NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.1986 8.3144 121.7899 56.0373 33.4222 172.6915 2 E 5.0507 8.3679 122.6542 53.1707 31.2095 175.7950 3 T 4.1902 8.3932 118.4819 61.2362 72.0759 174.7832 4 A 4.0005 8.5888 123.5258 55.5108 18.3605 180.0427 5 A 4.0968 7.9653 118.4958 55.1288 18.4967 179.5515 6 A 3.9870 8.0888 119.4353 55.1797 18.4928 179.8223 7 K 4.0075 8.2338 118.1859 59.5792 32.3100 178.5475 8 F 4.0932 8.4367 121.0599 61.6042 39.2155 177.0555 9 E 4.0122 8.3805 117.9626 59.3651 29.0544 179.3507 10 R 3.8692 8.1517 118.0765 59.5532 30.3063 178.2358 11 Q 4.0442 8.2739 116.3747 57.9128 29.1388 176.2125 12 H 4.7132 7.8618 113.6374 53.5426 31.7536 172.8097 13 M 4.8817 7.8832 118.4831 53.7473 33.7862 176.3765 14 D 4.7938 9.1880 123.0895 52.7331 41.4793 175.7780 15 S 4.4828 8.4787 115.9566 59.6860 63.6246 175.7977 16 S 4.2991 8.0942 117.3399 60.4538 62.8586 174.4603 17 T 4.6168 7.5559 108.5444 59.5132 70.9193 174.4919 18 S 4.2074 8.4806 116.4667 60.8699 63.5700 174.8775 19 A 3.9699 7.4301 121.6908 50.3713 21.4430 174.7527 20 A 3.3474 7.3333 127.0248 52.2618 18.2616 177.7524 21 S 4.1585 8.6496 118.3039 60.2398 63.8223 171.5820 22 S 3.5849 7.4816 114.0773 54.6283 66.1988 174.1464 23 S 4.4134 8.4231 113.8848 60.7166 63.2860 175.6115 24 N 4.5395 8.1243 119.2000 55.2128 37.1890 176.3616 25 Y 3.9504 7.6076 121.5927 60.9563 38.8425 177.3413 26 C 4.1244 8.6406 117.4014 60.0848 38.6273 175.5210 27 N 4.3852 8.3797 117.5881 56.8320 38.1212 177.2719 28 Q 3.9491 7.8277 118.4563 59.2623 28.7947 178.7448 29 M 3.6551 8.1007 119.9452 58.4366 31.7909 178.7045 30 M 3.9857 7.9436 119.0826 58.0845 32.0008 178.8328 31 K 3.8867 7.5608 118.7770 59.7290 32.2907 178.8636 32 S 4.0416 8.0391 114.4017 61.8028 62.8405 175.8311 33 R 4.2428 8.0058 116.0349 55.8238 29.7374 176.1435 34 N 4.2980 7.9710 113.9951 54.5162 36.5858 175.0195 35 L 4.4045 8.1104 117.4419 55.6335 42.0154 177.9914 36 T 5.6583 7.6416 107.7758 60.5081 69.3001 175.0126 37 K 4.2469 8.3737 124.7223 59.8144 32.5980 177.5534 38 D 4.5230 8.0045 117.5335 56.1304 41.4394 176.5025 39 R 4.0566 7.3319 112.3034 54.1045 32.8318 174.7103 40 C 4.9392 8.6678 115.3978 55.7490 39.3561 173.7841 41 K 4.0531 8.4702 126.9245 56.2690 32.1246 175.1107 42 P 4.6255 0.0000 0.0000 65.1518 32.8028 176.2691 43 V 5.0591 7.6365 119.0086 61.3904 34.7107 173.8046 44 N 4.7928 9.1255 124.5973 52.7963 42.9521 172.8305 45 T 4.7906 8.0190 121.7470 61.6789 71.5135 172.9011 46 F 4.8022 8.8323 125.0570 55.7495 41.7077 174.7827 47 V 4.5364 8.8299 123.3160 61.2456 33.4509 175.4146 48 H 5.2928 8.6094 127.9503 53.7291 26.4623 172.9527 49 E 4.7941 7.7178 118.9035 53.2585 34.5697 176.1882 50 S 4.3210 8.4073 114.5043 58.2197 64.7877 174.5849 51 L 3.9328 8.6671 125.2724 58.8005 41.7128 179.3860 52 A 4.1686 8.0539 119.7481 55.2542 18.0596 179.1844 53 D 4.3006 7.9841 116.6263 57.6358 41.2643 178.8999 54 V 3.8057 7.8970 118.7666 66.0687 31.6747 178.1169 55 Q 3.9349 8.5861 118.0982 58.7494 28.5230 178.4743 56 A 4.0799 8.2828 121.6773 54.6671 18.3116 179.7022 57 V 3.5933 7.7633 117.0204 65.8585 31.3527 177.0302 58 C 3.7998 7.7902 114.9986 58.1795 39.8711 174.2498 59 S 4.7157 7.5388 114.2922 57.9601 63.7325 174.7009 60 Q 4.6335 7.5298 121.2271 56.3501 30.6943 176.9927 61 K 4.2053 7.9549 130.1361 56.6162 33.0920 175.8913 62 N 4.4817 8.7915 127.3728 53.7662 39.1705 174.2789 63 V 4.5762 8.4940 118.1063 59.2734 36.8328 174.6568 64 A 4.1746 8.3752 125.0397 52.2763 19.0331 178.5793 65 C 4.7098 8.7000 119.2478 56.1992 41.1049 175.4216 66 K 3.7294 8.9851 122.3675 59.4782 31.6581 178.0765 67 N 4.5286 8.0417 113.5044 53.0005 37.5320 175.8361 68 G 3.9266 8.2741 108.8132 45.5278 0.0000 174.1444 69 Q 4.2227 8.6355 119.5627 56.2229 29.2771 176.5156 70 T 4.5615 8.3040 107.8761 61.6940 69.3630 174.3236 71 N 5.0580 7.7757 119.5706 53.5880 38.4659 174.9846 72 C 5.3827 7.3673 115.7086 56.7863 41.5477 172.9044 73 Y 5.0428 8.6145 118.1165 56.5260 42.0775 173.9753 74 Q 5.0726 9.1763 126.2372 54.2842 31.1569 174.9048 75 S 4.5627 8.6177 121.5841 58.6227 63.2230 174.2912 76 Y 4.4221 8.9990 121.1925 60.6479 37.9604 176.6933 77 S 4.8306 7.8577 114.1717 56.9387 64.7850 173.8206 78 T 4.2359 8.0267 112.8736 62.0915 69.8417 173.3872 79 M 5.0641 8.9801 121.1920 53.4011 37.0303 174.6594 80 S 4.9852 9.2946 117.3106 58.4961 63.7696 173.1595 81 I 5.2360 8.7782 119.4985 59.8627 41.9805 174.0771 82 T 4.8967 9.0437 118.5437 62.0547 72.2560 173.1443 83 D 4.8417 9.2035 127.7333 53.9017 42.7019 174.8640 84 C 5.3975 9.3396 121.5602 55.3190 40.7649 172.7492 85 R 5.2950 8.7199 124.3421 54.0671 32.5928 174.3328 86 E 4.0261 9.2117 128.6737 56.3315 30.2719 176.8012 87 T 4.2584 8.3658 117.5255 60.8200 69.9160 175.0003 88 G 3.7075 8.4195 110.2814 47.6812 0.0000 174.9565 89 S 4.2712 7.8440 112.8069 59.1336 63.7986 174.0311 90 S 3.9664 7.6263 116.0395 58.7223 62.4327 173.2311 91 K 4.5776 8.3741 127.2211 54.1578 34.0978 175.2278 92 Y 4.2938 8.6877 125.2736 57.4421 39.1093 174.2413 93 P 3.2977 0.0000 0.0000 63.5868 32.1461 176.7576 94 N 4.5962 7.3992 117.8867 52.2672 36.8718 172.8853 95 C 4.4260 8.0882 117.7833 56.3847 39.7128 173.0843 96 A 5.2241 8.5206 125.4352 50.4161 22.0315 174.5339 97 Y 5.0535 8.9420 117.7098 56.1120 42.4792 174.8959 98 K 4.3388 9.2992 125.7363 56.2491 33.8046 175.4951 99 T 4.8431 8.6019 124.3735 62.8859 69.7424 174.3482 100 T 4.5135 8.8286 123.9902 61.5303 71.2051 173.3615 101 Q 4.6347 8.7141 128.1043 56.1537 30.1839 174.6042 102 A 4.6079 8.6103 125.6919 51.3641 23.6855 174.6411 103 N 5.4483 8.6783 116.1615 51.7449 40.8510 174.4496 104 K 4.7543 8.8132 122.2640 54.9944 37.8129 175.2042 105 H 4.9172 9.4224 119.4618 55.6172 30.0247 175.0833 106 I 4.7280 8.4995 116.1584 59.7500 40.3565 174.6513 107 I 4.8202 8.3066 124.9182 59.8110 39.7336 174.9645 108 V 4.7736 8.3988 120.1876 59.3157 35.1820 174.8758 109 A 4.9630 8.6798 125.3730 51.1930 20.7162 175.7186 110 C 5.1075 8.6489 117.4841 55.3875 38.2277 173.2277 111 E 4.6520 8.5884 119.6089 55.9082 34.4765 175.0482 112 G 4.1911 9.6593 107.1485 45.0073 0.0000 172.5759 113 N 4.8162 8.1060 115.8179 50.7426 40.1955 172.0260 114 P 4.4051 0.0000 0.0000 62.6220 32.1952 176.1221 115 Y 4.7749 8.3014 121.5125 57.0648 38.3848 174.4684 116 V 4.4451 7.9972 118.5633 58.1398 36.6355 173.3234 117 P 4.3797 0.0000 0.0000 62.8963 30.8947 176.9372 118 V 4.3644 8.5540 116.2146 61.2663 34.2122 175.4432 119 H 5.2369 7.8971 115.9733 53.9709 33.6011 172.1810 120 F 4.6955 8.9009 123.2796 57.2613 39.5388 174.6512 121 D 4.5736 8.7858 127.1251 56.3439 41.8997 175.7955 122 A 4.6338 6.6277 117.2295 51.3889 22.5173 174.8172 123 S 5.1973 8.7630 112.9923 56.7894 66.4311 174.6751 124 V 4.1500 8.9619 114.5496 61.7700 32.6551 175.2812 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 4.20 0.00 1.72 1.83 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.33 1.50 7.81 2 E 8.37 5.05 0.00 2.16 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 2.09 2.38 0.00 3 T 8.39 4.19 4.25 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 1.22 0.00 0.00 4 A 8.59 4.00 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 0.00 0.00 5 A 7.97 4.10 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 0.00 0.00 6 A 8.09 3.99 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 8.23 4.01 0.00 2.00 2.04 0.00 1.68 0.00 0.00 1.61 0.00 0.00 2.99 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.46 7.81 8 F 8.44 4.09 0.00 3.12 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 9 E 8.38 4.01 0.00 2.32 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 2.48 2.68 0.00 10 R 8.15 3.87 0.00 1.77 2.11 0.00 3.34 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.66 0.00 11 Q 8.27 4.04 0.00 1.65 1.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.49 0.00 0.00 0.00 0.00 0.00 2.27 2.49 0.00 12 H 7.86 4.71 0.00 1.89 2.60 0.00 5.60 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 M 7.88 4.88 0.00 1.97 2.13 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.64 0.00 14 D 9.19 4.79 0.00 2.72 2.52 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 15 S 8.48 4.48 0.00 3.93 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 16 S 8.09 4.30 0.00 4.02 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 17 T 7.56 4.62 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 1.21 0.00 0.00 18 S 8.48 4.21 0.00 3.98 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 19 A 7.43 3.97 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 20 A 7.33 3.35 0.16 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 0.00 0.00 21 S 8.65 4.16 0.00 3.79 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 7.48 3.58 0.00 3.98 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 23 S 8.42 4.41 0.00 4.01 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 24 N 8.12 4.54 0.00 2.95 3.13 0.00 0.00 5.90 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 25 Y 7.61 3.95 0.00 3.16 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 26 C 8.64 4.12 0.00 3.14 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 27 N 8.38 4.39 0.00 2.91 2.94 0.00 0.00 7.07 7.74 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 28 Q 7.83 3.95 0.00 2.08 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.82 0.00 0.00 0.00 0.00 0.00 2.32 2.43 0.00 29 M 8.10 3.66 0.00 0.69 1.14 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.48 0.00 30 M 7.94 3.99 0.00 1.69 1.81 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 2.32 0.00 31 K 7.56 3.89 0.00 2.04 1.85 0.00 1.63 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.41 1.46 7.81 32 S 8.04 4.04 0.00 3.68 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 33 R 8.01 4.24 0.00 1.91 2.09 0.00 3.60 0.00 0.00 3.17 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.81 0.00 34 N 7.97 4.30 0.00 2.89 2.94 0.00 0.00 6.90 7.17 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 35 L 8.11 4.40 0.00 1.76 1.66 0.84 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 36 T 7.64 5.66 4.39 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 1.42 0.00 0.00 37 K 8.37 4.25 0.00 1.76 1.92 0.00 1.70 0.00 0.00 1.73 0.00 0.00 3.06 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.57 1.55 7.81 38 D 8.00 4.52 0.00 2.71 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 39 R 7.33 4.06 0.00 1.76 1.78 0.00 2.93 0.00 0.00 3.29 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.62 0.00 40 C 8.67 4.94 0.00 3.06 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 8.47 4.05 0.00 1.91 1.83 0.00 1.78 0.00 0.00 1.69 0.00 0.00 3.29 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.59 1.42 7.81 42 P 0.00 4.63 0.00 2.19 2.31 0.00 3.76 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 2.11 1.99 0.00 43 V 7.64 5.06 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 0.98 0.00 0.00 44 N 9.13 4.79 0.00 2.71 2.33 0.00 0.00 6.73 6.79 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 45 T 8.02 4.79 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 0.80 0.00 0.00 46 F 8.83 4.80 0.00 3.00 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 8.83 4.54 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 1.12 0.00 0.00 1.00 0.00 0.00 48 H 8.61 5.29 0.00 3.07 3.49 0.00 5.62 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 7.72 4.79 0.00 1.95 1.86 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 2.26 2.28 0.00 50 S 8.41 4.32 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 8.67 3.93 0.00 1.82 1.76 1.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 52 A 8.05 4.17 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 7.98 4.30 0.00 2.86 2.79 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 54 V 7.90 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 1.23 0.00 0.00 1.04 0.00 0.00 55 Q 8.59 3.93 0.00 2.22 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 2.35 2.67 0.00 56 A 8.28 4.08 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.76 3.59 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 1.00 0.00 0.00 0.94 0.00 0.00 58 C 7.79 3.80 0.00 2.82 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 7.54 4.72 0.00 3.96 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 60 Q 7.53 4.63 0.00 1.87 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.93 0.00 0.00 0.00 0.00 0.00 2.46 2.50 0.00 61 K 7.95 4.21 0.00 1.64 1.60 0.00 1.68 0.00 0.00 1.54 0.00 0.00 2.76 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.38 1.43 7.81 62 N 8.79 4.48 0.00 2.83 2.66 0.00 0.00 7.00 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 8.49 4.58 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 0.66 0.00 0.00 0.79 0.00 0.00 64 A 8.38 4.17 1.18 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 0.00 0.00 65 C 8.70 4.71 0.00 3.16 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 66 K 8.99 3.73 0.00 1.69 1.86 0.00 1.80 0.00 0.00 1.75 0.00 0.00 3.02 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.46 7.81 67 N 8.04 4.53 0.00 2.79 2.89 0.00 0.00 6.25 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 8.27 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 Q 8.64 4.22 0.00 2.17 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.08 6.70 0.00 0.00 0.00 0.00 0.00 2.43 2.44 0.00 70 T 8.30 4.56 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 1.18 0.00 0.00 71 N 7.78 5.06 0.00 3.13 3.19 0.00 0.00 6.07 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 7.37 5.38 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 73 Y 8.61 5.04 0.00 2.84 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 74 Q 9.18 5.07 0.00 1.98 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 7.00 0.00 0.00 0.00 0.00 0.00 2.21 2.25 0.00 75 S 8.62 4.56 0.00 3.95 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 76 Y 9.00 4.42 0.00 3.06 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 S 7.86 4.83 0.00 3.92 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 78 T 8.03 4.24 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 1.06 0.00 0.00 79 M 8.98 5.06 0.00 1.96 1.99 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 2.54 2.50 0.00 80 S 9.29 4.99 0.00 3.92 3.97 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 81 I 8.78 5.24 1.92 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 1.43 0.57 0.99 0.00 0.00 82 T 9.04 4.90 4.40 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 1.24 0.00 0.00 83 D 9.20 4.84 0.00 2.63 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 84 C 9.34 5.40 0.00 2.87 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 85 R 8.72 5.30 0.00 1.96 1.81 0.00 3.12 0.00 0.00 3.13 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.58 0.00 86 E 9.21 4.03 0.00 1.95 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 2.06 1.57 0.00 87 T 8.37 4.26 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 1.18 0.00 0.00 88 G 8.42 3.71 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 0.00 0.00 0.00 89 S 7.84 4.27 0.00 3.97 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 90 S 7.63 3.97 0.00 3.85 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 91 K 8.37 4.58 0.00 1.79 1.70 0.00 1.77 0.00 0.00 1.75 0.00 0.00 2.86 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.57 1.33 7.81 92 Y 8.69 4.29 0.00 2.93 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 1.82 1.34 0.00 3.68 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.76 0.00 94 N 7.40 4.60 0.00 2.73 2.78 0.00 0.00 6.99 6.95 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 95 C 8.09 4.43 0.00 3.16 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 96 A 8.52 5.22 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 8.94 5.05 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 98 K 9.30 4.34 0.00 1.85 1.73 0.00 1.65 0.00 0.00 1.67 0.00 0.00 2.87 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.47 1.46 7.81 99 T 8.60 4.84 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 1.33 0.00 0.00 100 T 8.83 4.51 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 8.71 4.63 0.00 1.97 1.96 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 2.27 2.39 0.00 102 A 8.61 4.61 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 8.68 5.45 0.00 2.58 2.74 0.00 0.00 6.68 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 8.81 4.75 0.00 1.73 1.89 0.00 1.70 0.00 0.00 1.70 0.00 0.00 2.90 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.39 1.45 7.81 105 H 9.42 4.92 0.00 3.04 3.33 0.00 5.60 0.00 0.00 0.00 0.00 6.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 I 8.50 4.73 1.94 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.66 1.16 0.00 0.00 107 I 8.31 4.82 1.67 0.00 0.00 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 1.13 0.76 0.81 0.00 0.00 108 V 8.40 4.77 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 0.72 0.00 0.00 0.90 0.00 0.00 109 A 8.68 4.96 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 0.00 110 C 8.65 5.11 0.00 2.00 1.76 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 0.00 111 E 8.59 4.65 0.00 1.81 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 2.26 2.21 0.00 112 G 9.66 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 0.00 113 N 8.11 4.82 0.00 2.64 2.71 0.00 0.00 6.94 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 4.41 0.00 2.23 2.05 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 1.98 1.95 0.00 115 Y 8.30 4.77 0.00 2.82 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 0.00 116 V 8.00 4.45 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 0.71 0.00 0.00 0.90 0.00 0.00 117 P 0.00 4.38 0.00 0.49 1.14 0.00 3.35 0.00 0.00 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.80 0.00 118 V 8.55 4.36 1.91 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 0.61 0.00 0.00 0.80 0.00 0.00 119 H 7.90 5.24 0.00 3.04 3.15 0.00 5.60 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 F 8.90 4.70 0.00 2.64 2.72 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 0.00 121 D 8.79 4.57 0.00 2.54 2.56 0.00 0.00 0.00 0.00 0.00 0.00 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 6.63 4.63 1.15 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 0.00 123 S 8.76 5.20 0.00 3.95 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 0.00 124 V 8.96 4.15 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 0.65 0.00 0.00 0.97 0.00 0.00