NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2299 8.3144 121.7898 55.9192 33.2416 174.6529 2 E 4.0695 8.2346 122.5220 53.7836 30.4857 174.7590 3 T 4.1680 8.6189 117.6311 61.2211 72.0841 175.0494 4 A 4.0085 8.5097 123.0849 55.2633 18.4421 179.8678 5 A 3.9366 8.0001 118.5807 55.3725 18.5768 179.6270 6 A 4.2998 8.0802 120.6857 54.5360 18.4351 179.7790 7 K 4.1736 8.3032 119.7562 59.0023 32.1905 178.8706 8 F 4.0659 8.3195 121.0509 61.2077 39.3500 176.8934 9 E 3.9694 8.3331 118.1919 59.5233 29.0934 179.3756 10 R 3.9893 7.8453 117.2477 59.6032 30.2435 178.2230 11 Q 3.9867 8.0298 116.3128 57.6614 29.1014 176.5152 12 A 4.3878 7.8063 120.6917 51.4837 21.6566 176.6332 13 M 4.5203 8.0332 115.6546 54.6905 33.2649 177.1995 14 D 4.8102 8.8932 122.5530 53.2409 41.2133 175.6946 15 S 4.5393 8.3213 114.6889 59.2121 63.7764 175.5940 16 S 4.3955 7.9363 115.2668 59.6337 63.3209 174.2514 17 T 4.7350 7.5050 110.2758 59.6205 71.4599 174.0496 18 S 4.1927 8.6102 117.1054 60.7442 63.7026 173.9021 19 A 3.8247 6.8962 119.8410 50.9803 21.1656 175.3285 20 A 3.6713 8.7443 124.2020 52.2728 18.2629 178.4379 21 S 4.7761 8.1811 120.6211 57.7790 64.1342 174.0634 22 S 4.6131 7.5160 112.1292 57.3466 64.7739 175.1672 23 S 4.4501 8.7340 120.1633 59.9090 63.3639 174.2672 24 N 4.7856 8.5391 119.0643 53.4561 39.2043 175.8895 25 Y 3.9910 8.0622 120.6274 61.2162 38.6710 177.6978 26 C 4.1829 8.3803 117.0996 59.9879 39.6348 175.7894 27 N 4.3685 8.1763 117.5979 56.3470 38.1047 177.0832 28 Q 3.8616 7.8875 120.6987 59.5576 29.1951 178.1934 29 M 3.7564 7.6643 121.3897 57.9382 31.7150 178.7134 30 M 4.0275 8.0131 119.0668 57.9583 31.9258 178.8638 31 K 3.9346 7.6433 118.9764 59.5307 32.2473 179.1437 32 S 4.1088 8.1929 114.6153 61.0296 62.4825 175.5622 33 R 4.3792 7.8249 119.1910 55.1808 30.1135 175.7968 34 N 4.2812 8.0270 115.0985 54.6900 36.2831 174.9004 35 L 4.4677 8.2908 117.1658 55.2484 42.1553 178.0207 36 T 5.5272 7.5766 106.8993 60.4143 68.8268 174.8878 37 K 3.9463 7.9417 122.5306 59.8521 32.3544 177.1842 38 D 4.4861 7.7478 119.1550 55.3219 41.9125 176.0780 39 R 3.6360 7.1642 113.7663 55.4674 31.6997 173.9807 40 C 4.9805 8.5950 115.9670 55.2587 40.1272 173.9380 41 K 4.2019 8.3844 128.0262 55.6634 32.3811 175.0404 42 P 4.7245 0.0000 0.0000 64.9866 32.4496 176.4160 43 V 5.0364 7.5776 117.6311 61.2893 34.8832 173.9689 44 N 4.7211 8.9941 123.6654 52.7479 42.6544 172.9728 45 T 4.8003 7.6360 120.0262 61.5961 72.1067 172.7499 46 F 4.7842 9.0728 124.6130 55.6102 42.3086 174.5690 47 V 4.6000 8.9165 122.4786 61.1069 33.5917 175.6317 48 H 5.6430 8.7756 127.9556 53.8069 26.2661 173.2260 49 E 4.7978 7.6819 118.0462 53.3275 34.6044 176.4429 50 S 4.3751 8.3510 114.8560 58.1460 65.0326 174.9345 51 L 3.9664 8.5095 124.5017 58.4483 42.0256 179.0849 52 A 4.0358 8.0611 120.1386 55.5228 18.0817 179.2367 53 D 4.3684 8.0179 116.2618 57.2291 41.1085 178.8655 54 V 3.8131 7.7506 118.9824 65.9727 31.5877 178.0853 55 Q 3.9158 8.5889 118.0712 58.8533 28.5381 178.6161 56 A 4.0470 7.9617 121.1911 54.6204 18.3404 179.6563 57 V 3.4928 7.5973 116.9544 65.8276 31.3116 176.9086 58 C 3.7196 7.7813 114.7267 58.1490 39.9543 174.6668 59 S 4.4665 7.4495 115.4123 59.1343 63.7047 174.7410 60 Q 3.9725 7.8325 125.9239 55.5231 27.6292 176.8830 61 K 4.2592 7.8956 128.6322 57.0865 33.1031 175.9650 62 N 4.3898 8.7921 127.5888 53.4505 39.5121 174.2637 63 V 4.5903 8.2149 118.3135 59.1525 36.7671 174.8582 64 A 4.3793 8.3627 124.3004 52.1879 19.0979 178.3086 65 C 4.5946 9.2820 119.3584 55.9452 41.2473 175.2402 66 K 3.2206 8.6610 122.3685 59.6953 31.7068 177.8172 67 N 4.5462 8.1076 113.0905 52.7834 37.5803 175.9508 68 G 3.9441 8.9398 109.2071 45.6561 0.0000 174.2719 69 Q 4.2518 7.7072 118.7090 56.1822 29.3903 176.0529 70 T 4.6260 8.2714 108.6729 61.7628 69.3542 174.1524 71 N 5.0155 8.0091 117.6191 54.0042 38.6469 174.5752 72 C 5.3204 7.4541 115.9408 56.8768 43.5271 172.5622 73 Y 5.0667 8.9077 118.5172 56.3941 42.0168 173.8771 74 Q 5.0564 9.0729 125.0489 54.0128 31.4894 174.8988 75 S 4.3324 8.7511 121.8414 58.6213 63.2039 174.2354 76 Y 4.4664 9.2860 122.0322 60.5285 37.8167 176.2604 77 S 5.0333 7.8578 112.4898 56.4234 65.8843 173.9984 78 T 4.3234 8.2407 110.1461 61.7903 69.9097 173.7134 79 M 5.0491 9.0439 121.4019 53.3835 37.1007 174.6281 80 S 5.0299 9.6552 117.0763 58.3299 63.5350 173.1295 81 I 5.2038 9.3065 120.2451 59.5450 41.8278 174.3329 82 T 4.9490 8.9793 119.0411 61.9637 72.1664 172.5794 83 D 4.9319 9.3393 127.5779 53.4252 43.0567 174.2280 84 C 5.5864 9.4015 123.6938 55.2490 41.4597 172.9739 85 R 5.3068 8.9361 123.6554 54.2553 33.5249 174.1562 86 E 4.1178 9.1420 126.1425 56.6873 29.6774 177.2217 87 T 4.2851 8.5288 114.1521 60.6002 70.0142 176.0225 88 G 3.8915 8.6221 111.3108 48.0770 0.0000 174.2162 89 S 4.7148 7.2076 114.9641 58.1421 63.5311 173.8766 90 S 4.7042 7.8468 114.4156 57.4487 63.8578 172.9811 91 K 4.5610 8.4179 125.4519 54.5762 35.6632 175.3233 92 Y 3.9472 8.7231 125.5790 57.3647 39.2483 173.4001 93 P 3.3029 0.0000 0.0000 62.4341 32.1027 176.7544 94 N 4.6553 8.9417 119.5511 52.2662 37.0201 173.3114 95 C 4.5611 7.8016 116.5614 56.6043 42.9570 173.3766 96 A 5.0647 8.3090 125.0193 50.4050 21.8083 174.5011 97 Y 5.1345 9.6323 119.4771 55.9395 42.1727 174.9978 98 K 4.4580 9.5130 124.1749 55.9185 34.0128 175.3229 99 T 5.0262 8.5872 123.9142 62.4034 70.3554 174.0689 100 T 4.5396 8.8736 123.2870 61.7183 71.6512 172.9440 101 Q 4.7990 8.7380 128.1026 55.5641 30.3433 174.4399 102 A 4.5920 8.8885 126.1199 51.3713 23.6851 174.6689 103 N 5.4505 8.8461 118.8913 52.4131 40.4870 175.1434 104 K 4.7742 8.8369 126.3450 53.7352 37.1170 171.8324 105 H 4.8696 8.9365 116.8018 56.5513 30.0431 174.9754 106 I 4.8104 8.5817 115.2711 59.3417 40.8668 174.3442 107 I 4.8890 8.2326 124.2723 59.7302 40.0245 175.1583 108 V 4.7967 8.7673 119.2670 59.3984 36.3496 174.2191 109 A 5.0147 8.4842 124.3238 50.8948 20.6329 175.7379 110 C 5.0389 8.3973 119.2435 55.4244 39.7368 173.0575 111 E 4.6190 8.7258 119.2190 57.0329 34.5168 176.3785 112 G 4.0131 9.3824 109.0720 44.8580 0.0000 171.6859 113 N 5.0407 8.3195 117.3272 50.9837 40.6702 172.9518 114 P 4.3170 0.0000 0.0000 62.9100 31.9167 175.6547 115 Y 4.8526 8.2874 121.3870 56.7292 38.8277 174.4662 116 V 4.4298 8.1467 119.4572 58.3714 36.6817 173.3766 117 P 4.3397 0.0000 0.0000 62.8174 30.9727 177.1032 118 V 4.3899 8.3738 115.8295 61.5935 34.2905 175.5326 119 H 5.1244 7.6417 115.8420 54.5478 33.4561 172.5941 120 F 4.8443 9.0572 124.7329 57.2807 39.1727 174.7164 121 D 4.5516 8.4746 127.3385 56.1087 41.9532 175.7636 122 A 4.4035 6.4136 118.6816 52.3422 21.9038 174.4089 123 S 5.0797 8.4844 111.4539 56.9003 66.2889 174.2991 124 V 4.0053 8.7980 121.3284 63.1825 31.4727 175.1593 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 K 8.31 4.23 0.00 1.74 1.80 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.91 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.33 1.44 7.81 2 E 8.23 4.07 0.00 2.13 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 2.39 2.37 0.00 3 T 8.62 4.17 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 4 A 8.51 4.01 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 5 A 8.00 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 6 A 8.08 4.30 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 7 K 8.30 4.17 0.00 1.96 2.02 0.00 1.72 0.00 0.00 1.68 0.00 0.00 2.91 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.32 7.81 8 F 8.32 4.07 0.00 3.18 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 9 E 8.33 3.97 0.00 2.31 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 2.47 2.66 0.00 10 R 7.85 3.99 0.00 1.82 2.02 0.00 3.38 0.00 0.00 3.23 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.68 0.00 11 Q 8.03 3.99 0.00 1.81 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.56 0.00 0.00 0.00 0.00 0.00 2.30 2.58 0.00 12 A 7.81 4.39 0.45 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 13 M 8.03 4.52 0.00 1.94 2.13 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.60 0.00 14 D 8.89 4.81 0.00 2.69 2.51 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 15 S 8.32 4.54 0.00 3.93 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 16 S 7.94 4.40 0.00 3.93 3.99 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 17 T 7.51 4.74 4.17 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 1.25 0.00 0.00 18 S 8.61 4.19 0.00 3.97 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 19 A 6.90 3.82 1.12 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 20 A 8.74 3.67 0.72 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 0.00 0.00 21 S 8.18 4.78 0.00 3.81 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 22 S 7.52 4.61 0.00 3.83 3.69 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 0.00 0.00 0.00 0.00 23 S 8.73 4.45 0.00 4.05 3.99 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 24 N 8.54 4.79 0.00 2.76 2.88 0.00 0.00 6.50 7.04 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 25 Y 8.06 3.99 0.00 3.01 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 26 C 8.38 4.18 0.00 3.16 3.08 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 27 N 8.18 4.37 0.00 2.91 2.91 0.00 0.00 6.76 7.65 0.00 0.00 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 Q 7.89 3.86 0.00 2.01 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.81 0.00 0.00 0.00 0.00 0.00 2.23 2.44 0.00 29 M 7.66 3.76 0.00 0.86 1.17 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.60 0.00 30 M 8.01 4.03 0.00 1.72 1.85 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 2.47 0.00 31 K 7.64 3.93 0.00 1.98 1.88 0.00 1.63 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.44 7.81 32 S 8.19 4.11 0.00 4.01 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 33 R 7.82 4.38 0.00 1.95 2.04 0.00 3.58 0.00 0.00 3.21 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.96 0.00 34 N 8.03 4.28 0.00 2.89 2.95 0.00 0.00 6.87 7.43 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 35 L 8.29 4.47 0.00 1.80 1.65 0.86 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 36 T 7.58 5.53 4.42 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 1.44 0.00 0.00 37 K 7.94 3.95 0.00 1.93 1.86 0.00 1.80 0.00 0.00 1.74 0.00 0.00 2.98 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.48 1.46 7.81 38 D 7.75 4.49 0.00 2.62 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 39 R 7.16 3.64 0.00 1.83 1.74 0.00 2.82 0.00 0.00 3.23 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.56 0.00 40 C 8.59 4.98 0.00 3.09 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 41 K 8.38 4.20 0.00 1.84 1.78 0.00 1.76 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 1.46 1.38 7.81 42 P 0.00 4.72 0.00 2.19 2.31 0.00 3.89 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.82 0.00 43 V 7.58 5.04 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 0.79 0.00 0.00 0.97 0.00 0.00 44 N 8.99 4.72 0.00 2.61 2.23 0.00 0.00 6.88 6.99 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 45 T 7.64 4.80 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 0.92 0.00 0.00 46 F 9.07 4.78 0.00 2.99 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 47 V 8.92 4.60 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 1.13 0.00 0.00 1.05 0.00 0.00 48 H 8.78 5.64 0.00 3.04 3.45 0.00 5.62 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 7.68 4.80 0.00 1.94 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 2.26 2.27 0.00 50 S 8.35 4.38 0.00 4.07 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 51 L 8.51 3.97 0.00 1.82 1.74 1.02 1.19 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 A 8.06 4.04 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 53 D 8.02 4.37 0.00 2.83 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 54 V 7.75 3.81 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 1.25 0.00 0.00 1.03 0.00 0.00 55 Q 8.59 3.92 0.00 2.28 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.33 2.51 0.00 56 A 7.96 4.05 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 V 7.60 3.49 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.90 0.00 0.00 58 C 7.78 3.72 0.00 2.85 2.69 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 0.00 0.00 0.00 0.00 59 S 7.45 4.47 0.00 3.92 3.83 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 60 Q 7.83 3.97 0.00 1.79 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.93 0.00 0.00 0.00 0.00 0.00 1.86 2.19 0.00 61 K 7.90 4.26 0.00 2.04 1.86 0.00 1.62 0.00 0.00 1.77 0.00 0.00 2.90 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.49 1.45 7.81 62 N 8.79 4.39 0.00 2.71 2.65 0.00 0.00 7.01 7.71 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 63 V 8.21 4.59 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 0.67 0.00 0.00 0.81 0.00 0.00 64 A 8.36 4.38 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 C 9.28 4.59 0.00 3.06 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 66 K 8.66 3.22 0.00 1.75 1.90 0.00 1.70 0.00 0.00 1.76 0.00 0.00 3.04 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.47 1.62 7.81 67 N 8.11 4.55 0.00 2.83 2.92 0.00 0.00 6.16 7.00 0.00 0.00 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 G 8.94 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 69 Q 7.71 4.25 0.00 2.09 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.08 6.94 0.00 0.00 0.00 0.00 0.00 2.54 2.31 0.00 70 T 8.27 4.63 4.17 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 1.22 0.00 0.00 71 N 8.01 5.02 0.00 3.04 3.14 0.00 0.00 6.06 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 72 C 7.45 5.32 0.00 3.05 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 73 Y 8.91 5.07 0.00 2.82 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 74 Q 9.07 5.06 0.00 2.01 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.99 0.00 0.00 0.00 0.00 0.00 2.25 2.26 0.00 75 S 8.75 4.33 0.00 3.92 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 76 Y 9.29 4.47 0.00 3.00 2.97 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 77 S 7.86 5.03 0.00 3.89 3.93 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 78 T 8.24 4.32 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 0.98 0.00 0.00 79 M 9.04 5.05 0.00 1.94 1.99 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 2.54 2.49 0.00 80 S 9.66 5.03 0.00 3.87 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 81 I 9.31 5.20 1.99 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 1.32 0.68 1.08 0.00 0.00 82 T 8.98 4.95 4.42 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 1.28 0.00 0.00 83 D 9.34 4.93 0.00 2.74 2.69 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 0.00 0.00 0.00 0.00 84 C 9.40 5.59 0.00 2.86 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 85 R 8.94 5.31 0.00 1.94 1.78 0.00 3.13 0.00 0.00 3.20 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.79 0.00 86 E 9.14 4.12 0.00 2.01 1.72 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 1.80 1.75 0.00 87 T 8.53 4.29 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 88 G 8.62 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 89 S 7.21 4.71 0.00 4.14 3.93 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 90 S 7.85 4.70 0.00 3.75 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 91 K 8.42 4.56 0.00 1.79 1.63 0.00 1.71 0.00 0.00 1.57 0.00 0.00 2.86 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.36 1.36 7.81 92 Y 8.72 3.95 0.00 2.95 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 93 P 0.00 3.30 0.00 1.70 0.91 0.00 3.64 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.71 0.00 94 N 8.94 4.66 0.00 2.83 2.75 0.00 0.00 7.04 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 95 C 7.80 4.56 0.00 3.10 3.09 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 0.00 0.00 0.00 96 A 8.31 5.06 1.14 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 0.00 0.00 97 Y 9.63 5.13 0.00 2.89 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 98 K 9.51 4.46 0.00 1.84 1.73 0.00 1.63 0.00 0.00 1.68 0.00 0.00 2.88 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.44 1.46 7.81 99 T 8.59 5.03 4.32 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 1.34 0.00 0.00 100 T 8.87 4.54 4.28 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 1.23 0.00 0.00 101 Q 8.74 4.80 0.00 1.95 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.73 0.00 0.00 0.00 0.00 0.00 2.24 2.39 0.00 102 A 8.89 4.59 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 N 8.85 5.45 0.00 2.59 2.75 0.00 0.00 6.54 7.61 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 0.00 104 K 8.84 4.77 0.00 1.40 1.60 0.00 1.80 0.00 0.00 1.65 0.00 0.00 2.79 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.27 1.29 7.81 105 H 8.94 4.87 0.00 3.18 3.27 0.00 5.75 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 I 8.58 4.81 1.77 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 1.27 0.93 1.10 0.00 0.00 107 I 8.23 4.89 1.79 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 1.15 0.98 0.85 0.00 0.00 108 V 8.77 4.80 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 0.72 0.00 0.00 0.79 0.00 0.00 109 A 8.48 5.01 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 C 8.40 5.04 0.00 1.64 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 E 8.73 4.62 0.00 1.82 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 0.00 2.16 2.10 0.00 112 G 9.38 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 0.00 113 N 8.32 5.04 0.00 2.64 2.69 0.00 0.00 6.87 7.69 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 0.00 114 P 0.00 4.32 0.00 2.23 2.06 0.00 3.82 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 1.99 1.96 0.00 115 Y 8.29 4.85 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 0.00 116 V 8.15 4.43 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 0.67 0.00 0.00 0.89 0.00 0.00 117 P 0.00 4.34 0.00 0.49 1.29 0.00 3.36 0.00 0.00 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.80 0.00 118 V 8.37 4.39 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 0.63 0.00 0.00 0.62 0.00 0.00 119 H 7.64 5.12 0.00 3.12 3.20 0.00 5.62 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 F 9.06 4.84 0.00 3.20 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 0.00 121 D 8.47 4.55 0.00 2.72 2.68 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 0.00 0.00 0.00 0.00 122 A 6.41 4.40 1.23 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 0.00 0.00 123 S 8.48 5.08 0.00 4.20 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 0.00 124 V 8.80 4.01 2.13 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 0.98 0.00 0.00 0.93 0.00 0.00