NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 N 4.5540 8.4244 119.1705 51.7590 41.2485 174.0341 4 Q 4.3781 7.2869 120.7855 54.6434 32.1944 173.6776 5 Y 4.9975 8.8349 120.2080 56.7762 42.5616 173.2310 6 Y 4.8219 9.1452 126.6223 56.7171 40.9028 174.1401 7 G 3.7516 8.3345 113.9364 45.6650 0.0000 172.2970 8 T 3.9919 7.7261 116.2729 60.5512 68.0161 171.5567 9 G 3.8106 10.2857 118.9421 44.7089 0.0000 173.0034 10 R 5.4464 7.8515 118.6712 56.2757 32.1176 174.2483 11 R 4.3216 8.5630 114.9613 56.9586 31.2936 173.7571 12 K 3.9363 9.4501 117.1437 58.4003 29.4541 174.8594 13 S 3.6557 7.9732 103.5579 59.4154 62.4588 173.0807 14 S 5.1628 8.1893 114.5706 56.6959 65.0536 171.9611 15 A 4.5705 8.7040 129.7385 50.5651 20.2846 176.0048 16 A 5.0488 9.0719 124.8404 50.5802 22.2980 176.3541 17 R 4.6717 8.3800 117.5338 55.1028 34.2864 175.0399 18 V 4.9221 8.6690 124.3049 60.1746 34.8498 174.6196 19 F 5.5734 8.2585 121.4925 55.2196 39.4395 173.7067 20 I 4.2191 8.9361 122.3762 62.2660 38.6655 175.6857 21 K 4.9255 9.4886 125.0841 54.3498 36.2705 174.7469 22 P 4.8114 0.0000 0.0000 62.5702 30.8307 176.2130 23 G 4.4228 8.3981 103.1107 46.5088 0.0000 175.8952 24 N 4.4015 8.4819 122.0728 52.0554 37.1944 176.7735 25 G 5.6021 7.2207 116.8547 45.3884 0.0000 172.6251 26 K 4.3554 7.0638 117.7785 55.9058 33.9321 177.1139 27 I 4.6317 8.2659 121.9083 60.0895 40.3881 173.8328 28 V 5.3997 8.0809 128.5237 60.2737 32.0829 172.5412 29 I 4.0280 7.9966 125.3546 60.3259 38.4533 175.5105 30 N 4.0534 9.9725 127.1125 54.5131 36.5173 175.0784 31 Q 3.8492 8.6373 112.1181 56.5854 26.2732 173.1956 32 R 4.6747 7.7367 117.9127 54.2437 33.4040 174.6951 33 S 4.9086 8.1299 112.1909 57.0993 63.2126 174.0291 34 L 3.9918 8.0782 127.3722 58.7634 42.0379 179.2966 35 E 4.4233 8.1147 116.1416 57.0123 29.8149 178.0147 36 Q 4.2617 8.1355 120.2880 58.0111 30.5070 176.2203 37 Y 4.3142 7.9696 116.8288 59.6884 38.9811 175.6998 38 F 5.2857 7.7067 115.3335 56.7960 40.1221 175.2841 39 G 4.1910 8.2653 109.0219 46.6578 0.0000 173.9751 40 R 3.8389 8.6748 122.3658 56.6800 28.7306 175.7055 41 E 4.6940 7.6926 113.8129 54.7245 33.1763 176.6093 42 T 3.8991 8.6605 116.1309 63.7908 67.8293 175.6049 43 A 3.7103 8.2688 124.5867 55.8723 18.4663 180.0407 44 R 4.2593 7.9792 109.9452 58.3993 29.9085 178.1425 45 M 4.2213 7.9880 118.0879 58.5238 31.5808 178.5762 46 V 3.8315 7.1188 110.6369 64.3386 31.5169 178.9875 47 V 3.7029 7.8395 110.2110 63.9908 30.9693 177.8006 48 R 4.3166 8.3625 117.0629 57.0941 30.0256 178.4190 49 Q 4.2226 8.1454 119.3850 58.5479 28.7181 176.9268 50 P 3.8321 0.0000 0.0000 64.3703 31.5047 177.0692 51 L 4.3815 7.2890 118.8112 56.6912 42.5543 177.9623 52 E 4.1605 9.3178 115.9856 57.8247 29.3428 177.7458 53 L 4.4273 7.6148 119.4869 55.6526 43.5744 176.7582 54 V 4.0076 7.5245 108.6518 60.2584 32.7081 171.8550 55 D 4.7988 9.8542 128.1432 54.1288 41.5585 173.3469 56 M 4.3685 8.0748 120.8458 55.7624 33.0178 175.6850 57 V 3.3445 8.7070 116.6011 64.1086 31.8161 173.2946 58 E 4.6978 8.8107 115.4252 55.5415 31.2995 175.9193 59 K 4.5524 7.7041 117.3810 57.3908 34.5182 175.7612 60 L 4.5512 7.1546 117.5213 55.3986 43.5239 172.3347 61 D 5.3295 9.5408 119.8678 51.9016 42.2664 173.7528 62 L 5.8585 8.4226 117.5803 55.3103 44.8433 173.8199 63 Y 5.2712 8.8827 119.7129 56.1931 41.0944 173.9313 64 I 4.7337 8.1738 128.0814 60.4418 39.6824 175.7417 65 T 4.5122 9.2109 124.0425 62.4491 71.4994 172.8910 66 V 4.8113 8.0916 125.1946 59.8251 34.7231 175.0448 67 K 4.6030 8.9288 120.6329 56.0284 37.2772 174.8503 68 G 4.3225 9.0617 111.4049 46.9360 0.0000 172.9107 69 G 4.1516 10.1346 106.5259 43.8290 0.0000 173.7288 70 G 4.0499 8.3107 111.9598 43.8482 0.0000 171.3811 71 I 3.7310 8.0663 117.8700 65.0245 36.7757 177.9097 72 S 4.0162 7.9290 113.8855 61.8690 62.8960 176.4989 73 G 3.7213 8.1332 108.8256 47.6465 0.0000 174.8367 74 Q 4.2197 9.7900 122.3666 57.8138 29.1034 179.2179 75 A 4.1454 8.3708 121.5531 55.4804 18.4040 179.7215 76 G 3.5813 8.7133 103.5073 47.8833 0.0000 175.1791 77 A 4.0390 8.6037 124.0038 55.0674 18.3237 179.5038 78 I 3.6447 7.9425 118.0068 64.8553 37.2716 178.3486 79 R 3.9288 7.9243 118.8641 59.8641 29.6812 177.9289 80 H 4.3402 8.2336 117.6859 59.2520 29.8983 177.4328 81 G 3.4690 7.9787 108.7157 47.4561 0.0000 174.9806 82 I 3.6703 8.3054 122.7583 64.9145 36.9459 178.1498 83 T 3.7819 7.8486 113.1818 65.2309 67.5266 176.1815 84 R 3.9912 8.0929 119.9088 59.2380 30.1159 178.8802 85 A 4.6630 8.4986 122.2871 54.6461 18.3465 179.3879 86 L 4.0229 7.9163 117.4523 58.0678 40.0312 179.5341 87 M 4.3498 7.7496 119.6444 58.0412 32.0236 178.0186 88 E 4.3203 8.7120 119.1331 58.9964 29.3676 178.2794 89 Y 3.9647 6.7925 117.5246 58.2758 39.0174 174.9392 90 D 4.2561 8.1938 120.5061 53.5579 42.8169 175.1658 91 E 4.2122 8.7018 126.4106 57.8089 29.8599 177.9065 92 S 4.5250 8.0623 114.3189 58.9241 63.7700 175.3526 93 L 4.3344 7.6158 120.7702 57.1137 40.7129 178.5715 94 R 3.9464 7.9830 118.9558 58.9698 29.3874 178.1811 95 S 4.0781 8.1565 112.9196 61.6483 62.2568 175.7774 96 E 4.1938 8.0974 119.9115 58.3658 29.0828 179.0338 97 L 3.7884 7.6473 118.9713 57.6788 41.7569 179.1989 98 R 4.0042 8.3249 118.9528 59.4171 29.8613 178.1975 99 K 3.9203 7.5782 117.1151 59.2969 32.0963 177.3827 100 A 4.7890 7.9390 118.4782 50.5925 19.7568 175.7821 101 G 3.6902 8.5345 113.3855 46.7917 0.0000 173.1505 102 F 4.8328 8.4741 121.8880 58.9250 46.6152 176.4608 103 V 3.8475 8.3014 113.2023 64.7078 31.5767 177.5829 104 T 3.9250 7.8033 107.8973 61.6013 69.0733 173.1827 105 R 4.0854 8.1558 123.7383 54.1171 31.1174 174.8569 106 D 4.2839 8.4977 125.0175 54.4559 40.3345 176.3654 107 A 4.0549 8.4042 130.0482 54.1528 18.8100 178.0067 108 R 3.8843 6.8309 114.6255 57.2370 30.5979 175.6093 109 Q 4.5323 8.1829 120.7456 54.2821 32.1170 173.9734 110 V 3.5796 8.2476 121.3645 63.3094 31.9128 174.9050 111 E 4.3917 8.5143 127.0181 54.3905 30.3063 176.0752 112 R 3.9337 8.4379 123.2910 55.9511 30.0447 176.1160 113 K 4.2020 8.4613 122.6680 55.8352 32.0452 176.6432 114 K 4.3120 8.4253 126.3592 55.4452 33.0232 177.1985 115 V 3.8622 7.9867 121.1915 63.0379 32.1045 175.2416 116 G 4.3353 8.9785 115.4521 46.1206 0.0000 174.3788 117 L 4.3512 6.7461 117.9510 53.6432 43.0457 176.1598 118 R 4.5388 8.7289 117.4551 56.7494 32.0185 176.5920 119 K 4.3249 7.9597 117.0297 55.5623 32.5357 176.9328 120 A 3.9475 8.4444 120.1009 53.4641 18.2320 178.5976 121 R 4.5502 8.1881 110.4857 57.3779 36.6012 175.5379 122 R 3.9429 8.0552 119.1026 56.4222 30.0196 174.9137 123 R 4.7472 8.3183 125.1860 53.2720 31.7904 174.5527 124 P 4.2611 0.0000 0.0000 62.7311 31.4370 176.1345 125 Q 4.2234 8.7625 121.4690 56.6163 28.7133 176.4159 126 F 4.6817 8.9521 113.5834 55.5880 39.3644 176.6725 127 S 3.0643 7.1854 113.4326 58.8771 63.7145 172.1766 128 K 3.7720 7.8473 119.1899 55.7703 33.0777 176.8408 129 R 4.5650 8.4763 125.2131 56.5714 30.2267 175.0349 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 3 N 8.42 4.55 0.00 2.62 2.62 0.00 0.00 6.87 6.19 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 4 Q 7.29 4.38 0.00 2.07 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.06 6.64 0.00 0.00 0.00 0.00 0.00 2.36 2.43 0.00 5 Y 8.83 5.00 0.00 3.09 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 6 Y 9.15 4.82 0.00 2.87 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 7 G 8.33 3.75 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 0.00 0.00 0.00 8 T 7.73 3.99 4.20 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 1.29 0.00 0.00 9 G 10.29 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 0.00 0.00 0.00 10 R 7.85 5.45 0.00 2.00 1.89 0.00 2.75 0.00 0.00 3.96 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.57 0.00 11 R 8.56 4.32 0.00 2.10 2.02 0.00 3.06 0.00 0.00 3.30 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.43 0.00 12 K 9.45 3.94 0.00 1.87 1.87 0.00 1.88 0.00 0.00 1.73 0.00 0.00 2.91 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.35 1.39 7.81 13 S 7.97 3.66 0.00 4.12 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 14 S 8.19 5.16 0.00 3.94 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 15 A 8.70 4.57 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 16 A 9.07 5.05 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 17 R 8.38 4.67 0.00 1.75 1.84 0.00 3.04 0.00 0.00 3.10 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.72 0.00 18 V 8.67 4.92 1.92 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 1.34 0.00 0.00 0.85 0.00 0.00 19 F 8.26 5.57 0.00 3.44 2.98 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 20 I 8.94 4.22 2.17 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 1.06 0.40 0.92 0.00 0.00 21 K 9.49 4.93 0.00 2.00 1.84 0.00 1.63 0.00 0.00 1.70 0.00 0.00 2.89 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.34 1.37 7.81 22 P 0.00 4.81 0.00 2.28 2.24 0.00 3.91 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.07 0.00 23 G 8.40 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 0.00 0.00 0.00 0.00 24 N 8.48 4.40 0.00 3.01 3.03 0.00 0.00 6.14 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 25 G 7.22 5.60 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 26 K 7.06 4.36 0.00 2.02 1.76 0.00 1.61 0.00 0.00 1.65 0.00 0.00 3.05 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.47 1.43 7.81 27 I 8.27 4.63 1.92 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 1.28 0.79 0.98 0.00 0.00 28 V 8.08 5.40 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 1.33 0.00 0.00 0.98 0.00 0.00 29 I 8.00 4.03 1.69 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 1.35 0.43 0.68 0.00 0.00 30 N 9.97 4.05 0.00 2.31 2.64 0.00 0.00 7.16 7.57 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 31 Q 8.64 3.85 0.00 2.24 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.48 6.75 0.00 0.00 0.00 0.00 0.00 2.40 2.49 0.00 32 R 7.74 4.67 0.00 1.91 1.81 0.00 3.07 0.00 0.00 3.01 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.43 0.00 33 S 8.13 4.91 0.00 3.87 3.73 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 34 L 8.08 3.99 0.00 1.80 1.72 1.04 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 35 E 8.11 4.42 0.00 2.15 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 2.42 2.40 0.00 36 Q 8.14 4.26 0.00 2.03 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 7.00 0.00 0.00 0.00 0.00 0.00 2.30 2.33 0.00 37 Y 7.97 4.31 0.00 2.60 2.48 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 38 F 7.71 5.29 0.00 3.12 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 39 G 8.27 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 0.00 0.00 0.00 0.00 40 R 8.67 3.84 0.00 1.94 1.98 0.00 3.23 0.00 0.00 3.24 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.64 0.00 41 E 7.69 4.69 0.00 2.27 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 2.29 2.30 0.00 42 T 8.66 3.90 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 1.15 0.00 0.00 43 A 8.27 3.71 0.67 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 44 R 7.98 4.26 0.00 2.07 2.41 0.00 3.11 0.00 0.00 3.49 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.69 0.00 45 M 7.99 4.22 0.00 2.19 2.35 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 2.55 2.91 0.00 46 V 7.12 3.83 2.06 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 0.73 0.00 0.00 0.98 0.00 0.00 47 V 7.84 3.70 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 1.05 0.00 0.00 48 R 8.36 4.32 0.00 2.00 1.98 0.00 3.18 0.00 0.00 3.19 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.84 0.00 49 Q 8.15 4.22 0.00 2.52 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.84 0.00 0.00 0.00 0.00 0.00 2.48 2.64 0.00 50 P 0.00 3.83 0.00 2.09 2.05 0.00 3.81 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.11 0.00 51 L 7.29 4.38 0.00 1.81 1.69 0.98 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 52 E 9.32 4.16 0.00 1.95 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 2.57 2.48 0.00 53 L 7.61 4.43 0.00 1.63 1.47 0.84 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 54 V 7.52 4.01 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 0.70 0.00 0.00 0.93 0.00 0.00 55 D 9.85 4.80 0.00 2.78 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 56 M 8.07 4.37 0.00 2.13 2.08 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.56 0.00 57 V 8.71 3.34 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 0.79 0.00 0.00 0.93 0.00 0.00 58 E 8.81 4.70 0.00 1.90 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 2.49 2.38 0.00 59 K 7.70 4.55 0.00 1.63 1.75 0.00 1.78 0.00 0.00 1.75 0.00 0.00 2.86 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.32 1.45 7.81 60 L 7.15 4.55 0.00 1.88 1.63 0.52 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 61 D 9.54 5.33 0.00 2.83 3.06 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 62 L 8.42 5.86 0.00 1.74 2.04 0.93 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 63 Y 8.88 5.27 0.00 3.09 3.29 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 64 I 8.17 4.73 1.82 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.74 0.89 0.00 0.00 65 T 9.21 4.51 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 1.12 0.00 0.00 66 V 8.09 4.81 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 1.03 0.00 0.00 67 K 8.93 4.60 0.00 1.72 1.68 0.00 1.60 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.34 1.41 7.81 68 G 9.06 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 0.00 0.00 0.00 0.00 69 G 10.13 4.15 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 G 8.31 4.05 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 0.00 0.00 0.00 71 I 8.07 3.73 1.82 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.58 0.74 0.00 0.00 72 S 7.93 4.02 0.00 3.95 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 73 G 8.13 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 74 Q 9.79 4.22 0.00 2.90 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.67 0.00 0.00 0.00 0.00 0.00 2.98 2.58 0.00 75 A 8.37 4.15 0.79 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 0.00 0.00 76 G 8.71 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.60 4.04 1.52 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 0.00 0.00 78 I 7.94 3.64 2.13 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.12 0.97 0.00 0.00 79 R 7.92 3.93 0.00 1.98 2.15 0.00 3.40 0.00 0.00 3.14 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 2.01 0.00 80 H 8.23 4.34 0.00 3.31 3.48 0.00 5.84 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 81 G 7.98 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 I 8.31 3.67 2.05 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 1.41 0.79 0.88 0.00 0.00 83 T 7.85 3.78 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 1.43 0.00 0.00 84 R 8.09 3.99 0.00 1.83 1.82 0.00 3.25 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.52 0.00 85 A 8.50 4.66 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 86 L 7.92 4.02 0.00 1.94 1.70 0.90 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 87 M 7.75 4.35 0.00 2.34 2.04 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.68 0.00 88 E 8.71 4.32 0.00 2.44 2.37 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 2.45 2.54 0.00 89 Y 6.79 3.96 0.00 1.69 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 90 D 8.19 4.26 0.00 2.72 2.55 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 91 E 8.70 4.21 0.00 1.98 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 2.52 2.27 0.00 92 S 8.06 4.53 0.00 3.99 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 93 L 7.62 4.33 0.00 1.88 1.90 0.95 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 94 R 7.98 3.95 0.00 1.84 2.03 0.00 3.32 0.00 0.00 3.25 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.63 0.00 95 S 8.16 4.08 0.00 3.88 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 96 E 8.10 4.19 0.00 2.02 1.95 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 2.29 2.47 0.00 97 L 7.65 3.79 0.00 1.76 1.60 0.84 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 98 R 8.32 4.00 0.00 1.90 2.07 0.00 3.13 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 99 K 7.58 3.92 0.00 1.84 2.10 0.00 1.86 0.00 0.00 1.80 0.00 0.00 3.06 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.50 1.50 7.81 100 A 7.94 4.79 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 G 8.53 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 0.00 0.00 0.00 102 F 8.47 4.83 0.00 3.13 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 0.00 103 V 8.30 3.85 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 0.79 0.00 0.00 0.98 0.00 0.00 104 T 7.80 3.93 4.22 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 1.21 0.00 0.00 105 R 8.16 4.09 0.00 1.78 1.85 0.00 3.40 0.00 0.00 3.12 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.57 0.00 106 D 8.50 4.28 0.00 2.67 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 A 8.40 4.05 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 0.00 108 R 6.83 3.88 0.00 1.83 1.90 0.00 3.16 0.00 0.00 3.13 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.58 0.00 109 Q 8.18 4.53 0.00 2.13 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.88 0.00 0.00 0.00 0.00 0.00 2.24 2.29 0.00 110 V 8.25 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 0.81 0.00 0.00 0.93 0.00 0.00 111 E 8.51 4.39 0.00 1.94 1.83 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 2.24 2.34 0.00 112 R 8.44 3.93 0.00 1.96 1.93 0.00 3.08 0.00 0.00 3.15 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.62 0.00 113 K 8.46 4.20 0.00 1.74 1.78 0.00 1.77 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.53 7.81 114 K 8.43 4.31 0.00 1.90 1.70 0.00 1.61 0.00 0.00 1.96 0.00 0.00 3.04 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.52 1.48 7.81 115 V 7.99 3.86 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 0.69 0.00 0.00 0.93 0.00 0.00 116 G 8.98 4.34 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 0.00 117 L 6.75 4.35 0.00 1.54 1.86 0.96 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 118 R 8.73 4.54 0.00 1.69 2.00 0.00 3.30 0.00 0.00 3.15 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.52 0.00 119 K 7.96 4.32 0.00 1.78 1.64 0.00 1.90 0.00 0.00 1.82 0.00 0.00 2.93 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.39 1.40 7.81 120 A 8.44 3.95 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 0.00 121 R 8.19 4.55 0.00 1.74 1.91 0.00 3.33 0.00 0.00 3.15 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.70 0.00 122 R 8.06 3.94 0.00 1.84 1.84 0.00 3.16 0.00 0.00 3.34 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.66 0.00 123 R 8.32 4.75 0.00 1.85 1.84 0.00 3.27 0.00 0.00 3.28 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.60 0.00 124 P 0.00 4.26 0.00 2.20 2.11 0.00 3.80 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.99 0.00 125 Q 8.76 4.22 0.00 2.19 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.90 0.00 0.00 0.00 0.00 0.00 2.34 2.36 0.00 126 F 8.95 4.68 0.00 3.17 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 0.00 127 S 7.19 3.06 0.00 3.92 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 K 7.85 3.77 0.00 1.65 1.75 0.00 1.59 0.00 0.00 1.59 0.00 0.00 3.05 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.43 1.49 7.81 129 R 8.48 4.57 0.00 1.91 1.84 0.00 3.59 0.00 0.00 3.35 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.82 0.00