NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2219 8.1727 120.1316 56.7991 34.7864 173.9949 2 V 4.4640 8.0794 122.1265 61.0152 32.1422 174.8652 3 F 4.2815 9.2356 127.7267 57.3686 40.2854 174.5657 4 E 4.1476 8.8565 121.9592 55.4948 31.0283 176.3918 5 R 3.2455 9.0143 123.4494 60.8652 29.9671 179.3567 6 C 4.3456 8.1885 115.4834 59.5733 34.5568 175.8055 7 E 3.8819 8.2562 121.4142 59.1797 29.2027 178.6146 8 L 3.3927 7.9076 120.2010 57.6494 42.0183 178.6497 9 A 3.9276 7.6703 120.4219 55.3295 18.3558 179.8619 10 R 3.8751 7.9906 116.4499 59.5564 30.0898 179.5023 11 T 3.8033 7.6589 114.9816 66.7064 68.5014 176.7380 12 L 3.8611 8.0587 121.2452 57.6393 41.4353 179.5978 13 K 3.9948 8.0873 119.6385 59.5120 31.9000 179.1984 14 R 4.0071 7.7822 117.6540 58.7654 29.9468 177.8714 15 L 4.4552 7.6832 116.9889 53.9291 41.8256 176.8067 16 G 3.9781 7.6031 106.1204 47.0981 0.0000 175.5212 17 M 3.9343 7.8839 121.0476 56.3858 32.5200 175.8556 18 D 4.4824 8.0221 117.7616 56.4395 40.9791 175.9537 19 G 3.9942 9.4929 116.5208 45.1016 0.0000 171.4900 20 Y 4.1147 8.2856 122.2631 58.8455 38.9495 176.1946 21 R 3.7476 9.1210 124.6814 57.0779 27.7344 177.2516 22 G 3.8746 8.3968 105.0528 45.4037 0.0000 173.9985 23 I 4.0131 7.6851 122.2735 59.5784 38.1117 176.0128 24 S 4.6925 8.3218 120.0602 57.5396 64.1061 174.7956 25 L 4.2598 8.8014 122.6831 58.6601 41.6974 179.2811 26 A 4.1443 8.1825 120.0227 55.3602 18.3980 179.1704 27 N 4.4820 8.1689 114.8205 56.0407 38.6283 177.7784 28 W 4.2227 7.9895 120.1870 59.9337 29.2613 178.3800 29 M 4.3053 8.6899 119.1654 58.5620 31.4605 177.9998 30 C 3.3941 8.3064 118.7915 59.0194 44.8858 175.4017 31 L 4.0161 7.9658 121.3115 58.2318 41.7457 178.6855 32 A 4.4721 8.3078 122.0517 54.4762 18.4563 179.4038 33 K 3.0711 8.1695 117.9348 59.4939 32.0901 179.1659 34 W 4.2234 7.6723 116.8244 59.1365 29.0309 178.4493 35 E 4.3492 8.3069 118.6238 58.7731 29.6279 177.8692 36 S 4.5660 8.1566 109.2187 56.7659 64.8737 174.6186 37 G 3.3888 8.1042 108.6714 46.9245 0.0000 173.6071 38 Y 3.7855 7.9473 113.6869 58.4683 35.1567 168.2710 39 N 5.2670 7.7438 119.0107 52.2316 39.4977 175.7664 40 T 4.2802 9.0725 117.9933 63.4953 69.8677 175.7491 41 R 4.5803 8.0489 117.7078 55.7849 30.4692 176.2894 42 A 4.4035 8.0419 122.4970 52.9116 19.4145 177.5687 43 T 4.9940 8.3656 110.6907 60.0155 72.4445 173.2797 44 N 4.8033 8.8175 121.9374 52.3814 42.0106 172.2484 45 Y 4.8215 8.7162 128.2926 57.0391 40.2573 174.4593 46 N 4.5502 8.7332 124.9361 51.2026 39.2207 175.4881 47 A 3.5493 8.1773 128.0080 54.6006 18.9081 178.9890 48 G 3.7238 8.0587 104.4968 48.1182 0.0000 173.9680 49 D 4.7731 7.6128 115.3507 51.8010 39.9596 175.5039 50 R 3.9097 7.7344 116.6877 57.5810 28.4706 175.9753 51 S 4.9862 7.7031 110.7762 57.1878 66.2100 172.8274 52 T 5.1751 9.0489 116.5777 62.0541 72.8327 172.7061 53 D 5.4521 8.9298 125.0454 53.1908 43.3167 175.1770 54 Y 5.1011 8.9071 119.9419 57.3522 42.2385 177.4012 55 G 4.6737 9.1905 111.4076 45.6605 0.0000 174.1783 56 F 4.9959 8.8078 111.4246 58.4462 38.0326 176.4187 57 F 4.6369 7.5304 117.8174 56.5535 40.0016 175.1647 58 Q 3.6185 7.6762 118.8479 57.0682 26.4270 173.8330 59 I 4.4121 8.2941 119.0722 60.6884 39.2475 176.9621 60 N 5.2749 9.1738 126.7304 53.6696 39.6103 175.8033 61 S 4.5467 9.2699 120.9573 61.0075 63.3788 175.4377 62 R 3.7751 8.8547 121.9246 58.3965 30.3902 177.7256 63 Y 4.1232 7.7337 114.6701 58.1818 40.6523 176.8607 64 W 4.8625 8.0376 118.4699 57.4904 31.2699 173.9312 65 C 5.6160 8.1968 111.7486 53.6982 41.1441 172.7839 66 N 5.1346 9.0846 118.6178 51.9436 40.1670 174.5270 67 D 4.7191 8.7334 123.5090 52.0767 40.7188 176.5827 68 G 3.9285 8.4014 107.0925 46.2667 0.0000 174.2941 69 K 4.5588 8.7654 116.5725 55.8754 33.3232 175.7371 70 T 4.6111 7.7095 116.0859 60.7806 70.4361 172.4528 71 P 4.2742 0.0000 0.0000 63.5777 31.9073 176.2677 72 G 3.8677 8.6065 109.8708 46.3771 0.0000 173.3804 73 A 4.3309 7.9246 121.2795 51.2427 19.4650 178.2063 74 V 4.4256 8.1110 115.1605 59.6321 35.0242 175.9720 75 N 4.8873 8.1816 120.2649 51.5779 38.2883 174.6923 76 A 3.9559 8.5076 124.1990 55.0305 19.0605 178.5654 77 C 4.4755 8.4263 111.2217 57.4484 41.1837 173.0555 78 H 4.1230 8.0343 116.3630 56.3370 26.2398 174.3042 79 L 4.7811 8.3532 118.0132 53.1114 46.5862 176.4230 80 S 4.8148 8.3893 115.9543 57.6651 64.4356 176.0745 81 C 4.0070 8.9506 121.3033 59.9156 34.7984 176.6639 82 S 3.9141 7.8837 114.9748 60.8393 62.4140 175.8569 83 A 4.3989 7.8509 124.7767 53.4380 18.3396 177.7146 84 L 4.5712 7.7476 117.0852 54.6935 41.7691 177.5079 85 L 5.1508 7.7639 116.6490 54.5836 42.4366 176.7550 86 Q 4.3916 7.7505 118.6283 55.3649 29.6476 176.7977 87 D 4.3468 8.5127 119.5820 57.1195 41.1275 176.7810 88 N 4.5159 8.0283 118.2055 53.2511 39.0156 174.7311 89 I 4.2429 8.3904 119.0545 60.9686 38.1164 176.8567 90 A 3.9639 8.2536 124.4499 56.0906 18.1701 179.7757 91 D 4.3310 8.1616 116.2377 57.3040 40.8103 178.8357 92 A 4.0134 7.9755 120.8278 55.1382 18.5561 179.5172 93 V 3.4717 7.9826 116.5950 66.1931 31.0602 177.9256 94 A 3.8803 7.9756 120.3288 55.4525 18.2056 178.8527 95 C 4.2653 8.2750 116.6802 59.6495 37.9381 175.5697 96 A 3.8902 8.3109 122.8189 55.0958 17.6467 179.7945 97 K 3.7849 7.7053 116.2868 59.3249 32.3603 179.3064 98 R 4.0537 7.4979 118.1860 59.2428 29.8939 178.5684 99 V 2.0689 7.3353 118.0160 65.6075 31.2683 178.0119 100 V 3.8077 7.5898 110.0396 62.8954 31.3593 177.8550 101 R 4.2361 7.5492 116.5823 56.7158 30.5688 176.4269 102 D 4.7118 7.3093 119.6819 52.9585 41.9084 175.5673 103 P 4.1928 0.0000 0.0000 66.1575 31.4613 178.1672 104 Q 4.0291 8.1501 116.2567 56.6139 29.8159 177.3752 105 G 3.9303 8.1238 107.1266 46.8822 0.0000 175.3419 106 I 3.7938 7.7277 119.9414 62.8742 38.0457 177.8159 107 R 4.3733 7.3289 117.6599 57.9708 29.9284 177.4967 108 A 4.0417 7.5615 121.5503 54.1781 18.7634 177.6781 109 W 4.6711 8.1548 116.5359 55.5128 29.2986 177.3168 110 V 3.7232 8.7131 124.2014 66.0470 30.8778 177.6398 111 A 4.0536 8.2133 120.1715 54.7621 18.2024 179.2520 112 W 4.0340 8.4040 126.8512 60.5103 30.5424 178.5688 113 R 3.6857 8.1278 116.8465 59.2168 29.6826 178.3605 114 N 4.3358 7.9953 115.1065 55.6774 38.7340 176.9003 115 R 4.0041 7.8133 116.0993 55.9713 31.1058 176.1665 116 C 4.5070 7.0545 114.3388 57.6906 43.0557 174.2903 117 Q 3.2180 6.6415 120.0709 57.1788 28.7083 175.9000 118 N 4.1931 8.6892 120.0325 53.7848 36.3380 173.7150 119 R 4.5675 7.1545 116.6697 53.7814 32.8957 175.0218 120 D 4.5513 8.4385 119.0821 54.5681 41.6070 176.0752 121 V 4.8720 8.3425 117.5009 61.1969 33.4679 177.6739 122 R 4.0982 8.5184 122.6880 59.0565 30.3687 179.1460 123 Q 4.0416 8.0612 115.7771 59.0049 28.7709 177.7961 124 Y 4.3410 7.6257 115.6143 60.0686 38.1087 176.9342 125 V 4.4505 7.7913 110.5917 60.3903 33.4018 175.4695 126 Q 4.1518 7.6938 119.9086 57.5193 28.7556 177.3807 127 G 4.0116 8.9422 110.5890 45.8582 0.0000 174.9137 128 C 4.3422 8.0813 116.5764 57.6988 40.4171 174.0902 129 G 3.8928 8.1974 106.7775 46.7339 0.0000 173.9735 130 V 4.0216 7.8244 118.0498 61.1206 32.3034 175.7937 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 8.17 4.22 0.00 1.63 1.97 0.00 1.06 0.00 0.00 0.81 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.17 0.98 7.81 2 V 8.08 4.46 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 0.87 0.00 0.00 0.95 0.00 0.00 3 F 9.24 4.28 0.00 2.87 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 4 E 8.86 4.15 0.00 2.01 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 2.29 2.39 0.00 5 R 9.01 3.25 0.00 1.98 1.88 0.00 3.47 0.00 0.00 3.48 7.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.77 0.00 6 C 8.19 4.35 0.00 3.12 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 7 E 8.26 3.88 0.00 2.20 2.21 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 2.50 2.35 0.00 8 L 7.91 3.39 0.00 1.22 1.31 -0.44 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.67 3.93 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 10 R 7.99 3.88 0.00 1.86 1.97 0.00 3.13 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.91 0.00 11 T 7.66 3.80 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 12 L 8.06 3.86 0.00 1.59 1.61 1.03 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 13 K 8.09 3.99 0.00 1.96 1.94 0.00 1.65 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.50 7.81 14 R 7.78 4.01 0.00 2.01 1.95 0.00 3.19 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 1.65 1.79 0.00 15 L 7.68 4.46 0.00 1.50 1.57 0.84 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 16 G 7.60 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 17 M 7.88 3.93 0.00 1.25 1.99 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.25 0.00 18 D 8.02 4.48 0.00 2.69 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 19 G 9.49 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 0.00 0.00 0.00 20 Y 8.29 4.11 0.00 3.42 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 21 R 9.12 3.75 0.00 2.03 1.91 0.00 3.16 0.00 0.00 3.09 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.54 0.00 22 G 8.40 3.87 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 0.00 0.00 0.00 23 I 7.69 4.01 1.57 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.44 -0.20 0.00 0.00 24 S 8.32 4.69 0.00 4.07 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 L 8.80 4.26 0.00 2.04 1.83 1.01 1.46 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 26 A 8.18 4.14 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.17 4.48 0.00 2.86 2.78 0.00 0.00 6.95 7.38 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 28 W 7.99 4.22 0.00 3.64 3.22 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 29 M 8.69 4.31 0.00 2.19 2.40 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.97 0.00 30 C 8.31 3.39 0.00 2.50 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 31 L 7.97 4.02 0.00 1.84 1.84 0.22 -0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 32 A 8.31 4.47 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 0.00 0.00 0.00 0.00 0.00 33 K 8.17 3.07 0.00 1.93 1.70 0.00 0.61 0.00 0.00 0.65 0.00 0.00 2.40 0.00 0.00 2.54 0.00 0.00 0.00 0.00 0.79 1.55 7.81 34 W 7.67 4.22 0.00 3.38 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 35 E 8.31 4.35 0.00 2.20 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 0.00 2.56 2.33 0.00 36 S 8.16 4.57 0.00 4.04 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 37 G 8.10 3.39 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 0.00 38 Y 7.95 3.79 0.00 3.25 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 39 N 7.74 5.27 0.00 2.96 2.87 0.00 0.00 6.99 7.10 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 40 T 9.07 4.28 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 1.36 0.00 0.00 41 R 8.05 4.58 0.00 1.89 2.09 0.00 3.12 0.00 0.00 3.54 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.64 0.00 42 A 8.04 4.40 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 43 T 8.37 4.99 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 1.23 0.00 0.00 44 N 8.82 4.80 0.00 2.90 2.78 0.00 0.00 6.83 6.85 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 45 Y 8.72 4.82 0.00 2.91 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 46 N 8.73 4.55 0.00 2.63 2.61 0.00 0.00 6.51 7.79 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 47 A 8.18 3.55 1.21 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 0.00 0.00 0.00 48 G 8.06 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 D 7.61 4.77 0.00 2.70 2.67 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 50 R 7.73 3.91 0.00 2.02 2.15 0.00 3.17 0.00 0.00 3.34 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.62 0.00 51 S 7.70 4.99 0.00 3.94 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 52 T 9.05 5.18 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 0.64 0.00 0.00 53 D 8.93 5.45 0.00 2.76 2.73 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 0.00 0.00 0.00 0.00 54 Y 8.91 5.10 0.00 3.02 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 55 G 9.19 4.67 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 56 F 8.81 5.00 0.00 3.19 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 57 F 7.53 4.64 0.00 2.71 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 58 Q 7.68 3.62 0.00 2.56 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 6.83 0.00 0.00 0.00 0.00 0.00 2.44 2.80 0.00 59 I 8.29 4.41 2.11 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.95 1.14 0.00 0.00 60 N 9.17 5.27 0.00 3.07 2.98 0.00 0.00 6.96 7.24 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 61 S 9.27 4.55 0.00 4.04 4.46 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 62 R 8.85 3.78 0.00 1.59 1.65 0.00 2.54 0.00 0.00 2.80 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.05 0.00 63 Y 7.73 4.12 0.00 1.95 1.63 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 64 W 8.04 4.86 0.00 3.43 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 65 C 8.20 5.62 0.00 3.09 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 66 N 9.08 5.13 0.00 2.83 2.69 0.00 0.00 7.13 8.45 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 67 D 8.73 4.72 0.00 2.85 2.66 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 68 G 8.40 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 0.00 0.00 0.00 69 K 8.77 4.56 0.00 1.76 1.82 0.00 1.66 0.00 0.00 1.71 0.00 0.00 3.19 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.37 1.58 7.81 70 T 7.71 4.61 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 1.19 0.00 0.00 71 P 0.00 4.27 0.00 2.01 1.97 0.00 3.83 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 72 G 8.61 3.87 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 0.00 0.00 0.00 73 A 7.92 4.33 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 74 V 8.11 4.43 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 0.66 0.00 0.00 0.93 0.00 0.00 75 N 8.18 4.89 0.00 2.76 2.70 0.00 0.00 6.98 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 76 A 8.51 3.96 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 77 C 8.43 4.48 0.00 3.35 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 78 H 8.03 4.12 0.00 3.32 3.34 0.00 5.65 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 79 L 8.35 4.78 0.00 1.71 1.51 0.95 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 80 S 8.39 4.81 0.00 3.96 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 C 8.95 4.01 0.00 2.06 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 82 S 7.88 3.91 0.00 4.05 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 83 A 7.85 4.40 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 84 L 7.75 4.57 0.00 1.95 1.81 1.02 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 85 L 7.76 5.15 0.00 1.83 1.74 1.13 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 86 Q 7.75 4.39 0.00 2.37 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.92 0.00 0.00 0.00 0.00 0.00 2.47 2.50 0.00 87 D 8.51 4.35 0.00 2.61 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 88 N 8.03 4.52 0.00 2.69 2.76 0.00 0.00 6.96 7.94 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 89 I 8.39 4.24 1.90 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.50 0.69 0.00 0.00 90 A 8.25 3.96 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 91 D 8.16 4.33 0.00 2.81 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 92 A 7.98 4.01 1.51 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 93 V 7.98 3.47 2.17 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 0.76 0.00 0.00 0.95 0.00 0.00 94 A 7.98 3.88 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 95 C 8.27 4.27 0.00 3.07 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 96 A 8.31 3.89 1.13 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 0.00 0.00 97 K 7.71 3.78 0.00 1.68 1.49 0.00 1.36 0.00 0.00 0.99 0.00 0.00 2.24 0.00 0.00 2.52 0.00 0.00 0.00 0.00 0.30 1.07 7.81 98 R 7.50 4.05 0.00 1.98 2.10 0.00 3.25 0.00 0.00 3.19 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.87 0.00 99 V 7.34 2.07 1.77 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 -0.19 0.00 0.00 -0.36 0.00 0.00 100 V 7.59 3.81 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 1.20 0.00 0.00 1.36 0.00 0.00 101 R 7.55 4.24 0.00 2.05 2.02 0.00 3.22 0.00 0.00 3.35 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 2.04 0.00 102 D 7.31 4.71 0.00 3.05 2.62 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 0.00 103 P 0.00 4.19 0.00 2.01 2.13 0.00 3.68 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 2.03 2.15 0.00 104 Q 8.15 4.03 0.00 2.05 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.75 0.00 0.00 0.00 0.00 0.00 2.42 2.31 0.00 105 G 8.12 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 0.00 0.00 0.00 106 I 7.73 3.79 1.02 0.00 0.00 -0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.16 0.70 -0.79 0.00 0.00 107 R 7.33 4.37 0.00 2.01 2.05 0.00 3.36 0.00 0.00 3.27 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.71 0.00 108 A 7.56 4.04 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 W 8.15 4.67 0.00 3.49 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 0.00 110 V 8.71 3.72 2.17 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 1.08 0.00 0.00 0.99 0.00 0.00 111 A 8.21 4.05 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 0.00 112 W 8.40 4.03 0.00 3.43 3.48 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 0.00 113 R 8.13 3.69 0.00 1.99 1.98 0.00 3.37 0.00 0.00 3.51 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.10 0.00 114 N 8.00 4.34 0.00 2.69 2.68 0.00 0.00 6.97 6.94 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 0.00 115 R 7.81 4.00 0.00 0.67 0.66 0.00 2.70 0.00 0.00 2.77 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.54 0.00 116 C 7.05 4.51 0.00 1.66 2.65 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 0.00 0.00 0.00 0.00 117 Q 6.64 3.22 0.00 0.93 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.22 0.00 0.00 0.00 0.00 0.00 2.19 2.17 0.00 118 N 8.69 4.19 0.00 2.81 2.86 0.00 0.00 6.90 7.66 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 0.00 119 R 7.15 4.57 0.00 1.77 1.81 0.00 2.94 0.00 0.00 3.02 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.52 0.00 120 D 8.44 4.55 0.00 2.65 2.60 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 0.00 121 V 8.34 4.87 2.38 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 1.10 0.00 0.00 1.05 0.00 0.00 122 R 8.52 4.10 0.00 1.93 2.02 0.00 3.16 0.00 0.00 3.25 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.82 0.00 123 Q 8.06 4.04 0.00 2.09 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.06 6.91 0.00 0.00 0.00 0.00 0.00 2.28 2.31 0.00 124 Y 7.63 4.34 0.00 3.19 3.18 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 0.00 125 V 7.79 4.45 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 0.87 0.00 0.00 1.09 0.00 0.00 126 Q 7.69 4.15 0.00 2.07 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.62 0.00 0.00 0.00 0.00 0.00 2.63 2.46 0.00 127 G 8.94 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 0.00 128 C 8.08 4.34 0.00 3.10 3.16 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 0.00 129 G 8.20 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 0.00 130 V 7.82 4.02 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 0.74 0.00 0.00 0.95 0.00 0.00