NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 D 4.5996 8.3644 120.5379 54.3155 42.4203 174.3490 3 N 4.7731 8.4081 117.3232 49.9657 41.1135 173.1355 4 S 4.2254 9.5709 125.5942 61.0658 63.4287 176.0063 5 R 4.1623 7.9462 121.7924 59.2103 29.9910 177.8552 6 Y 4.7571 8.3175 120.4768 60.3449 38.8812 177.5656 7 T 3.3629 8.4459 110.4148 63.9624 69.1710 176.0656 8 H 4.3222 7.7952 120.4050 58.5931 30.0226 176.9158 9 F 4.1160 8.5269 123.1351 61.1668 39.3214 177.0269 10 L 3.7327 8.7464 119.5735 58.0753 41.2023 179.3500 11 T 3.8633 7.6041 114.7474 66.4519 68.5569 175.6201 12 Q 4.4936 7.2318 114.5248 56.2354 29.1887 175.2038 13 H 4.7396 7.6443 114.9277 54.2381 31.8609 171.8228 14 Y 5.0882 8.0281 119.1485 55.9267 41.9227 174.7273 15 D 4.1767 8.4512 126.0821 53.1680 43.6901 175.1299 16 A 3.7133 8.8353 129.0381 54.6006 18.7485 176.7521 17 K 4.6370 7.5735 112.3397 54.4761 35.6894 173.6824 18 P 4.6624 0.0000 0.0000 60.6693 31.9796 176.0493 19 Q 4.1155 8.7287 123.2602 57.6074 28.9302 176.7920 20 G 4.1929 7.2993 104.1522 43.9268 0.0000 172.4012 21 R 4.0187 8.1628 117.8625 54.7548 32.0896 176.3172 22 D 4.8308 7.7394 120.2750 52.9328 43.1214 175.6614 23 D 4.4794 8.6569 117.3447 58.0869 40.8372 178.4382 24 R 4.0970 8.0995 117.2828 58.2340 30.1073 178.0835 25 Y 4.0910 7.8244 120.3032 60.5802 39.0462 176.5352 26 C 3.9296 8.0293 117.2094 60.1243 36.0006 175.9530 27 E 4.0452 8.4746 119.3213 58.7421 29.0188 178.5422 28 S 4.2557 7.3502 113.5702 60.4710 62.5146 175.4642 29 I 3.3620 7.6067 121.0532 64.4076 37.6101 177.9226 30 M 4.0087 7.5494 118.9497 58.5427 31.5250 178.8078 31 R 3.9541 7.8163 117.5026 58.8416 30.4738 177.5767 32 R 4.3573 7.6702 113.1713 56.3473 29.9539 176.6624 33 R 4.5527 7.5829 118.6972 56.7891 31.0097 175.3982 34 G 4.1077 8.0885 102.4335 47.0061 0.0000 174.2841 35 L 4.7524 8.1493 115.7096 54.3722 42.1620 178.2657 36 T 4.7378 8.0300 106.9387 61.2064 70.0816 174.0246 37 S 4.7736 7.7901 116.5513 55.4399 62.2376 170.8580 38 P 4.8629 0.0000 0.0000 62.0193 32.8090 176.5366 39 C 4.8386 8.6534 118.5751 56.0462 40.6936 174.2311 40 K 4.2518 8.6856 126.6577 56.5079 32.1051 176.6164 41 D 4.6322 8.9252 126.9639 56.2809 40.7164 176.1073 42 I 5.0986 7.4894 117.7427 59.4330 41.2044 173.6759 43 N 5.0881 8.8142 126.3385 51.5898 42.5983 172.8221 44 T 4.7640 8.2318 121.2156 61.7230 71.7006 172.9715 45 F 4.7570 8.8391 124.8971 55.9440 41.9453 174.7786 46 I 4.6178 8.5140 122.3405 59.9594 39.7605 174.6045 47 H 5.3946 8.1574 121.5842 53.8723 32.0197 174.5341 48 G 3.8557 8.6174 105.9534 44.0388 0.0000 172.3111 49 N 4.3248 8.9401 115.9549 54.3657 39.4410 176.4515 50 K 4.1833 8.8968 125.5771 58.4916 33.0701 178.0890 51 R 4.3645 7.9763 117.5649 58.1950 29.9776 177.2268 52 S 4.5905 7.5852 112.7476 59.3603 62.9507 174.5919 53 I 4.2943 7.4673 122.7808 63.1514 38.7532 177.9356 54 K 3.9711 7.6981 117.4339 59.1551 31.7312 179.2417 55 A 4.3318 7.9330 122.2714 54.4878 17.7470 179.5571 56 I 3.8388 7.7690 118.6250 64.7643 36.8864 177.8097 57 C 4.3386 7.9094 116.2472 58.6890 38.6909 173.0907 58 E 4.8485 8.2258 117.1003 53.6577 32.5548 176.2097 59 N 4.2886 8.8359 116.4886 56.5498 38.7007 177.2396 60 K 3.8927 8.1049 117.7054 59.6251 32.4040 176.7372 61 N 5.0936 8.4212 114.3490 53.2031 41.2979 173.7498 62 G 4.6838 7.8836 102.1933 44.4052 0.0000 172.5965 63 N 5.2632 9.6242 121.4496 50.1833 42.1022 172.3520 64 P 4.6021 0.0000 0.0000 63.9289 32.5000 175.1109 65 H 4.7350 9.4215 121.3851 55.0935 33.6477 173.2161 66 R 3.4865 8.5584 125.1447 57.5553 31.2033 176.4718 67 E 3.8425 9.1469 115.5350 57.3738 27.9676 176.1351 68 N 4.7722 8.8183 122.0893 53.0651 39.2179 176.0203 69 L 4.4475 7.4283 119.8188 55.0844 43.0784 176.0712 70 R 5.0380 9.2407 121.3614 54.4243 33.3164 174.7854 71 I 4.9869 8.5724 122.8653 58.9017 41.0516 175.1309 72 S 4.9177 8.7128 123.5427 58.8001 63.4006 174.2033 73 K 4.3888 8.9015 120.9367 58.4865 32.7643 177.9904 74 S 4.3554 8.2923 113.3277 57.2571 63.8722 173.7564 75 S 4.2840 7.8753 116.8108 58.0519 63.7008 172.5723 76 F 4.9491 9.8002 122.9169 55.5810 43.1507 174.3103 77 Q 5.0539 8.9219 120.5968 56.0516 30.0855 175.4899 78 V 4.8128 9.0454 115.9612 59.9613 36.9430 174.7066 79 T 5.0104 8.6060 119.2567 62.3538 71.6841 173.1102 80 T 4.7307 8.7930 124.5649 62.5405 70.6253 173.5580 81 C 5.0844 9.2532 125.1435 55.4689 37.7317 173.0340 82 K 4.8473 8.8286 125.2598 54.5741 32.9857 176.5799 83 L 3.8202 9.1629 128.4328 55.8528 42.8238 175.6985 84 H 4.6533 9.1078 123.0327 55.3788 32.1249 174.1843 85 G 3.9042 10.0994 110.2616 44.7120 0.0000 173.8639 86 G 4.1001 8.1890 104.7374 45.9568 0.0000 172.9560 87 S 3.9824 8.1228 115.8280 57.9177 62.6653 172.6787 88 P 4.3177 0.0000 0.0000 63.4896 31.3534 175.6557 89 W 5.6104 7.0230 118.5544 54.6456 30.5770 174.4874 90 P 4.6766 0.0000 0.0000 61.5676 31.6688 174.4622 91 P 4.3167 0.0000 0.0000 63.0989 31.7694 176.6684 92 C 4.5735 8.6179 118.3587 55.6150 36.7327 172.9903 93 Q 4.9295 8.0456 124.1283 53.8811 30.2468 174.7418 94 Y 5.2374 8.7467 120.1352 56.1998 42.2027 175.2155 95 R 4.9700 8.7584 118.9715 54.4249 33.2137 175.5712 96 A 4.7831 9.2307 126.4798 52.5704 19.8286 177.7883 97 T 4.5367 8.8348 116.0858 62.5053 71.5620 173.1769 98 A 5.2325 8.0379 127.9208 51.3039 20.0397 176.2142 99 G 4.2406 8.3608 106.1684 45.5121 0.0000 171.3761 100 F 5.6362 8.7109 121.0647 57.1670 40.9883 173.6465 101 R 4.7175 9.2180 124.2254 55.5829 35.2869 173.8653 102 N 4.8504 8.5292 117.9947 52.3181 39.0343 175.3338 103 V 4.4118 8.1935 114.2630 60.8236 34.0528 175.1353 104 V 4.7525 8.3132 121.6888 61.5355 34.4500 174.7882 105 V 5.1059 8.8934 120.5945 59.6928 36.6349 173.7030 106 A 4.9312 8.5127 121.3523 50.8533 21.6754 175.0741 107 C 5.3187 8.8265 119.2498 55.3890 38.1832 173.7631 108 E 4.4468 9.1133 120.8124 55.9463 32.4579 175.6916 109 N 4.2375 9.6130 123.0458 54.4733 35.9075 175.4991 110 G 3.8616 8.3677 103.2289 45.6347 0.0000 173.6906 111 L 4.4854 7.2170 119.5916 51.5258 44.3790 174.1867 112 P 4.5515 0.0000 0.0000 62.6882 31.8855 177.2598 113 V 4.4171 8.8312 113.8958 61.1807 34.3732 175.2515 114 H 5.1204 7.9448 117.7927 53.9338 32.9636 171.3674 115 L 4.8367 7.8647 125.0110 53.1688 43.7054 176.5891 116 H 4.4788 8.4785 126.3121 56.1591 27.6710 175.1762 117 Q 3.9130 8.3149 126.7990 57.6208 29.6684 177.9877 118 S 4.3488 7.9166 112.3001 60.4899 63.7543 176.2051 119 I 3.5769 7.1135 113.9613 63.6090 37.1272 176.6345 120 F 4.4757 7.4819 118.1084 57.5914 38.5174 175.7074 121 R 4.4910 7.8130 121.4672 55.5535 31.4570 177.1368 122 R 4.6111 7.7698 115.7329 53.6159 30.2134 174.2233 123 P 4.4084 0.0000 0.0000 62.4907 31.1237 176.2361 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 2 D 8.36 4.60 0.00 2.75 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 3 N 8.41 4.77 0.00 2.89 2.92 0.00 0.00 6.64 6.75 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 4 S 9.57 4.23 0.00 4.12 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 5 R 7.95 4.16 0.00 1.95 2.08 0.00 3.14 0.00 0.00 3.47 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.70 0.00 6 Y 8.32 4.76 0.00 3.02 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 7 T 8.45 3.36 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 1.28 0.00 0.00 8 H 7.80 4.32 0.00 3.46 3.52 0.00 5.78 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 F 8.53 4.12 0.00 3.34 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 10 L 8.75 3.73 0.00 1.49 1.51 0.51 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 11 T 7.60 3.86 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 1.14 0.00 0.00 12 Q 7.23 4.49 0.00 1.83 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 7.02 0.00 0.00 0.00 0.00 0.00 2.08 1.90 0.00 13 H 7.64 4.74 0.00 2.18 2.77 0.00 5.57 0.00 0.00 0.00 0.00 6.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 8.03 5.09 0.00 2.80 2.84 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 0.00 0.00 0.00 15 D 8.45 4.18 0.00 2.62 2.45 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 16 A 8.84 3.71 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 K 7.57 4.64 0.00 1.75 1.71 0.00 1.57 0.00 0.00 1.77 0.00 0.00 3.07 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.29 1.40 7.81 18 P 0.00 4.66 0.00 1.82 1.73 0.00 3.20 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 1.37 1.54 0.00 19 Q 8.73 4.12 0.00 2.02 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.82 0.00 0.00 0.00 0.00 0.00 2.33 2.33 0.00 20 G 7.30 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 21 R 8.16 4.02 0.00 1.60 1.71 0.00 3.06 0.00 0.00 2.89 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 1.35 0.00 22 D 7.74 4.83 0.00 2.98 2.85 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 23 D 8.66 4.48 0.00 2.83 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 R 8.10 4.10 0.00 2.03 2.00 0.00 3.13 0.00 0.00 3.28 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.71 0.00 25 Y 7.82 4.09 0.00 2.96 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 26 C 8.03 3.93 0.00 3.27 3.13 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 27 E 8.47 4.05 0.00 2.06 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 2.57 2.64 0.00 28 S 7.35 4.26 0.00 4.02 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 29 I 7.61 3.36 1.09 0.00 0.00 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.77 -0.19 0.00 0.00 30 M 7.55 4.01 0.00 1.94 2.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 2.46 0.00 31 R 7.82 3.95 0.00 1.83 2.23 0.00 3.24 0.00 0.00 3.27 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.70 0.00 32 R 7.67 4.36 0.00 1.96 2.10 0.00 3.00 0.00 0.00 3.16 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.58 0.00 33 R 7.58 4.55 0.00 1.75 1.92 0.00 3.72 0.00 0.00 3.19 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.65 0.00 34 G 8.09 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 0.00 0.00 0.00 35 L 8.15 4.75 0.00 1.90 1.64 0.89 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 36 T 8.03 4.74 4.35 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 1.38 0.00 0.00 37 S 7.79 4.77 0.00 3.89 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 38 P 0.00 4.86 0.00 1.87 1.45 0.00 3.90 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.91 0.00 39 C 8.65 4.84 0.00 2.80 3.11 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 40 K 8.69 4.25 0.00 1.96 1.74 0.00 1.95 0.00 0.00 1.74 0.00 0.00 2.90 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.45 1.51 7.81 41 D 8.93 4.63 0.00 2.79 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 42 I 7.49 5.10 1.91 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.76 0.93 0.00 0.00 43 N 8.81 5.09 0.00 2.63 2.25 0.00 0.00 6.85 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 44 T 8.23 4.76 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 0.26 0.00 0.00 45 F 8.84 4.76 0.00 2.98 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 46 I 8.51 4.62 1.96 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.63 0.89 0.00 0.00 47 H 8.16 5.39 0.00 3.04 3.24 0.00 5.59 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 G 8.62 3.86 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 0.00 0.00 0.00 49 N 8.94 4.32 0.00 2.92 2.89 0.00 0.00 6.58 6.75 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 50 K 8.90 4.18 0.00 1.68 1.79 0.00 1.78 0.00 0.00 1.81 0.00 0.00 2.82 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.39 0.94 7.81 51 R 7.98 4.36 0.00 2.00 1.96 0.00 3.30 0.00 0.00 3.36 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.82 0.00 52 S 7.59 4.59 0.00 4.29 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 0.00 53 I 7.47 4.29 2.23 0.00 0.00 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 1.54 1.17 1.02 0.00 0.00 54 K 7.70 3.97 0.00 1.86 1.79 0.00 1.66 0.00 0.00 1.69 0.00 0.00 2.96 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.28 1.50 7.81 55 A 7.93 4.33 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 56 I 7.77 3.84 1.93 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.02 0.89 0.00 0.00 57 C 7.91 4.34 0.00 3.21 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 58 E 8.23 4.85 0.00 2.05 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 2.14 2.34 0.00 59 N 8.84 4.29 0.00 2.77 2.95 0.00 0.00 6.41 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 60 K 8.10 3.89 0.00 1.72 1.88 0.00 1.76 0.00 0.00 1.65 0.00 0.00 2.99 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.46 1.47 7.81 61 N 8.42 5.09 0.00 2.91 2.62 0.00 0.00 6.74 7.80 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 62 G 7.88 4.68 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 0.00 0.00 0.00 63 N 9.62 5.26 0.00 2.59 2.69 0.00 0.00 6.80 7.37 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 64 P 0.00 4.60 0.00 1.93 2.01 0.00 3.68 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.11 0.00 65 H 9.42 4.74 0.00 3.18 3.11 0.00 5.92 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 R 8.56 3.49 0.00 1.71 1.16 0.00 3.20 0.00 0.00 3.17 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.64 0.00 67 E 9.15 3.84 0.00 1.98 1.73 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 2.30 2.34 0.00 68 N 8.82 4.77 0.00 2.81 2.91 0.00 0.00 6.00 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 69 L 7.43 4.45 0.00 1.98 1.61 0.97 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 70 R 9.24 5.04 0.00 1.76 1.78 0.00 3.04 0.00 0.00 3.31 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.51 0.00 71 I 8.57 4.99 1.74 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.61 1.04 0.00 0.00 72 S 8.71 4.92 0.00 4.32 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 73 K 8.90 4.39 0.00 1.90 1.90 0.00 1.70 0.00 0.00 1.76 0.00 0.00 3.02 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.45 1.38 7.81 74 S 8.29 4.36 0.00 3.68 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 75 S 7.88 4.28 0.00 3.27 2.63 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 76 F 9.80 4.95 0.00 3.10 2.96 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 77 Q 8.92 5.05 0.00 2.16 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.82 0.00 0.00 0.00 0.00 0.00 2.70 2.44 0.00 78 V 9.05 4.81 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 0.81 0.00 0.00 1.15 0.00 0.00 79 T 8.61 5.01 4.58 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 1.47 0.00 0.00 80 T 8.79 4.73 4.31 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 1.31 0.00 0.00 81 C 9.25 5.08 0.00 2.62 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 82 K 8.83 4.85 0.00 2.01 1.83 0.00 1.65 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.49 7.81 83 L 9.16 3.82 0.00 1.87 1.65 0.43 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 84 H 9.11 4.65 0.00 3.10 3.13 0.00 5.80 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 G 10.10 3.90 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 0.00 0.00 0.00 86 G 8.19 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 0.00 0.00 0.00 0.00 87 S 8.12 3.98 0.00 3.85 3.77 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 88 P 0.00 4.32 0.00 1.42 1.91 0.00 3.46 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.59 0.00 89 W 7.02 5.61 0.00 3.32 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 90 P 0.00 4.68 0.00 2.24 2.16 0.00 4.16 0.00 0.00 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.07 0.00 91 P 0.00 4.32 0.00 2.20 2.11 0.00 3.77 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 0.00 92 C 8.62 4.57 0.00 3.01 2.84 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 0.00 0.00 0.00 93 Q 8.05 4.93 0.00 1.93 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.70 6.75 0.00 0.00 0.00 0.00 0.00 2.34 2.27 0.00 94 Y 8.75 5.24 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 95 R 8.76 4.97 0.00 1.84 1.87 0.00 3.23 0.00 0.00 3.26 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.60 0.00 96 A 9.23 4.78 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 97 T 8.83 4.54 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 1.29 0.00 0.00 98 A 8.04 5.23 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 G 8.36 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 F 8.71 5.64 0.00 2.91 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 R 9.22 4.72 0.00 1.82 1.76 0.00 3.30 0.00 0.00 3.67 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.65 0.00 102 N 8.53 4.85 0.00 2.83 2.97 0.00 0.00 6.03 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 0.00 103 V 8.19 4.41 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.00 0.00 0.66 0.00 0.00 104 V 8.31 4.75 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 0.82 0.00 0.00 0.73 0.00 0.00 105 V 8.89 5.11 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 0.82 0.00 0.00 106 A 8.51 4.93 1.27 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 0.00 0.00 107 C 8.83 5.32 0.00 2.79 2.91 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 0.00 108 E 9.11 4.45 0.00 1.90 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.26 0.00 109 N 9.61 4.24 0.00 2.82 2.83 0.00 0.00 7.19 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 0.00 110 G 8.37 3.86 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 0.00 0.00 0.00 111 L 7.22 4.49 0.00 1.51 0.96 0.79 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 112 P 0.00 4.55 0.00 0.58 1.68 0.00 3.45 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.69 0.00 113 V 8.83 4.42 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 1.07 0.00 0.00 114 H 7.94 5.12 0.00 3.21 3.13 0.00 5.80 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 L 7.86 4.84 0.00 1.44 1.19 0.75 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 116 H 8.48 4.48 0.00 3.24 3.23 0.00 5.83 0.00 0.00 0.00 0.00 6.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 Q 8.31 3.91 0.00 2.25 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.85 6.66 0.00 0.00 0.00 0.00 0.00 2.41 2.42 0.00 118 S 7.92 4.35 0.00 4.02 4.06 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 0.00 119 I 7.11 3.58 1.65 0.00 0.00 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 -0.36 1.01 0.00 0.00 120 F 7.48 4.48 0.00 3.07 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 0.00 121 R 7.81 4.49 0.00 1.89 1.91 0.00 3.11 0.00 0.00 3.24 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.69 0.00 122 R 7.77 4.61 0.00 1.76 1.85 0.00 3.35 0.00 0.00 3.28 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.70 0.00 123 P 0.00 4.41 0.00 2.04 1.98 0.00 3.71 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.13 0.00