NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 D 4.5559 8.2185 120.1945 53.8007 41.7422 175.5816 3 A 3.9880 8.5087 129.9812 54.7049 18.1698 177.5626 4 K 3.9910 8.4777 117.5716 59.5337 32.8036 177.3438 5 A 4.2103 8.6897 121.4032 55.0610 18.2293 179.8810 6 G 3.6420 8.3761 104.5024 47.7784 0.0000 175.4041 7 E 2.5400 7.4739 120.1710 58.7489 29.7115 178.5331 8 A 4.0516 7.6678 120.7015 55.0554 18.4539 179.7466 9 V 3.5482 7.6895 116.3469 66.1068 31.6284 177.8729 10 F 4.1922 8.2671 120.3582 60.8777 38.8728 177.1221 11 K 3.8343 7.5023 117.4840 59.4574 32.0478 178.8280 12 Q 3.9984 8.0172 118.2558 59.1888 28.6595 178.6163 13 C 3.8745 7.6259 117.0324 62.6694 27.9032 175.2836 14 M 4.8332 7.1370 119.4455 56.2745 31.4934 177.8415 15 T 3.8984 7.2386 116.6289 66.1632 68.8461 174.3790 16 C 4.6910 7.7561 114.9082 59.1307 30.8224 173.1132 17 H 5.1683 8.0955 116.0679 53.7891 31.9645 172.5791 18 R 5.0766 8.0758 118.6720 54.0810 34.1229 176.8763 19 A 4.0530 8.8960 121.8525 55.2122 18.4384 179.0240 20 D 5.1193 8.0931 111.2287 53.7375 42.0321 175.8385 21 K 4.7247 7.5666 117.0635 54.9238 35.6551 175.7081 22 N 4.8440 8.5800 117.7051 53.8916 40.1982 174.2336 23 M 4.8012 8.2818 123.6602 54.5506 33.0640 177.2673 24 V 3.6777 8.9606 125.7093 66.2737 31.6607 175.7699 25 G 3.7511 7.8875 108.1699 42.2802 0.0000 170.7421 26 P 4.1289 0.0000 0.0000 61.5034 31.8238 176.2237 27 A 4.3260 8.6002 123.2952 53.2425 18.7711 177.8419 28 L 4.4550 8.5779 119.9891 54.4255 42.9976 176.7477 29 A 4.0841 7.9698 123.4788 53.3899 18.5088 178.0098 30 G 3.9923 8.8745 111.3939 45.2000 0.0000 174.7309 31 V 3.7228 7.9170 120.5508 64.1846 31.6517 176.8013 32 V 4.0474 7.5749 120.7665 63.9149 31.5587 175.7626 33 G 3.9250 9.2867 116.0587 45.3335 0.0000 172.5096 34 R 4.6573 7.7242 119.9100 53.6464 32.9084 175.2809 35 K 4.1935 8.6281 124.8447 56.6756 32.8057 176.2764 36 A 3.8013 8.3615 129.5652 52.7818 19.5220 177.8860 37 G 2.2213 8.7466 108.4929 46.1604 0.0000 174.0394 38 T 4.6065 7.6213 105.0000 60.4299 69.8721 173.4011 39 A 4.0632 8.1926 125.9592 52.6319 18.7488 177.8795 40 A 4.1038 8.5551 126.5326 53.5866 18.9745 177.9501 41 G 3.9986 9.0757 110.1102 45.1603 0.0000 172.9930 42 F 4.3583 7.6302 121.9537 56.5516 40.5475 174.9318 43 T 4.1623 7.0259 122.5024 60.8428 66.9527 173.7549 44 Y 4.6380 8.4618 126.9533 56.9820 39.2694 176.4610 45 S 4.4278 8.6902 116.8953 57.8875 65.1121 173.3775 46 P 4.3041 0.0000 0.0000 66.0016 31.2211 178.6977 47 L 4.0189 7.9566 118.3120 58.2899 41.7942 178.4117 48 N 4.4972 8.4886 117.0918 56.7244 38.9390 176.3977 49 H 4.0604 8.7866 120.1393 59.5000 30.1349 177.0908 50 N 4.3869 8.8142 118.5406 56.2834 38.3122 177.6801 51 S 4.2919 8.0820 116.4264 61.5366 62.9460 176.8937 52 G 3.8685 7.3679 108.3706 47.3744 0.0000 175.6085 53 E 3.9893 7.9632 119.4000 58.2285 29.4978 178.2220 54 A 4.4754 7.5034 118.8213 51.8692 19.0330 177.6508 55 G 4.0297 7.8123 106.1979 44.7674 0.0000 173.7322 56 L 3.4999 8.0329 123.3426 54.5299 42.7264 175.9115 57 V 4.3806 7.8219 125.6373 60.2536 34.2128 176.0790 58 W 5.0744 8.4862 129.3260 55.9280 27.0359 175.9464 59 T 4.3392 7.7052 112.6627 60.9404 70.0116 176.1711 60 A 4.0070 8.6477 123.8506 55.5666 18.1209 179.4480 61 D 4.5415 8.0893 114.8723 56.3326 41.4106 177.6988 62 N 4.8321 7.7443 116.4869 55.6620 39.2101 177.3867 63 I 3.4577 8.0858 121.3771 64.0371 36.8968 178.4964 64 V 3.5612 7.5999 118.4508 65.6536 31.7826 176.1227 65 P 4.3790 0.0000 0.0000 65.7934 31.2125 177.3979 66 Y 3.7989 7.2801 118.8572 60.6291 38.5234 178.4143 67 L 3.6418 7.8821 118.9532 57.1408 41.3879 179.1506 68 A 4.2192 7.5050 120.9313 53.2801 19.6403 177.1827 69 D 4.4523 7.5824 112.2751 51.6643 43.8429 173.8590 70 P 4.1312 0.0000 0.0000 65.2915 31.6760 177.4969 71 N 4.4829 8.1896 114.3288 56.3195 38.5361 177.2629 72 A 4.0794 8.2831 121.9651 54.9374 18.3876 179.4566 73 F 4.1036 8.6178 119.3192 61.6119 39.5817 177.4232 74 L 4.1178 8.4509 118.6178 57.8211 41.3483 179.7240 75 K 4.0515 8.3040 118.5351 59.2047 31.8798 179.3769 76 K 3.8688 8.2553 120.0701 59.2645 32.0117 178.4477 77 F 3.8278 8.0736 121.0762 61.4038 39.1690 177.1367 78 L 3.8944 8.1075 118.3254 58.0696 41.4434 179.6767 79 T 3.8930 8.1084 115.9011 66.7670 68.1892 176.6247 80 E 3.9774 8.1303 119.3700 58.7171 29.4759 178.0597 81 K 3.9772 7.1925 116.1860 56.2273 32.0718 177.1387 82 G 3.9010 7.9601 106.9152 46.6811 0.0000 174.2894 83 K 4.5731 8.1007 117.8086 55.2174 33.2495 178.6561 84 A 3.9737 8.1986 124.3875 55.2481 18.4257 179.8223 85 D 4.5807 8.0751 112.9198 54.9871 39.6357 176.6699 86 Q 4.4138 8.2213 118.2576 56.0511 29.3167 175.6493 87 A 4.6465 7.7376 120.2786 51.6355 19.3254 177.3438 88 V 3.6542 7.5220 117.7206 64.7815 32.2446 176.6095 89 G 3.9022 9.3301 112.5470 44.5693 0.0000 172.2086 90 V 4.6001 7.6985 110.2542 59.4114 35.5526 175.3557 91 T 4.4049 9.0180 112.5489 61.0037 69.5851 174.5006 92 K 4.1801 8.5559 121.3421 57.6399 33.3192 177.3011 93 M 3.2457 8.6415 120.6053 56.7893 29.3790 177.6266 94 T 4.1900 7.5546 114.0193 63.4022 69.8917 174.6617 95 F 4.9561 8.5807 126.9012 56.1509 42.5636 173.8301 96 K 4.2892 7.4133 125.1716 54.1418 34.9795 175.3794 97 L 4.2560 8.2401 124.9700 52.9189 43.2444 176.8171 98 A 3.8245 8.4996 130.1231 54.8593 18.8661 177.5315 99 N 4.2791 8.0393 115.0678 53.8171 39.6501 174.9251 100 E 3.8874 8.7442 129.0038 59.4818 29.9066 178.3219 101 Q 3.9548 8.0993 119.1288 59.2978 29.1023 177.9785 102 Q 4.0391 8.8552 119.5385 58.9193 28.7081 179.0751 103 R 3.9255 7.9323 119.0948 59.1872 30.1518 179.1951 104 K 3.9826 8.3239 118.5393 59.6064 32.0796 179.2235 105 D 4.3861 8.5241 119.7397 57.4000 40.7179 179.2899 106 V 3.7904 8.2154 120.0291 64.6881 31.2285 178.6481 107 V 3.5539 7.9945 118.9349 65.6917 31.1321 177.7871 108 A 3.9893 7.8825 119.7657 55.3151 18.5074 178.6141 109 Y 4.0521 8.1135 117.9789 60.8533 38.8576 178.3080 110 L 3.7022 8.3024 119.9508 57.6044 41.4418 179.3315 111 A 4.0356 7.5135 120.0405 54.6049 17.0621 178.8902 112 T 3.9792 7.4987 107.1411 62.9270 68.9269 176.4152 113 L 3.8900 7.3675 121.5982 56.5911 42.1227 176.8539 114 K 4.0559 7.2507 122.6112 56.5483 32.4001 175.3121 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 8.22 4.56 0.00 2.70 2.83 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 3 A 8.51 3.99 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 4 K 8.48 3.99 0.00 1.75 1.90 0.00 1.78 0.00 0.00 1.73 0.00 0.00 3.04 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.49 1.54 7.81 5 A 8.69 4.21 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 6 G 8.38 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 0.00 0.00 0.00 7 E 7.47 2.54 0.00 1.60 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 2.12 1.97 0.00 8 A 7.67 4.05 1.31 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 0.00 0.00 0.00 9 V 7.69 3.55 2.23 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 1.06 0.00 0.00 0.93 0.00 0.00 10 F 8.27 4.19 0.00 3.07 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 11 K 7.50 3.83 0.00 1.78 1.80 0.00 1.75 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.60 1.59 7.81 12 Q 8.02 4.00 0.00 2.20 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.79 0.00 0.00 0.00 0.00 0.00 2.34 2.38 0.00 13 C 7.63 3.87 0.00 2.22 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 14 M 7.14 4.83 0.00 1.84 2.06 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.30 0.00 15 T 7.24 3.90 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 1.06 0.00 0.00 16 C 7.76 4.69 0.00 2.68 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 17 H 8.10 5.17 0.00 3.03 3.07 0.00 5.55 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 R 8.08 5.08 0.00 2.02 1.84 0.00 3.33 0.00 0.00 3.38 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.54 0.00 19 A 8.90 4.05 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 20 D 8.09 5.12 0.00 2.66 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 21 K 7.57 4.72 0.00 1.82 1.74 0.00 1.59 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.32 1.47 7.81 22 N 8.58 4.84 0.00 2.83 3.01 0.00 0.00 6.72 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 23 M 8.28 4.80 0.00 1.90 1.49 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 2.51 2.76 0.00 24 V 8.96 3.68 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 0.76 0.00 0.00 0.91 0.00 0.00 25 G 7.89 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 26 P 0.00 4.13 0.00 1.97 0.92 0.00 3.36 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.65 0.00 27 A 8.60 4.33 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 28 L 8.58 4.46 0.00 1.81 1.68 0.83 0.28 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 29 A 7.97 4.08 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 30 G 8.87 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 31 V 7.92 3.72 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 0.65 0.00 0.00 0.87 0.00 0.00 32 V 7.57 4.05 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 0.80 0.00 0.00 0.89 0.00 0.00 33 G 9.29 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 0.00 0.00 0.00 34 R 7.72 4.66 0.00 2.10 1.97 0.00 3.14 0.00 0.00 3.12 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.55 0.00 35 K 8.63 4.19 0.00 1.72 1.65 0.00 1.76 0.00 0.00 1.64 0.00 0.00 2.85 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.27 1.41 7.81 36 A 8.36 3.80 0.56 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 0.00 0.00 37 G 8.75 2.22 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 0.00 38 T 7.62 4.61 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 1.21 0.00 0.00 39 A 8.19 4.06 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 40 A 8.56 4.10 1.31 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 0.00 0.00 0.00 41 G 9.08 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 42 F 7.63 4.36 0.00 3.05 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 43 T 7.03 4.16 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 1.05 0.00 0.00 44 Y 8.46 4.64 0.00 3.15 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 45 S 8.69 4.43 0.00 4.16 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 46 P 0.00 4.30 0.00 2.24 2.21 0.00 3.67 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 2.16 2.20 0.00 47 L 7.96 4.02 0.00 1.85 1.79 1.01 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 48 N 8.49 4.50 0.00 3.12 3.11 0.00 0.00 6.90 7.34 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 49 H 8.79 4.06 0.00 3.37 3.59 0.00 5.84 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 N 8.81 4.39 0.00 2.83 3.00 0.00 0.00 7.12 7.20 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 51 S 8.08 4.29 0.00 3.94 3.68 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 52 G 7.37 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 53 E 7.96 3.99 0.00 2.01 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 2.21 2.31 0.00 54 A 7.50 4.48 1.46 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 0.00 0.00 55 G 7.81 4.03 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 0.00 0.00 0.00 56 L 8.03 3.50 0.00 0.27 0.82 0.07 -0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 57 V 7.82 4.38 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 0.90 0.00 0.00 0.89 0.00 0.00 58 W 8.49 5.07 0.00 3.47 2.90 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 59 T 7.71 4.34 4.29 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 1.23 0.00 0.00 60 A 8.65 4.01 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 61 D 8.09 4.54 0.00 2.73 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 62 N 7.74 4.83 0.00 3.16 3.09 0.00 0.00 6.85 6.89 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 63 I 8.09 3.46 1.81 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 0.94 1.14 0.68 0.00 0.00 64 V 7.60 3.56 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 0.86 0.00 0.00 1.01 0.00 0.00 65 P 0.00 4.38 0.00 2.53 2.41 0.00 3.80 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.24 0.00 66 Y 7.28 3.80 0.00 2.25 2.83 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 67 L 7.88 3.64 0.00 1.79 1.62 0.92 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 68 A 7.50 4.22 1.31 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 0.00 0.00 0.00 69 D 7.58 4.45 0.00 2.62 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 70 P 0.00 4.13 0.00 2.19 2.04 0.00 3.51 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.45 0.00 71 N 8.19 4.48 0.00 2.79 2.93 0.00 0.00 6.98 7.34 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 72 A 8.28 4.08 1.48 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 0.00 0.00 73 F 8.62 4.10 0.00 3.31 3.50 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 0.00 74 L 8.45 4.12 0.00 1.96 1.87 1.26 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 75 K 8.30 4.05 0.00 1.91 1.89 0.00 1.80 0.00 0.00 1.61 0.00 0.00 3.01 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.69 1.62 7.81 76 K 8.26 3.87 0.00 1.87 1.87 0.00 1.65 0.00 0.00 1.56 0.00 0.00 3.11 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.36 1.41 7.81 77 F 8.07 3.83 0.00 2.63 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 78 L 8.11 3.89 0.00 1.77 1.90 1.02 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 79 T 8.11 3.89 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 1.18 0.00 0.00 80 E 8.13 3.98 0.00 1.75 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 2.32 0.00 81 K 7.19 3.98 0.00 1.62 1.66 0.00 1.61 0.00 0.00 1.43 0.00 0.00 2.29 0.00 0.00 2.82 0.00 0.00 0.00 0.00 0.82 1.00 7.81 82 G 7.96 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 83 K 8.10 4.57 0.00 1.84 1.74 0.00 1.63 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.31 1.45 7.81 84 A 8.20 3.97 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 85 D 8.08 4.58 0.00 2.80 2.80 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 86 Q 8.22 4.41 0.00 2.18 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.14 0.00 0.00 0.00 0.00 0.00 2.32 2.28 0.00 87 A 7.74 4.65 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 88 V 7.52 3.65 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 0.83 0.00 0.00 0.95 0.00 0.00 89 G 9.33 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 90 V 7.70 4.60 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 0.84 0.00 0.00 0.98 0.00 0.00 91 T 9.02 4.40 4.43 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 1.47 0.00 0.00 92 K 8.56 4.18 0.00 1.92 1.86 0.00 1.97 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.50 1.56 7.81 93 M 8.64 3.25 0.00 2.11 2.10 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.52 0.00 94 T 7.55 4.19 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 1.24 0.00 0.00 95 F 8.58 4.96 0.00 2.82 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 96 K 7.41 4.29 0.00 1.43 1.55 0.00 1.70 0.00 0.00 1.55 0.00 0.00 2.75 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.15 1.22 7.81 97 L 8.24 4.26 0.00 1.65 1.44 1.01 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 98 A 8.50 3.82 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 99 N 8.04 4.28 0.00 2.75 2.84 0.00 0.00 6.83 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 0.00 100 E 8.74 3.89 0.00 2.07 1.93 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 2.38 2.37 0.00 101 Q 8.10 3.95 0.00 2.20 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.67 0.00 0.00 0.00 0.00 0.00 2.43 2.69 0.00 102 Q 8.86 4.04 0.00 2.27 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.58 0.00 0.00 0.00 0.00 0.00 2.38 2.52 0.00 103 R 7.93 3.93 0.00 2.03 1.96 0.00 3.33 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.85 0.00 104 K 8.32 3.98 0.00 1.95 1.87 0.00 1.68 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.47 1.67 7.81 105 D 8.52 4.39 0.00 2.72 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 0.00 106 V 8.22 3.79 2.22 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 1.03 0.00 0.00 1.20 0.00 0.00 107 V 7.99 3.55 2.28 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 1.00 0.00 0.00 0.95 0.00 0.00 108 A 7.88 3.99 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 0.00 109 Y 8.11 4.05 0.00 3.22 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 0.00 110 L 8.30 3.70 0.00 1.81 1.60 0.86 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 111 A 7.51 4.04 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 0.00 112 T 7.50 3.98 4.03 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 1.14 0.00 0.00 113 L 7.37 3.89 0.00 1.58 1.60 0.62 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 114 K 7.25 4.06 0.00 1.57 1.54 0.00 1.81 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.32 1.34 7.81