 39.6031 175.7267 44 D 4.4273 8.6071 125.4543 57.2879 40.5369 178.8811 45 R 3.6554 7.7880 113.7254 57.7762 29.9921 176.8151 46 F 5.0371 7.3542 115.7555 57.0909 40.4544 177.2655 47 K 3.9641 7.8700 120.1159 59.3402 31.8814 177.5097 48 H 4.4595 8.1646 112.0448 56.3576 29.0278 174.9533 49 L 4.3047 7.5875 121.7984 53.9991 42.1118 176.1273 50 K 4.3375 9.8710 124.2488 57.2048 33.9476 177.0321 51 T 4.6501 7.5393 107.5214 59.2441 72.7809 174.5350 52 E 3.8855 8.5738 121.0116 59.3579 29.7318 178.5093 53 A 3.9953 7.9714 120.2731 55.3767 18.2569 179.3168 54 E 3.9662 7.9788 115.8896 59.6482 29.7366 179.3164 55 M 4.1609 7.9542 118.8132 58.4299 31.8841 178.9628 56 K 3.9467 8.3077 117.2974 58.9274 32.2443 178.3992 57 A 4.4760 7.5092 118.6132 51.7645 19.4602 177.1150 58 S 4.2361 7.5413 113.4213 57.6859 62.7615 174.5342 59 E 4.0235 8.8554 129.1455 59.2349 29.4371 178.0410 60 D 4.4117 8.1291 117.9954 56.8972 41.3614 177.6980 61 L 3.5649 8.1030 121.0374 58.0339 42.1602 178.8675 62 K 3.8438 7.8711 119.0192 59.3156 32.1739 178.4998 63 K 3.9373 8.3171 120.0635 59.9237 32.1599 178.3155 64 H 4.4488 8.5682 118.6444 58.8662 29.7606 177.2892 65 G 3.6667 8.2805 107.9677 47.8971 0.0000 175.6940 66 V 3.6038 7.7093 120.6703 65.8979 31.6197 178.0208 67 T 3.8955 7.7818 115.0592 66.7359 68.3270 176.6896 68 V 3.6111 7.8088 119.7607 66.1850 31.6112 178.1998 69 L 4.3001 7.9991 118.4424 57.8384 41.4035 179.6622 70 T 4.0401 8.2049 116.0473 66.4347 68.2582 176.7203 71 A 4.0571 8.0075 122.4005 54.7785 18.3842 179.5114 72 L 3.6935 8.1798 119.1621 58.1729 42.1733 179.4139 73 G 3.3184 8.5115 105.8685 47.6738 0.0000 175.4878 74 A 4.0072 7.7630 122.0587 54.6778 18.5475 179.6175 75 I 3.8437 7.2923 118.3625 64.4768 37.4109 178.3556 76 L 3.9366 7.8638 120.1497 57.7053 41.1846 179.1176 77 K 4.1478 7.7420 115.1917 57.3117 32.2103 178.3050 78 K 4.0350 8.0336 119.3939 55.4392 33.2402 176.0732 79 K 2.0000 8.1687 118.3806 56.3601 29.6940 174.4013 80 G 4.0311 7.6411 105.8513 45.9467 0.0000 173.1500 81 H 4.4866 7.5781 118.5695 55.4411 27.5974 175.5467 82 H 5.1689 7.1618 112.4767 54.7176 29.9972 176.2092 83 E 3.9671 8.2377 122.5511 60.5211 29.1667 178.9133 84 A 4.0785 7.9317 118.4549 54.9506 17.2778 178.9991 85 E 4.1243 8.0921 116.9310 59.2628 29.7392 178.7136 86 L 4.3044 8.2773 120.4410 57.5222 42.2028 178.7596 87 K 3.9770 8.0127 119.5869 58.8179 32.1189 177.1492 88 P 4.3043 0.0000 0.0000 65.0300 31.2370 178.2717 89 L 4.0149 7.5008 117.0774 58.1119 42.0188 178.8128 90 A 4.1094 8.1992 120.7813 55.3636 18.3733 179.3585 91 Q 3.8213 8.0512 116.7221 59.2876 28.7544 179.7068 92 S 3.9948 8.0967 114.9595 61.8272 63.0996 176.1541 93 H 4.1677 8.6786 119.6405 57.7149 28.4927 177.7970 94 A 3.0828 7.8889 123.4191 54.7770 17.9515 179.3405 95 T 3.7234 7.1340 105.9262 62.6765 69.5907 175.8746 96 K 4.0828 7.4090 121.0649 58.6512 32.8615 177.1953 97 H 4.2888 7.8543 114.5191 56.2449 29.4324 175.3684 98 K 3.8125 7.5974 116.0133 56.7436 28.3932 176.2007 99 I 4.3157 8.3738 119.5890 58.8110 38.6042 175.1528 100 P 5.0250 0.0000 0.0000 61.8466 32.0641 177.4150 101 I 3.4105 8.0915 120.4851 64.3490 36.8090 178.5253 102 K 3.6921 7.7552 120.1011 59.5721 31.9313 178.2453 103 Y 4.0940 7.7672 116.9310 60.6666 37.7411 178.0843 104 L 4.1454 7.9217 120.0672 57.1870 41.7239 178.9854 105 E 3.9427 7.8472 119.2714 59.1123 29.7065 178.4032 106 F 4.4656 7.6849 117.8463 61.0102 39.0163 177.6664 107 I 3.8669 8.2496 117.8652 63.9659 37.7387 178.0997 108 S 4.2009 8.2717 116.5088 61.6821 62.5944 176.3999 109 E 4.1398 8.3487 120.9420 59.0061 29.1769 179.2651 110 A 4.0311 8.0087 121.1221 55.1698 18.4739 179.6847 111 I 3.7080 8.0903 118.5728 64.7262 37.3269 178.8217 112 I 3.9100 8.0244 120.6470 64.3764 36.8981 178.0439 113 H 4.1527 8.5546 119.4257 59.3469 29.7656 177.5940 114 V 3.5234 7.9254 120.0463 65.9140 31.3857 177.7976 115 L 3.7902 7.8669 118.7755 58.0700 41.0579 179.1066 116 H 4.3198 7.7524 116.8769 59.3229 29.9040 177.2535 117 S 4.1471 7.8167 116.2093 60.9529 62.7104 175.9712 118 R 4.2665 7.6218 118.5938 56.4924 31.7423 176.2574 119 H 4.9457 7.9431 116.0327 53.6289 29.7863 172.4564 120 P 4.2202 0.0000 0.0000 66.1095 31.8318 179.7109 121 G 3.3131 8.1292 105.7163 48.0908 0.0000 173.6397 122 D 4.8624 8.1814 117.4175 54.1333 41.8226 176.3373 123 F 5.0108 8.8090 121.1110 56.2905 39.4029 174.3077 124 G 3.9202 7.5484 109.5546 44.1146 0.0000 171.3865 125 A 3.8752 8.4330 120.7822 54.9518 18.4554 179.6826 126 D 4.1611 7.9533 117.0472 56.5674 39.4420 178.5391 127 A 3.8700 7.7287 122.0561 54.7338 18.4876 179.1468 128 Q 3.1859 7.6007 118.3850 58.9815 28.9628 178.8357 129 G 3.5086 8.4883 106.9149 47.6264 0.0000 175.6144 130 A 3.9088 7.8047 122.7194 54.8999 18.3255 179.4408 131 M 4.0216 8.2724 117.1168 58.5457 32.2441 177.8312 132 N 4.2740 8.2101 117.2589 56.8472 39.1732 176.7531 133 K 3.7952 7.9098 119.4499 59.5486 32.0969 179.1762 134 A 3.8720 7.8846 120.7718 55.1698 18.3379 179.7623 135 L 4.0638 8.1863 117.6796 57.7983 41.5638 179.6753 136 E 3.9806 8.5219 119.0163 59.2164 29.4522 178.8671 137 L 3.9623 8.0318 120.4113 58.3068 42.2573 178.7414 138 F 4.2307 8.2903 120.4282 61.5225 39.2004 177.1010 139 R 3.6128 8.1828 118.2432 58.9672 29.9884 178.3432 140 K 3.8942 8.2011 119.8059 59.3505 32.0124 178.6133 141 D 4.4217 8.2297 119.2829 57.0031 40.6601 178.8530 142 I 3.6024 7.4492 120.0508 64.2166 36.9774 178.2943 143 A 3.7678 8.0597 121.6031 54.8561 18.0904 179.5446 144 A 3.9409 7.8591 119.1025 55.3191 18.4160 180.0640 145 K 4.0246 7.9083 117.0121 59.5299 32.1667 179.0304 146 Y 4.0868 8.5711 117.6176 61.0516 37.8037 178.7408 147 K 3.9032 8.4917 120.4726 59.5687 32.1272 177.9634 148 E 3.9055 7.8268 118.1690 59.6860 29.6113 178.6769 149 L 4.3687 7.6584 115.3979 55.3827 41.9601 177.6350 150 G 3.9607 8.0674 106.9981 46.0603 0.0000 173.6847 151 Y 4.3392 8.1127 115.3496 56.7846 39.4911 175.5137 152 Q 3.8140 8.0528 120.7352 57.9168 29.3900 177.1732 153 G 4.0131 9.1005 113.5842 45.7751 0.0000 172.4638 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 4.15 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 0.94 0.00 0.00 0.95 0.00 0.00 2 L 8.30 4.05 0.00 0.65 0.61 0.62 -0.48 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 3 S 9.29 4.46 0.00 4.01 4.01 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 4 E 8.77 4.29 0.00 2.19 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 2.43 2.52 0.00 5 G 8.11 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 6 E 8.14 3.95 0.00 1.94 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 0.00 2.20 2.25 0.00 7 W 8.22 4.23 0.00 3.56 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 0.00 8 Q 8.46 4.13 0.00 2.44 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.80 0.00 0.00 0.00 0.00 0.00 2.44 2.49 0.00 9 L 7.79 4.08 0.00 1.82 1.74 0.92 0.79 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 10 V 7.79 3.77 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.85 0.00 0.00 11 L 8.37 4.32 0.00 1.95 1.82 0.96 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 12 H 8.78 4.21 0.00 3.41 3.40 0.00 5.78 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 V 7.83 3.50 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 1.08 0.00 0.00 1.25 0.00 0.00 14 W 8.47 3.92 0.00 3.64 3.14 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 0.00 0.00 0.00 0.00 15 A 7.98 3.99 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 16 K 7.40 3.92 0.00 1.32 1.69 0.00 1.64 0.00 0.00 1.46 0.00 0.00 2.73 0.00 0.00 3.33 0.00 0.00 0.00 0.00 1.57 1.47 7.81 17 V 7.08 2.83 0.85 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 -0.04 0.00 0.00 0.23 0.00 0.00 18 E 7.45 3.97 0.00 2.01 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 2.20 2.13 0.00 19 A 7.79 4.17 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 20 D 7.83 4.65 0.00 2.71 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 7.82 3.48 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 1.04 0.00 0.00 0.89 0.00 0.00 22 A 7.93 4.05 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 23 G 8.27 3.60 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 0.00 0.00 0.00 24 H 8.22 4.20 0.00 3.32 3.22 0.00 5.82 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 25 G 8.39 3.57 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 0.00 0.00 0.00 26 Q 7.86 3.83 0.00 2.23 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.72 0.00 0.00 0.00 0.00 0.00 2.28 2.32 0.00 27 D 7.84 4.31 0.00 2.75 2.64 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.63 3.64 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 1.52 0.70 0.88 0.00 0.00 29 L 7.78 3.38 0.00 1.34 0.94 0.72 0.45 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 30 I 7.67 3.70 1.86 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.70 0.89 0.00 0.00 31 R 7.88 3.80 0.00 1.98 2.10 0.00 3.08 0.00 0.00 3.04 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 32 L 7.89 3.93 0.00 1.73 1.39 1.08 1.33 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 33 F 8.05 4.57 0.00 3.07 2.82 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 34 K 8.22 4.02 0.00 1.78 1.84 0.00 1.72 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.50 1.70 7.81 35 S 8.13 4.30 0.00 3.79 3.61 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 36 H 8.21 4.63 0.00 3.07 3.01 0.00 5.63 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 37 P 0.00 4.61 0.00 2.15 2.09 0.00 3.80 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.98 0.00 38 E 8.24 4.10 0.00 2.28 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 2.23 2.54 0.00 39 T 8.22 3.79 4.48 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 0.97 0.00 0.00 40 L 7.93 3.64 0.00 1.37 1.72 -0.20 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 41 E 7.77 4.11 0.00 2.06 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 2.36 2.43 0.00 42 K 7.99 4.35 0.00 1.79 1.56 0.00 1.93 0.00 0.00 1.74 0.00 0.00 3.19 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.69 1.86 7.81 43 F 8.03 4.60 0.00 3.20 2.89 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 44 D 8.61 4.43 0.00 2.65 2.70 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 45 R 7.79 3.66 0.00 1.57 1.81 0.00 2.74 0.00 0.00 2.77 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.50 0.00 46 F 7.35 5.04 0.00 2.74 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 47 K 7.87 3.96 0.00 1.76 1.91 0.00 1.67 0.00 0.00 2.20 0.00 0.00 3.17 0.00 0.00 3.25 0.00 0.00 0.00 0.00 1.62 1.60 7.81 48 H 8.16 4.46 0.00 3.29 3.42 0.00 5.52 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 L 7.59 4.30 0.00 1.62 1.56 0.84 0.64 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 50 K 9.87 4.34 0.00 1.86 1.82 0.00 1.66 0.00 0.00 1.75 0.00 0.00 3.06 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.55 1.49 7.81 51 T 7.54 4.65 4.23 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 1.20 0.00 0.00 52 E 8.57 3.89 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 2.36 2.36 0.00 53 A 7.97 4.00 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 54 E 7.98 3.97 0.00 2.12 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 2.35 2.35 0.00 55 M 7.95 4.16 0.00 2.06 2.28 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.55 0.00 56 K 8.31 3.95 0.00 1.88 1.86 0.00 1.67 0.00 0.00 1.68 0.00 0.00 3.03 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.44 1.52 7.81 57 A 7.51 4.48 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 58 S 7.54 4.24 0.00 3.89 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 59 E 8.86 4.02 0.00 2.14 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 2.45 0.00 60 D 8.13 4.41 0.00 2.94 2.89 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 61 L 8.10 3.56 0.00 1.51 1.71 0.21 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 62 K 7.87 3.84 0.00 1.87 1.95 0.00 1.69 0.00 0.00 1.57 0.00 0.00 2.87 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.43 1.42 7.81 63 K 8.32 3.94 0.00 2.08 2.10 0.00 1.72 0.00 0.00 1.61 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.51 1.51 7.81 64 H 8.57 4.45 0.00 3.63 3.44 0.00 5.85 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 65 G 8.28 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 0.00 0.00 0.00 66 V 7.71 3.60 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 1.04 0.00 0.00 0.99 0.00 0.00 67 T 7.78 3.90 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 1.26 0.00 0.00 68 V 7.81 3.61 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 1.09 0.00 0.00 1.00 0.00 0.00 69 L 8.00 4.30 0.00 1.81 1.84 0.90 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 70 T 8.20 4.04 4.50 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 1.26 0.00 0.00 71 A 8.01 4.06 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 72 L 8.18 3.69 0.00 1.73 1.74 0.12 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 73 G 8.51 3.32 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 0.00 74 A 7.76 4.01 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 75 I 7.29 3.84 1.82 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.62 0.88 0.00 0.00 76 L 7.86 3.94 0.00 1.29 1.53 -0.17 0.70 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 K 7.74 4.15 0.00 1.72 1.78 0.00 1.69 0.00 0.00 1.72 0.00 0.00 3.16 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.46 1.48 7.81 78 K 8.03 4.04 0.00 1.79 1.79 0.00 1.76 0.00 0.00 1.56 0.00 0.00 2.89 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.61 1.58 7.81 79 K 8.17 2.00 0.00 1.23 0.74 0.00 1.54 0.00 0.00 1.45 0.00 0.00 2.71 0.00 0.00 3.01 0.00 0.00 0.00 0.00 0.51 0.79 7.81 80 G 7.64 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 81 H 7.58 4.49 0.00 3.11 3.25 0.00 5.82 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 H 7.16 5.17 0.00 3.33 3.46 0.00 5.65 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 83 E 8.24 3.97 0.00 2.09 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 0.00 2.41 2.47 0.00 84 A 7.93 4.08 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 85 E 8.09 4.12 0.00 2.26 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 2.40 2.43 0.00 86 L 8.28 4.30 0.00 1.89 1.69 0.88 0.88 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 87 K 8.01 3.98 0.00 1.92 1.90 0.00 1.70 0.00 0.00 1.66 0.00 0.00 2.98 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.49 7.81 88 P 0.00 4.30 0.00 2.23 2.10 0.00 3.81 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.15 0.00 89 L 7.50 4.01 0.00 1.79 1.87 1.03 1.21 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 90 A 8.20 4.11 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 91 Q 8.05 3.82 0.00 2.31 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.76 0.00 0.00 0.00 0.00 0.00 2.34 2.42 0.00 92 S 8.10 3.99 0.00 3.98 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 93 H 8.68 4.17 0.00 3.45 3.55 0.00 5.81 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 94 A 7.89 3.08 -0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.13 3.72 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 0.88 0.00 0.00 96 K 7.41 4.08 0.00 1.55 1.44 0.00 1.66 0.00 0.00 1.67 0.00 0.00 3.03 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.27 1.35 7.81 97 H 7.85 4.29 0.00 3.05 3.22 0.00 5.84 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 K 7.60 3.81 0.00 1.91 1.90 0.00 1.88 0.00 0.00 2.46 0.00 0.00 3.02 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.35 7.81 99 I 8.37 4.32 2.06 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 1.58 0.99 1.09 0.00 0.00 100 P 0.00 5.02 0.00 1.88 1.97 0.00 3.16 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.27 0.00 101 I 8.09 3.41 1.69 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.82 0.70 0.00 0.00 102 K 7.76 3.69 0.00 1.70 1.57 0.00 1.52 0.00 0.00 1.78 0.00 0.00 3.21 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.45 0.75 7.81 103 Y 7.77 4.09 0.00 3.17 3.05 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 0.00 0.00 0.00 104 L 7.92 4.15 0.00 1.74 1.72 0.62 0.61 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 0.00 105 E 7.85 3.94 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 2.44 2.42 0.00 106 F 7.68 4.47 0.00 3.25 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 0.00 107 I 8.25 3.87 2.01 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.62 1.07 0.00 0.00 108 S 8.27 4.20 0.00 4.17 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 0.00 109 E 8.35 4.14 0.00 2.12 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 0.00 2.74 2.60 0.00 110 A 8.01 4.03 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 0.00 111 I 8.09 3.71 2.11 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 1.59 1.13 1.05 0.00 0.00 112 I 8.02 3.91 2.00 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.27 1.15 0.00 0.00 113 H 8.55 4.15 0.00 3.41 3.49 0.00 5.78 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 V 7.93 3.52 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 0.88 0.00 0.00 0.96 0.00 0.00 115 L 7.87 3.79 0.00 1.09 0.41 0.77 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 116 H 7.75 4.32 0.00 3.52 3.55 0.00 5.95 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 S 7.82 4.15 0.00 3.93 3.81 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 0.00 118 R 7.62 4.27 0.00 1.46 1.54 0.00 2.75 0.00 0.00 2.75 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.58 0.00 119 H 7.94 4.95 0.00 3.17 3.16 0.00 5.65 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 P 0.00 4.22 0.00 2.17 2.11 0.00 3.58 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.05 0.00 121 G 8.13 3.31 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 0.00 122 D 8.18 4.86 0.00 2.75 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 0.00 123 F 8.81 5.01 0.00 2.88 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 0.00 124 G 7.55 3.92 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 0.00 0.00 0.00 125 A 8.43 3.88 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 0.00 126 D 7.95 4.16 0.00 2.82 2.88 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 0.00 127 A 7.73 3.87 1.22 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 0.00 0.00 128 Q 7.60 3.19 0.00 1.36 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 2.25 2.35 0.00 129 G 8.49 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.80 3.91 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 0.00 131 M 8.27 4.02 0.00 2.37 2.44 0.00 0.00 0.00 0.00 0.00 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.87 0.00 132 N 8.21 4.27 0.00 2.98 2.94 0.00 0.00 7.20 6.63 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 0.00 133 K 7.91 3.80 0.00 1.87 1.69 0.00 1.55 0.00 0.00 1.55 0.00 0.00 2.89 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.39 1.52 7.81 134 A 7.88 3.87 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 0.00 135 L 8.19 4.06 0.00 1.88 1.81 0.99 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 136 E 8.52 3.98 0.00 2.20 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 2.34 2.56 0.00 137 L 8.03 3.96 0.00 1.90 1.99 1.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 138 F 8.29 4.23 0.00 3.04 3.20 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 0.00 139 R 8.18 3.61 0.00 2.22 1.96 0.00 3.10 0.00 0.00 3.02 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.57 0.00 140 K 8.20 3.89 0.00 1.83 2.02 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.46 7.81 141 D 8.23 4.42 0.00 2.75 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 0.00 142 I 7.45 3.60 1.55 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.06 0.42 0.00 0.00 143 A 8.06 3.77 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 0.00 144 A 7.86 3.94 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 0.00 145 K 7.91 4.02 0.00 2.04 1.92 0.00 1.59 0.00 0.00 1.67 0.00 0.00 3.18 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.48 1.54 7.81 146 Y 8.57 4.09 0.00 3.07 3.17 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 0.00 147 K 8.49 3.90 0.00 1.94 2.03 0.00 1.68 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.47 7.81 148 E 7.83 3.91 0.00 2.04 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 0.00 2.36 2.41 0.00 149 L 7.66 4.37 0.00 1.92 1.92 0.81 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 150 G 8.07 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 0.00 151 Y 8.11 4.34 0.00 2.60 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 0.00 152 Q 8.05 3.81 0.00 2.07 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.58 0.00 0.00 0.00 0.00 0.00 2.37 2.50 0.00 153 G 9.10 4.01 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 0.00 0.00 0.00