NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.4525 8.3349 116.7959 58.5479 64.9522 174.2983 3 S 4.0423 8.0335 114.7317 58.4992 63.1391 172.2896 4 L 4.7996 9.0243 124.6857 52.8702 45.2577 175.6167 5 I 4.2234 8.1661 123.0282 60.6222 38.6350 174.4717 6 R 4.8784 8.6032 127.2188 54.6848 31.9561 175.2072 7 R 4.7513 9.2339 124.6930 54.3640 34.0532 174.3428 8 V 4.6862 8.3693 122.4082 61.3299 33.3773 174.7884 9 I 4.2478 8.4727 129.2708 60.5733 38.2256 175.8614 10 S 4.5474 8.5846 121.7376 57.4984 63.8146 172.5126 11 T 4.5789 9.4800 122.0571 59.7139 69.6310 174.9438 12 A 4.1172 8.5382 130.1680 54.4759 18.6317 178.5047 13 K 4.1758 7.8136 113.3145 57.2661 32.4189 176.5896 14 A 4.8414 7.2668 120.6368 48.9468 21.9423 174.2000 15 P 4.3212 0.0000 0.0000 62.5182 31.8858 177.2500 16 G 3.6889 8.5128 111.6012 44.9851 0.0000 173.2341 17 A 4.0725 8.3148 125.3835 52.0063 18.8218 177.5008 18 I 4.4994 8.2001 114.8630 59.9131 38.0936 175.3543 19 G 4.1445 7.0349 109.1712 45.3872 0.0000 171.9822 20 P 4.6111 0.0000 0.0000 61.3748 30.1471 174.7954 21 Y 4.9168 6.7121 115.3590 56.2699 41.5694 175.0855 22 S 4.8314 8.3700 116.4796 56.7436 65.6709 174.4389 23 Q 4.4018 8.6939 121.6673 59.1957 29.4267 176.3777 24 A 5.0804 7.6952 117.6173 50.9764 23.1307 175.1286 25 V 4.7297 8.8952 118.9337 61.0852 34.9904 173.9373 26 L 5.2561 9.0091 130.2803 53.4047 44.5666 175.1613 27 V 4.8339 8.5542 125.2410 60.5593 34.8673 174.7650 28 D 4.5473 9.7816 128.2211 55.5125 39.6172 174.2245 29 R 4.1435 7.9721 116.2012 56.3812 29.2148 176.1472 30 T 4.7521 7.7788 115.4153 61.9881 70.5784 173.6782 31 I 4.7919 8.6881 127.5067 59.7791 39.8889 174.1194 32 Y 4.6592 9.1587 126.0334 56.6892 39.1969 174.6437 33 I 4.7534 8.5235 125.9401 59.2618 39.5169 175.9635 34 S 4.2379 8.8734 123.4376 58.3847 63.6894 174.6070 35 G 3.7673 8.5174 109.5711 46.2867 0.0000 172.7722 36 Q 4.9355 9.1124 124.6788 54.1860 31.3146 174.8494 37 I 4.9479 8.2006 115.4773 57.9418 41.2926 175.2741 38 G 3.9861 8.1055 108.1714 46.4749 0.0000 173.5247 39 M 4.9403 7.7834 118.4876 54.2080 33.8147 177.2372 40 D 4.4843 9.0038 123.9809 53.5985 41.8484 175.6543 41 P 4.2903 0.0000 0.0000 65.3036 31.6298 177.5681 42 S 4.4659 8.2988 113.2015 59.3482 63.2011 174.8918 43 S 4.4922 8.1939 112.9005 57.0590 64.4789 175.0173 44 G 3.9423 8.3299 107.8645 46.1017 0.0000 172.9273 45 Q 4.7983 7.8662 118.1857 53.3085 31.9384 175.2289 46 L 4.5427 8.4038 121.6629 54.8838 42.2513 177.7266 47 V 3.8643 8.3680 116.8205 61.6324 32.2145 176.4726 48 S 4.4265 8.4085 119.3838 58.5191 63.8279 174.4673 49 G 3.9967 9.4050 108.8299 45.0742 0.0000 175.8367 50 G 3.8334 8.1705 108.2302 45.0204 0.0000 174.3840 51 V 3.5866 8.3954 117.1689 64.7530 31.4584 177.9221 52 A 3.9819 7.9658 120.8557 55.2094 18.4058 179.3346 53 E 3.9835 8.1254 116.3601 59.5606 29.5038 179.4177 54 E 3.9694 8.4685 118.5517 59.2552 29.4468 179.2301 55 A 3.9808 8.4557 121.3356 54.8869 18.3870 179.4770 56 K 3.8090 7.9353 117.7488 59.8169 32.2166 178.8249 57 Q 3.9076 8.0710 119.4002 59.0427 28.9946 177.8373 58 A 4.1113 8.2902 122.1891 55.2815 18.3895 179.6726 59 L 3.8717 8.0419 117.6208 57.6636 41.5575 179.7935 60 K 3.9864 8.0304 118.6104 59.4989 32.1157 178.9985 61 N 4.2981 8.4527 117.0302 56.5942 38.4271 177.0033 62 M 4.1192 8.2298 119.5873 58.6551 32.2889 178.4064 63 G 3.0858 8.2217 105.7925 47.7884 0.0000 175.5481 64 E 4.0614 8.2025 120.9532 58.9374 29.2674 179.6182 65 I 3.6902 7.6365 119.7235 64.2201 37.1664 178.2736 66 L 3.8765 8.0188 120.1970 57.7676 41.3658 179.4867 67 K 4.0579 8.5706 120.9110 58.9425 31.8564 178.6536 68 A 3.9698 7.8705 119.7962 54.3912 18.3135 178.3970 69 A 4.4549 7.4564 116.9698 51.3955 19.0782 177.4285 70 G 3.7778 8.1560 105.9727 46.9687 0.0000 173.2736 71 C 5.0029 8.2591 118.1751 57.4114 31.8381 171.6588 72 D 4.7276 8.6761 118.3260 52.0240 42.2090 175.9382 73 F 4.2583 8.4960 116.2792 60.7648 38.8766 177.7166 74 T 4.1496 8.0360 110.0340 64.0033 68.7998 175.1253 75 N 4.5537 8.3095 119.3394 54.4329 39.0543 175.2047 76 V 4.1661 7.6895 118.9003 63.0240 32.2329 175.7457 77 V 4.4483 8.7655 119.1570 61.3971 34.4396 175.3988 78 K 5.2398 7.8116 121.4946 55.2540 35.7397 174.6220 79 T 5.2672 9.0972 116.6818 60.2214 72.8698 172.6250 80 T 5.0229 8.8380 118.7354 61.7802 72.3594 173.1141 81 V 4.3522 8.8496 126.5864 61.1309 33.9102 174.0487 82 L 4.6802 8.8700 128.9948 53.0020 43.6483 175.7570 83 L 5.1039 8.2924 123.4298 52.7699 44.5068 177.4953 84 A 4.1586 8.6831 123.1058 54.1210 19.4084 177.7459 85 D 4.5260 7.7025 115.3064 53.0160 43.7065 175.4949 86 I 3.5194 9.0297 128.4592 64.1097 38.0684 176.9485 87 N 4.6781 8.4851 115.6105 54.6428 38.6446 175.7301 88 D 4.6898 8.2580 118.5942 54.5634 41.0287 177.7782 89 F 4.5281 8.0002 123.2269 61.4191 39.5073 176.5497 90 N 4.2841 8.3190 115.6432 56.7365 38.2555 177.1511 91 T 3.8833 7.9398 116.3143 66.8096 68.5745 176.6204 92 V 3.7046 7.9674 119.9530 66.1274 31.5512 177.7865 93 N 4.3153 8.8252 116.6552 56.2684 38.1388 176.8947 94 E 3.9925 7.9148 119.3523 59.4553 29.9293 178.7416 95 I 3.9959 7.7548 119.8437 64.4268 37.1423 177.5419 96 Y 4.2490 8.5866 120.8795 60.9297 38.4365 178.2635 97 K 4.6931 8.1148 118.2774 57.9572 32.2820 178.7107 98 Q 3.9988 8.1511 117.9919 57.6592 28.6614 176.1126 99 Y 3.7260 7.6285 115.8088 58.0967 39.8403 175.3818 100 F 4.6721 7.9257 120.2025 55.7746 38.8734 176.6923 101 K 4.0667 8.7053 126.1075 58.9220 32.2759 177.1964 102 S 3.3767 7.6327 109.1491 58.2796 65.5685 173.0376 103 N 3.9887 8.2424 114.2720 54.4388 35.5924 174.8412 104 F 4.5352 7.3384 115.8216 56.8691 40.2109 174.3605 105 P 4.5885 0.0000 0.0000 62.3742 32.0293 176.1784 106 A 4.3075 8.6546 123.7576 52.6121 19.6060 176.5650 107 R 5.6035 8.5374 117.6750 54.7888 33.5936 173.9614 108 A 5.0543 8.5694 124.4377 50.3861 22.8047 174.8044 109 A 5.2468 8.7226 120.4954 51.4193 22.4673 175.0804 110 Y 4.6557 7.6949 117.9128 56.4095 41.3008 172.5320 111 Q 4.8348 8.7512 121.5382 55.1446 30.3586 175.1985 112 V 4.4488 8.1889 119.1847 59.5611 33.9537 176.0112 113 A 4.0929 8.6719 123.7556 55.1307 18.5590 177.8444 114 A 4.4808 7.3376 114.0119 51.4764 22.1129 175.2197 115 L 4.8131 7.9201 119.8289 51.6715 45.1378 174.4909 116 P 4.3310 0.0000 0.0000 64.4500 31.5960 177.2755 117 K 3.6402 9.4088 119.7669 56.8353 29.5100 176.0104 118 G 3.8865 8.0714 105.2545 46.3734 0.0000 174.8086 119 S 4.3754 7.7230 114.9236 58.8345 63.4086 174.9265 120 R 4.3345 9.5048 121.5435 57.7265 31.1697 176.1288 121 I 4.9124 7.3216 117.3819 59.6586 40.9148 173.3212 122 E 4.8907 9.2635 128.9118 54.5321 33.2712 173.9918 123 I 5.1113 8.8729 127.3021 59.5613 40.4605 174.6320 124 E 5.0832 8.8431 124.8539 55.0177 32.7637 174.5513 125 A 5.1851 8.3298 119.9398 50.9733 23.4967 175.2249 126 V 4.7135 9.0138 118.9299 61.0530 34.7369 174.4867 127 A 5.2270 8.8638 128.1087 50.1845 23.0726 174.4128 128 I 4.8285 8.1955 119.9202 59.1913 39.3243 175.9464 129 Q 4.0391 9.1945 129.6829 56.0689 29.6172 176.4404 130 G 3.9413 8.5019 115.0815 44.0444 0.0000 171.0804 131 P 4.5645 0.0000 0.0000 61.9206 32.0745 176.2180 132 L 4.8701 8.2164 120.2570 53.1781 45.0031 176.1904 133 T 4.6053 8.3920 117.9582 62.0139 71.4062 173.4205 134 T 4.4739 8.4775 122.3529 61.7804 70.4629 174.4771 135 A 4.2644 8.5133 127.5929 52.3557 19.0308 176.8308 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 S 8.33 4.45 0.00 3.88 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 3 S 8.03 4.04 0.00 3.94 3.82 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 4 L 9.02 4.80 0.00 1.61 1.56 0.94 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 5 I 8.17 4.22 1.88 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 1.24 0.70 0.92 0.00 0.00 6 R 8.60 4.88 0.00 1.82 1.81 0.00 3.19 0.00 0.00 3.24 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.79 0.00 7 R 9.23 4.75 0.00 1.72 1.76 0.00 3.15 0.00 0.00 3.10 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.54 0.00 8 V 8.37 4.69 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 0.81 0.00 0.00 0.94 0.00 0.00 9 I 8.47 4.25 1.89 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 1.13 0.96 0.91 0.00 0.00 10 S 8.58 4.55 0.00 3.80 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 11 T 9.48 4.58 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 1.32 0.00 0.00 12 A 8.54 4.12 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 13 K 7.81 4.18 0.00 1.79 1.87 0.00 1.64 0.00 0.00 1.87 0.00 0.00 2.97 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.47 1.38 7.81 14 A 7.27 4.84 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 15 P 0.00 4.32 0.00 2.10 2.04 0.00 3.71 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.23 0.00 16 G 8.51 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 17 A 8.31 4.07 0.54 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 0.00 0.00 18 I 8.20 4.50 1.90 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 1.34 0.93 0.92 0.00 0.00 19 G 7.03 4.14 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 0.00 20 P 0.00 4.61 0.00 2.23 2.13 0.00 3.94 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.00 0.00 21 Y 6.71 4.92 0.00 3.03 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 22 S 8.37 4.83 0.00 3.91 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 23 Q 8.69 4.40 0.00 2.25 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.70 0.00 0.00 0.00 0.00 0.00 2.51 2.42 0.00 24 A 7.70 5.08 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 25 V 8.90 4.73 2.19 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 1.03 0.00 0.00 0.98 0.00 0.00 26 L 9.01 5.26 0.00 1.79 1.51 0.96 0.88 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 27 V 8.55 4.83 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 1.20 0.00 0.00 0.99 0.00 0.00 28 D 9.78 4.55 0.00 2.78 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 29 R 7.97 4.14 0.00 2.07 2.12 0.00 3.53 0.00 0.00 3.33 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.58 0.00 30 T 7.78 4.75 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 0.71 0.00 0.00 31 I 8.69 4.79 1.81 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 1.21 0.65 0.91 0.00 0.00 32 Y 9.16 4.66 0.00 2.91 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 33 I 8.52 4.75 2.02 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 1.25 1.08 0.95 0.00 0.00 34 S 8.87 4.24 0.00 3.94 3.82 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 35 G 8.52 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 0.00 0.00 0.00 36 Q 9.11 4.94 0.00 1.98 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.52 0.00 0.00 0.00 0.00 0.00 2.46 2.45 0.00 37 I 8.20 4.95 1.86 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 1.28 0.67 0.93 0.00 0.00 38 G 8.11 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 39 M 7.78 4.94 0.00 1.93 2.02 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 2.59 2.54 0.00 40 D 9.00 4.48 0.00 2.80 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 41 P 0.00 4.29 0.00 2.09 2.05 0.00 3.73 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 2.03 2.11 0.00 42 S 8.30 4.47 0.00 3.95 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 43 S 8.19 4.49 0.00 3.95 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 44 G 8.33 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 45 Q 7.87 4.80 0.00 2.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.32 6.94 0.00 0.00 0.00 0.00 0.00 2.28 2.51 0.00 46 L 8.40 4.54 0.00 1.53 1.61 0.97 0.96 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 47 V 8.37 3.86 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 0.69 0.00 0.00 1.05 0.00 0.00 48 S 8.41 4.43 0.00 3.86 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 49 G 9.41 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.17 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 0.00 0.00 0.00 51 V 8.40 3.59 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 1.03 0.00 0.00 0.92 0.00 0.00 52 A 7.97 3.98 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 53 E 8.13 3.98 0.00 2.04 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 2.41 2.48 0.00 54 E 8.47 3.97 0.00 2.08 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 2.33 2.46 0.00 55 A 8.46 3.98 1.42 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 56 K 7.94 3.81 0.00 1.95 2.03 0.00 1.74 0.00 0.00 1.64 0.00 0.00 2.98 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.52 1.65 7.81 57 Q 8.07 3.91 0.00 2.24 2.08 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 2.47 2.46 0.00 58 A 8.29 4.11 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 59 L 8.04 3.87 0.00 1.04 0.71 0.86 1.14 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 60 K 8.03 3.99 0.00 1.96 1.89 0.00 1.72 0.00 0.00 1.73 0.00 0.00 3.02 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.59 1.78 7.81 61 N 8.45 4.30 0.00 2.89 3.02 0.00 0.00 6.68 7.41 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 62 M 8.23 4.12 0.00 2.34 2.13 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.58 0.00 63 G 8.22 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 0.00 0.00 0.00 64 E 8.20 4.06 0.00 2.11 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 2.50 2.65 0.00 65 I 7.64 3.69 2.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.40 0.91 0.00 0.00 66 L 8.02 3.88 0.00 1.54 1.67 0.58 0.73 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 67 K 8.57 4.06 0.00 1.78 1.90 0.00 1.65 0.00 0.00 1.72 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.40 1.28 7.81 68 A 7.87 3.97 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 69 A 7.46 4.45 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 70 G 8.16 3.78 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 0.00 0.00 0.00 0.00 0.00 0.00 71 C 8.26 5.00 0.00 2.84 3.07 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 72 D 8.68 4.73 0.00 2.79 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 73 F 8.50 4.26 0.00 3.03 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 74 T 8.04 4.15 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 1.26 0.00 0.00 75 N 8.31 4.55 0.00 2.97 3.09 0.00 0.00 6.46 6.96 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 76 V 7.69 4.17 2.58 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 0.91 0.00 0.00 1.20 0.00 0.00 77 V 8.77 4.45 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 0.77 0.00 0.00 0.99 0.00 0.00 78 K 7.81 5.24 0.00 1.85 1.60 0.00 1.69 0.00 0.00 1.89 0.00 0.00 3.02 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.44 1.53 7.81 79 T 9.10 5.27 4.41 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 1.17 0.00 0.00 80 T 8.84 5.02 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 1.20 0.00 0.00 81 V 8.85 4.35 1.98 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 0.80 0.00 0.00 0.94 0.00 0.00 82 L 8.87 4.68 0.00 1.50 1.36 0.84 -0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 83 L 8.29 5.10 0.00 1.35 1.41 0.24 0.26 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 84 A 8.68 4.16 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 85 D 7.70 4.53 0.00 2.61 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 86 I 9.03 3.52 1.94 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.10 0.92 0.00 0.00 87 N 8.49 4.68 0.00 2.88 2.86 0.00 0.00 7.02 8.02 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 88 D 8.26 4.69 0.00 2.80 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 89 F 8.00 4.53 0.00 3.21 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 90 N 8.32 4.28 0.00 2.83 2.87 0.00 0.00 7.12 7.05 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 91 T 7.94 3.88 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 1.25 0.00 0.00 92 V 7.97 3.70 2.39 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 1.24 0.00 0.00 0.97 0.00 0.00 93 N 8.83 4.32 0.00 2.77 2.73 0.00 0.00 6.65 7.70 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 94 E 7.91 3.99 0.00 2.00 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 0.00 2.35 2.43 0.00 95 I 7.75 4.00 2.13 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 1.49 0.56 1.08 0.00 0.00 96 Y 8.59 4.25 0.00 3.23 3.21 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 97 K 8.11 4.69 0.00 2.02 1.97 0.00 1.79 0.00 0.00 1.55 0.00 0.00 3.15 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.62 1.63 7.81 98 Q 8.15 4.00 0.00 1.78 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.01 6.74 0.00 0.00 0.00 0.00 0.00 2.30 2.53 0.00 99 Y 7.63 3.73 0.00 1.88 1.43 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 0.00 0.00 0.00 0.00 100 F 7.93 4.67 0.00 3.04 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 0.00 101 K 8.71 4.07 0.00 1.70 1.81 0.00 1.77 0.00 0.00 1.66 0.00 0.00 3.09 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.40 1.45 7.81 102 S 7.63 3.38 0.00 3.68 3.64 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 0.00 103 N 8.24 3.99 0.00 2.74 2.84 0.00 0.00 6.83 7.45 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 0.00 104 F 7.34 4.54 0.00 3.05 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 0.00 105 P 0.00 4.59 0.00 1.84 1.93 0.00 3.68 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 2.15 0.00 106 A 8.65 4.31 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 R 8.54 5.60 0.00 1.72 1.68 0.00 2.70 0.00 0.00 3.52 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.58 0.00 108 A 8.57 5.05 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 0.00 109 A 8.72 5.25 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 0.00 110 Y 7.69 4.66 0.00 2.93 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 0.00 111 Q 8.75 4.83 0.00 2.04 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.84 0.00 0.00 0.00 0.00 0.00 2.26 2.51 0.00 112 V 8.19 4.45 2.12 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 0.81 0.00 0.00 0.94 0.00 0.00 113 A 8.67 4.09 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 0.00 114 A 7.34 4.48 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 0.00 115 L 7.92 4.81 0.00 1.81 1.51 0.88 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 116 P 0.00 4.33 0.00 2.14 1.95 0.00 3.75 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.07 0.00 117 K 9.41 3.64 0.00 1.91 1.93 0.00 1.85 0.00 0.00 1.72 0.00 0.00 3.02 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.34 1.42 7.81 118 G 8.07 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 0.00 119 S 7.72 4.38 0.00 3.91 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 0.00 120 R 9.50 4.33 0.00 1.66 1.93 0.00 3.28 0.00 0.00 3.08 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.78 0.00 121 I 7.32 4.91 1.83 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 1.21 0.67 0.90 0.00 0.00 122 E 9.26 4.89 0.00 1.97 1.64 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 2.15 2.23 0.00 123 I 8.87 5.11 1.94 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.72 1.11 0.00 0.00 124 E 8.84 5.08 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 2.20 2.27 0.00 125 A 8.33 5.19 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 0.00 126 V 9.01 4.71 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 0.82 0.00 0.00 0.94 0.00 0.00 127 A 8.86 5.23 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 I 8.20 4.83 1.86 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 1.08 0.96 0.92 0.00 0.00 129 Q 9.19 4.04 0.00 2.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.93 0.00 0.00 0.00 0.00 0.00 2.36 2.31 0.00 130 G 8.50 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 0.00 131 P 0.00 4.56 0.00 2.05 1.98 0.00 3.62 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.09 0.00 132 L 8.22 4.87 0.00 1.58 1.52 0.93 0.80 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 0.00 133 T 8.39 4.61 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 1.21 0.00 0.00 134 T 8.48 4.47 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 0.00 135 A 8.51 4.26 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