NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 M 4.5117 8.5404 119.7405 55.0577 33.0012 175.1644 5 A 4.0660 8.5584 129.2242 51.7676 19.1854 173.0134 6 E 4.4769 8.5413 118.9722 54.8990 31.8327 175.2816 7 S 4.4418 8.3650 115.5642 58.4616 63.1125 174.0190 8 K 4.3291 8.7724 125.3063 56.2843 33.2854 176.0749 9 V 4.3415 7.6232 121.8176 61.7673 30.7378 175.5750 10 L 4.2658 8.7787 129.3336 57.0646 42.4590 178.2728 11 V 4.5436 7.4959 118.0163 60.4975 34.8027 175.1385 12 K 4.4848 8.9354 127.0107 57.2427 33.2423 176.3763 13 G 4.1374 8.9734 109.0686 45.6305 0.0000 172.8725 14 T 4.8588 8.4880 110.7800 59.0922 72.2059 172.1838 15 P 4.3678 0.0000 0.0000 65.1841 31.2806 177.5140 16 F 4.5998 8.1594 117.8137 58.2364 40.3371 174.9323 17 N 4.9423 8.1973 118.2640 50.9455 41.0620 173.9036 18 K 4.2242 8.2618 122.0820 55.4785 32.8797 175.2075 19 P 4.5769 0.0000 0.0000 62.7145 32.8840 175.3758 20 V 4.2477 8.4147 120.6286 61.3960 33.1313 174.3410 21 I 4.9654 8.2285 128.4621 59.1935 39.4753 175.3541 22 K 4.0377 8.8746 128.8302 57.5755 32.6399 177.0205 23 G 4.0252 9.2776 112.7078 44.9957 0.0000 172.0851 24 K 4.6119 8.0033 116.4704 53.8432 35.1414 177.4090 25 L 2.7717 8.2052 123.7784 57.8512 41.9896 178.7922 26 E 4.0567 7.9174 113.8676 58.0626 29.7029 176.6918 27 N 4.8874 7.3395 116.3037 52.3923 40.0465 173.8866 28 N 3.9039 8.6943 114.3256 54.7075 36.7760 173.9961 29 Y 3.7824 8.3233 111.0410 59.4264 36.1275 171.1157 30 D 4.5173 8.0287 115.0071 55.3609 39.1247 174.4134 31 M 4.5903 7.8667 118.8586 54.6630 33.0751 176.9316 32 S 4.5787 9.3769 117.4404 57.8440 65.7502 175.5928 33 Q 4.0474 8.4542 120.3076 59.1947 28.4812 178.5778 34 D 4.4116 8.0937 119.4933 57.2724 40.8694 178.5059 35 E 4.0554 8.3100 119.2301 59.5152 29.5343 179.5715 36 V 3.7011 7.9904 118.2367 66.0470 31.5775 178.3150 37 S 4.1652 8.2747 114.9906 61.5481 62.6819 176.4140 38 L 4.0204 8.0806 123.0736 57.8552 41.9230 178.6102 39 L 4.0245 8.0063 120.4013 58.4422 42.0192 179.1626 40 L 4.0802 8.0921 118.7235 57.4759 41.5882 179.2983 41 F 4.1390 8.3577 120.9275 61.3666 39.3828 177.2716 42 L 4.0786 8.4063 118.7339 57.4025 41.3412 179.4835 43 K 3.9374 7.9047 119.4850 59.8486 31.9722 179.0207 44 T 3.8232 7.9555 115.1498 66.4409 68.5057 174.9590 45 H 4.5591 7.9706 117.1252 57.7886 29.6875 176.3721 46 G 3.9649 8.4137 106.7524 47.0448 0.0000 176.0065 47 G 4.0343 7.5460 109.1483 44.7462 0.0000 175.1861 48 K 4.4184 8.4455 122.2265 54.3190 32.0766 174.8853 49 I 4.5106 7.4170 124.7804 57.4732 38.2018 172.7868 50 P 4.3250 0.0000 0.0000 62.1620 32.3146 177.9313 51 L 3.8311 8.7737 122.9636 58.8948 41.8174 179.3184 52 Y 4.2466 7.4358 116.6145 59.9053 37.9005 178.1777 53 R 4.1483 7.6896 120.0942 58.8209 29.9196 178.7720 54 I 3.7212 7.5955 118.8037 63.8564 37.3156 177.7049 55 K 4.0669 7.7916 119.6999 59.0712 32.0725 177.9452 56 N 4.7202 7.9836 115.4781 54.2388 39.1645 175.7964 57 E 4.6994 8.0858 116.8147 56.2108 30.3315 176.8645 58 T 3.3688 7.6877 110.4192 61.7119 69.3316 175.2174 59 G 3.8390 7.9733 109.1723 46.4834 0.0000 173.0959 60 L 4.6893 7.0505 117.5082 52.1047 43.9166 177.0621 61 K 4.0695 8.5116 122.1980 59.5646 33.0736 177.4372 62 D 4.7645 7.6206 116.7520 50.9261 41.9717 172.8744 63 P 4.1945 0.0000 0.0000 65.6927 31.8168 177.5810 64 E 3.8810 8.1173 117.2863 59.3663 29.6114 178.7750 65 S 4.0505 8.1698 112.8124 61.3006 62.4852 176.2513 66 V 3.5624 7.6674 120.5431 65.8345 31.2609 177.5931 67 L 3.9251 8.2310 120.4985 57.9265 41.8737 178.6948 68 K 3.7955 8.0199 119.5920 59.6407 31.9836 178.4576 69 N 3.8432 7.8794 116.3737 56.1694 38.4337 177.3762 70 L 3.9978 7.6907 120.2874 58.0463 41.7185 179.6098 71 M 4.3354 8.0551 120.1218 58.0240 31.4398 178.5875 72 D 4.3271 8.0936 119.1325 57.3706 40.9189 178.2301 73 Y 4.4943 7.8151 117.1833 59.2018 37.4043 177.4200 74 G 3.9689 7.7235 107.6275 45.4268 0.0000 173.9323 75 F 5.2160 8.2816 117.7390 57.6689 40.2705 175.3654 76 A 5.2732 7.7933 119.4056 50.7099 22.6724 174.9983 77 L 4.7995 9.1969 119.2339 52.9683 46.2736 175.2746 78 E 5.0005 8.7281 121.3220 54.7474 32.2930 175.1316 79 D 4.5161 9.7633 125.1923 52.1674 44.2025 174.2958 80 K 4.5103 9.1339 128.2149 56.5172 32.3996 175.0320 81 E 4.8486 8.6695 127.8900 54.2427 31.7260 176.0816 82 R 3.6062 7.8365 113.9687 59.9303 30.5235 176.6519 83 L 4.4733 8.5947 117.0230 53.8416 42.3036 176.7131 84 G 3.9787 7.3592 106.8517 43.5333 0.0000 172.9718 85 E 4.5444 8.6240 119.4069 56.2313 30.5161 176.3271 86 K 4.6121 8.9940 124.5971 54.6234 35.7519 174.6093 87 I 4.9604 8.1353 125.7983 59.8207 39.9027 175.5270 88 V 4.6068 8.6500 117.8202 59.6402 36.3343 174.5674 89 L 4.7679 8.5437 124.0252 55.0194 42.5305 177.0919 90 T 4.3036 8.5482 113.4886 60.7789 70.7002 175.5365 91 S 4.0959 8.8472 115.2208 61.8748 62.0732 175.9230 92 E 4.1315 8.2667 120.7923 59.2095 29.2689 179.3412 93 G 3.3560 8.2369 105.9350 47.6970 0.0000 175.6885 94 E 3.9346 8.5383 121.3389 58.9559 29.3726 179.1697 95 F 3.9075 8.3096 120.7514 61.3215 39.5253 177.4174 96 V 3.2716 7.8226 117.7319 65.6309 31.1445 177.8353 97 A 3.8950 7.9053 120.6517 55.2724 18.1828 179.4754 98 Q 3.7858 8.1524 118.0174 59.0477 29.0511 178.1745 99 A 3.7531 7.8387 122.1690 55.0104 18.2643 179.7737 100 I 3.6429 7.7720 118.2786 64.4740 37.2315 178.7405 101 R 3.8767 8.0084 118.9772 59.4381 29.9029 179.3561 102 V 3.5597 7.9683 118.1283 65.8118 31.5027 178.0507 103 R 3.9902 7.9710 118.5712 59.6065 29.9477 178.2916 104 D 4.3646 8.4129 119.0939 57.2837 40.6922 178.4258 105 E 3.9597 8.2540 119.9771 59.2333 29.5603 178.7243 106 E 3.9609 8.4132 118.8206 59.1246 29.4439 179.3602 107 L 3.9472 7.7702 118.8304 57.6283 41.6878 179.3290 108 R 3.8606 7.9319 118.6909 59.4140 30.0410 178.3190 109 L 3.9279 8.1020 120.1980 57.9617 41.8605 178.7310 110 K 3.9124 8.0385 118.7184 59.5487 32.1854 178.2802 111 E 4.0991 8.0604 117.6545 59.6381 29.4792 178.7128 112 M 4.1812 7.7277 117.4029 58.4912 32.1949 177.2575 113 K 4.2827 7.8746 121.2140 56.7012 32.3675 176.7606 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 4 M 8.54 4.51 0.00 1.98 2.04 0.00 0.00 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.48 0.00 5 A 8.56 4.07 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 6 E 8.54 4.48 0.00 2.00 1.89 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 2.28 2.30 0.00 7 S 8.37 4.44 0.00 3.81 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 8 K 8.77 4.33 0.00 1.34 1.74 0.00 1.22 0.00 0.00 1.49 0.00 0.00 2.13 0.00 0.00 2.34 0.00 0.00 0.00 0.00 1.12 0.84 7.81 9 V 7.62 4.34 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 0.76 0.00 0.00 1.08 0.00 0.00 10 L 8.78 4.27 0.00 1.71 1.70 0.94 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 11 V 7.50 4.54 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 1.01 0.00 0.00 0.92 0.00 0.00 12 K 8.94 4.48 0.00 1.92 1.80 0.00 1.61 0.00 0.00 1.71 0.00 0.00 2.75 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.40 1.45 7.81 13 G 8.97 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 14 T 8.49 4.86 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 1.22 0.00 0.00 15 P 0.00 4.37 0.00 2.13 2.21 0.00 3.71 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.11 0.00 16 F 8.16 4.60 0.00 2.90 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 17 N 8.20 4.94 0.00 2.76 2.61 0.00 0.00 6.84 8.15 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 18 K 8.26 4.22 0.00 1.44 1.20 0.00 1.76 0.00 0.00 1.89 0.00 0.00 3.10 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.51 1.37 7.81 19 P 0.00 4.58 0.00 1.88 1.93 0.00 2.20 0.00 0.00 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 1.47 0.00 20 V 8.41 4.25 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 0.96 0.00 0.00 0.89 0.00 0.00 21 I 8.23 4.97 1.87 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 1.14 0.83 0.86 0.00 0.00 22 K 8.87 4.04 0.00 1.73 1.71 0.00 1.76 0.00 0.00 1.71 0.00 0.00 2.94 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.46 1.41 7.81 23 G 9.28 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 24 K 8.00 4.61 0.00 1.70 1.59 0.00 1.66 0.00 0.00 1.72 0.00 0.00 2.91 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.41 1.37 7.81 25 L 8.21 2.77 0.00 1.53 1.50 0.87 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 26 E 7.92 4.06 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 2.18 2.27 0.00 27 N 7.34 4.89 0.00 2.67 2.74 0.00 0.00 7.21 6.92 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 28 N 8.69 3.90 0.00 2.87 2.92 0.00 0.00 7.10 8.08 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 29 Y 8.32 3.78 0.00 3.16 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 30 D 8.03 4.52 0.00 2.82 2.78 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 31 M 7.87 4.59 0.00 2.18 2.25 0.00 0.00 0.00 0.00 0.00 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.54 0.00 32 S 9.38 4.58 0.00 4.04 4.08 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 33 Q 8.45 4.05 0.00 2.14 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.99 6.94 0.00 0.00 0.00 0.00 0.00 2.47 2.47 0.00 34 D 8.09 4.41 0.00 2.71 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 35 E 8.31 4.06 0.00 2.45 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 0.00 2.44 2.40 0.00 36 V 7.99 3.70 2.26 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 1.07 0.00 0.00 1.06 0.00 0.00 37 S 8.27 4.17 0.00 4.07 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 38 L 8.08 4.02 0.00 1.77 1.71 0.88 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 39 L 8.01 4.02 0.00 2.07 1.90 0.95 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 40 L 8.09 4.08 0.00 1.81 1.73 0.94 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 41 F 8.36 4.14 0.00 3.27 3.28 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 42 L 8.41 4.08 0.00 1.95 1.76 1.01 0.81 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 43 K 7.90 3.94 0.00 2.01 2.00 0.00 1.50 0.00 0.00 1.61 0.00 0.00 2.98 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.40 1.48 7.81 44 T 7.96 3.82 4.13 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 0.99 0.00 0.00 45 H 7.97 4.56 0.00 2.98 3.30 0.00 5.65 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 46 G 8.41 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 0.00 0.00 0.00 47 G 7.55 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 48 K 8.45 4.42 0.00 1.63 1.81 0.00 1.74 0.00 0.00 1.70 0.00 0.00 2.91 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.29 1.34 7.81 49 I 7.42 4.51 2.01 0.00 0.00 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 1.42 1.32 0.97 0.00 0.00 50 P 0.00 4.33 0.00 0.84 1.88 0.00 3.55 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.70 0.00 51 L 8.77 3.83 0.00 1.79 1.74 0.91 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 52 Y 7.44 4.25 0.00 3.22 3.24 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 53 R 7.69 4.15 0.00 1.88 2.06 0.00 3.14 0.00 0.00 3.05 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.27 0.00 54 I 7.60 3.72 2.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.53 0.84 0.00 0.00 55 K 7.79 4.07 0.00 1.82 2.07 0.00 1.81 0.00 0.00 1.74 0.00 0.00 3.07 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.47 1.49 7.81 56 N 7.98 4.72 0.00 2.83 2.90 0.00 0.00 6.86 7.82 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 57 E 8.09 4.70 0.00 2.20 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 2.32 2.46 0.00 58 T 7.69 3.37 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 0.35 0.00 0.00 59 G 7.97 3.84 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 0.00 0.00 0.00 60 L 7.05 4.69 0.00 1.57 1.53 0.92 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 61 K 8.51 4.07 0.00 1.70 1.83 0.00 1.77 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.41 1.42 7.81 62 D 7.62 4.76 0.00 2.72 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 63 P 0.00 4.19 0.00 2.14 2.01 0.00 3.62 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 2.06 2.09 0.00 64 E 8.12 3.88 0.00 2.01 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 2.36 2.36 0.00 65 S 8.17 4.05 0.00 4.07 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 66 V 7.67 3.56 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 1.02 0.00 0.00 0.99 0.00 0.00 67 L 8.23 3.93 0.00 1.80 1.84 0.94 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 68 K 8.02 3.80 0.00 1.93 1.89 0.00 1.63 0.00 0.00 1.67 0.00 0.00 2.89 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.37 1.59 7.81 69 N 7.88 3.84 0.00 2.84 2.26 0.00 0.00 7.06 6.64 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 70 L 7.69 4.00 0.00 1.89 1.87 1.03 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 71 M 8.06 4.34 0.00 2.02 2.19 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.58 0.00 72 D 8.09 4.33 0.00 2.52 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 73 Y 7.82 4.49 0.00 2.35 1.71 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 74 G 7.72 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 0.00 0.00 0.00 75 F 8.28 5.22 0.00 3.18 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 76 A 7.79 5.27 1.26 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 0.00 0.00 0.00 77 L 9.20 4.80 0.00 1.54 1.52 0.94 0.69 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 78 E 8.73 5.00 0.00 1.95 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 2.35 2.27 0.00 79 D 9.76 4.52 0.00 2.63 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 80 K 9.13 4.51 0.00 1.97 1.77 0.00 1.61 0.00 0.00 1.32 0.00 0.00 2.80 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.43 1.38 7.81 81 E 8.67 4.85 0.00 2.16 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 2.33 2.28 0.00 82 R 7.84 3.61 0.00 1.85 1.98 0.00 3.37 0.00 0.00 3.23 7.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.67 0.00 83 L 8.59 4.47 0.00 1.71 1.72 0.95 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 84 G 7.36 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 0.00 0.00 0.00 85 E 8.62 4.54 0.00 1.92 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 2.41 2.26 0.00 86 K 8.99 4.61 0.00 1.88 1.70 0.00 1.72 0.00 0.00 1.64 0.00 0.00 2.85 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.29 1.33 7.81 87 I 8.14 4.96 2.01 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 1.21 1.05 0.99 0.00 0.00 88 V 8.65 4.61 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 0.74 0.00 0.00 1.00 0.00 0.00 89 L 8.54 4.77 0.00 1.55 1.62 0.92 0.98 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 90 T 8.55 4.30 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 1.30 0.00 0.00 91 S 8.85 4.10 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 92 E 8.27 4.13 0.00 2.27 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 0.00 2.44 2.41 0.00 93 G 8.24 3.36 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 0.00 94 E 8.54 3.93 0.00 2.16 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 2.33 2.58 0.00 95 F 8.31 3.91 0.00 3.20 3.15 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 96 V 7.82 3.27 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 0.58 0.00 0.00 0.29 0.00 0.00 97 A 7.91 3.90 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 98 Q 8.15 3.79 0.00 2.13 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 2.26 2.28 0.00 99 A 7.84 3.75 1.08 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 0.00 0.00 100 I 7.77 3.64 1.99 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.90 0.91 0.00 0.00 101 R 8.01 3.88 0.00 1.94 1.94 0.00 3.10 0.00 0.00 3.05 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.81 0.00 102 V 7.97 3.56 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 0.95 0.00 0.00 0.88 0.00 0.00 103 R 7.97 3.99 0.00 1.92 2.05 0.00 3.28 0.00 0.00 3.13 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.76 0.00 104 D 8.41 4.36 0.00 2.84 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 0.00 105 E 8.25 3.96 0.00 2.24 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 2.28 2.37 0.00 106 E 8.41 3.96 0.00 2.15 1.96 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 2.31 2.63 0.00 107 L 7.77 3.95 0.00 1.94 1.70 0.90 0.92 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 0.00 108 R 7.93 3.86 0.00 1.97 2.14 0.00 3.09 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.63 0.00 109 L 8.10 3.93 0.00 1.78 1.79 0.91 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 110 K 8.04 3.91 0.00 1.86 1.99 0.00 1.85 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.48 7.81 111 E 8.06 4.10 0.00 2.13 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 2.34 2.66 0.00 112 M 7.73 4.18 0.00 2.00 2.30 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.86 2.59 0.00 113 K 7.87 4.28 0.00 1.89 1.72 0.00 1.73 0.00 0.00 1.74 0.00 0.00 3.07 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.47 1.61 7.81