NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 N 4.6427 8.4249 118.1155 52.3479 40.5361 173.9033 4 K 3.7748 7.8753 119.4831 55.8275 32.4043 174.7690 5 T 4.4640 8.9103 121.6223 61.8285 71.9178 172.9510 6 Y 4.7884 8.2979 122.2278 56.4050 40.5747 174.2596 7 E 4.8620 8.7347 121.0298 54.5339 32.3827 174.9050 8 I 3.8484 7.8514 123.3711 59.5804 37.4920 176.9683 9 S 4.5254 8.6828 121.4679 57.5534 65.0602 175.4768 10 S 4.3664 8.6201 116.9702 62.0287 62.6278 176.8050 11 A 4.1173 8.0377 122.7024 55.3875 17.9813 179.3577 12 E 3.9370 7.9656 116.3309 59.0934 29.5555 179.3588 13 W 4.1212 8.0663 118.8940 58.9624 29.1199 178.1445 14 E 4.0137 8.4356 120.0597 59.1995 29.1229 178.8615 15 V 3.5101 7.7715 117.6918 66.2552 31.7334 177.2997 16 M 3.3754 7.8137 118.4975 58.5149 31.7535 178.4961 17 N 4.8185 8.1523 115.8228 56.7034 38.7161 177.3854 18 I 3.7590 7.6619 120.6691 64.7203 37.2100 178.6379 19 I 3.7632 7.9088 120.4254 63.9220 36.5953 178.5544 20 W 4.5359 7.8572 119.4597 59.7235 28.9933 178.3798 21 M 4.3195 8.2328 117.9587 58.5887 31.8204 178.7251 22 K 4.1483 8.5619 118.1156 57.0717 32.1176 179.5698 23 K 4.4265 9.1485 120.4487 57.2618 31.8632 175.8904 24 Y 5.2467 8.4290 119.0426 56.6881 41.8059 174.0720 25 A 4.8580 8.7100 127.6104 50.7285 23.4795 175.6067 26 S 5.2814 8.8720 114.8219 56.6123 65.4509 175.1615 27 A 3.8970 8.9185 121.4395 55.4423 17.9841 179.4216 28 N 4.2344 8.2284 114.3382 56.6143 38.6792 176.7331 29 N 4.2320 8.1921 117.7457 56.7687 38.6664 177.3336 30 I 3.6843 7.7610 120.4518 64.5003 37.2310 178.4696 31 I 3.6692 8.1686 120.9629 64.4312 36.7145 178.0616 32 E 3.8959 8.3247 119.1599 59.2625 29.6469 178.3843 33 E 4.0856 8.2072 118.4888 59.6029 29.3336 179.4935 34 I 3.5280 7.8166 119.7880 64.3966 36.9485 178.4205 35 Q 4.2915 7.6870 118.4076 57.9688 28.4986 178.1384 36 M 4.1509 7.5036 120.1829 56.5908 32.2952 178.2104 37 Q 4.0600 8.1543 117.7739 56.7672 27.9197 179.2750 38 K 3.9211 5.6600 123.0227 57.1780 33.1651 175.7017 39 D 4.9185 8.2466 121.0470 51.9858 40.6975 174.9219 40 W 5.1140 7.9402 122.9941 53.7389 32.7762 176.3623 41 S 4.3656 8.4772 114.9173 57.9988 63.9807 173.6740 42 P 4.4238 0.0000 0.0000 65.0955 31.0894 179.2554 43 K 4.0548 7.8763 117.9789 59.5517 31.9191 179.3034 44 T 3.7801 7.8405 115.4739 66.7489 68.4567 176.4232 45 I 3.7979 7.8486 121.4762 64.6254 37.1503 178.6124 46 R 3.8321 8.4370 119.1031 59.5807 29.8411 179.1337 47 T 3.8188 7.6514 115.0522 66.8043 68.4269 176.6714 48 L 3.9679 7.9471 120.6730 57.6871 41.4829 179.7174 49 I 3.4719 7.8458 119.9516 64.4600 36.9797 178.3667 50 T 3.8936 8.1102 116.9010 66.8747 68.2730 176.5114 51 R 3.8475 8.2651 120.0535 59.6489 30.0917 179.2034 52 L 3.9962 8.0957 118.5113 57.6377 41.5011 179.0722 53 Y 4.5292 8.0274 121.2304 60.3029 38.6071 178.0781 54 K 3.6220 8.2283 118.3930 59.0776 32.2129 179.1812 55 K 3.4129 7.8389 117.4607 56.7827 31.9599 177.3812 56 G 3.6450 7.5320 107.1115 46.5116 0.0000 174.7256 57 F 4.4743 8.3687 120.8111 57.8945 40.0295 176.0800 58 I 5.0100 7.5211 112.6011 59.1023 41.1861 174.1142 59 D 5.3848 8.5014 123.7311 52.6637 44.8718 174.1614 60 R 5.1982 7.7881 113.9162 54.7329 32.1557 174.5717 61 K 4.8260 8.6569 119.5993 54.4632 36.2286 175.0261 62 K 4.6274 8.7424 124.6610 55.9100 33.4193 175.3846 63 D 4.6743 9.1364 127.0379 54.4297 43.6660 176.2339 64 N 3.9038 9.1922 120.8806 54.7440 35.4091 174.4913 65 K 3.7052 7.7464 120.9661 57.4427 31.2162 175.6848 66 I 4.2931 7.5747 120.9102 59.1800 39.7173 175.0794 67 F 4.6017 8.4075 125.4494 57.5342 40.4060 174.1777 68 Q 4.7160 8.7447 122.9164 54.4265 30.4544 174.4284 69 Y 4.7204 9.3681 123.6217 57.1750 39.9152 174.5577 70 Y 5.1575 8.1523 119.9958 55.2810 41.9736 174.7153 71 S 4.6426 8.9942 115.5228 58.6724 63.1142 173.8996 72 L 4.8210 9.0795 124.5448 54.5283 42.7187 176.9426 73 V 4.6096 7.8372 112.3196 59.1231 34.3243 175.8324 74 E 4.2598 8.8394 123.5783 55.8751 30.3160 177.0821 75 E 2.8978 8.8258 125.6289 59.4208 29.5175 179.2613 76 S 4.0509 7.7903 113.2670 61.2929 63.1310 176.0007 77 D 4.4493 8.0027 122.0239 57.3580 40.6846 178.3566 78 I 3.9836 7.9983 119.1236 64.1379 37.9356 178.0949 79 K 4.1188 8.4354 119.5572 59.4242 31.8228 178.8190 80 Y 4.1405 8.0144 119.3925 60.5762 38.8076 177.6356 81 K 3.6005 8.5790 120.9267 59.8538 32.2825 178.6493 82 T 3.9864 8.3041 116.0325 67.0296 68.3698 176.8493 83 S 4.2350 8.3860 117.2225 61.3360 62.6857 176.5254 84 K 3.8672 8.3694 122.8716 59.6036 31.8374 178.6184 85 N 4.3674 8.2058 116.7045 56.1736 38.4873 177.2447 86 F 4.1547 8.3631 121.9737 61.5517 39.5987 177.2628 87 I 3.8829 8.3559 119.7935 64.5752 36.6428 178.2460 88 N 4.4668 7.8092 116.7318 55.9999 38.4590 177.1514 89 K 4.0165 7.6997 120.0388 58.7493 32.3004 178.5748 90 V 3.7907 7.2471 117.4130 63.6371 32.0240 175.4170 91 Y 4.4614 7.9661 119.7365 55.7540 38.1681 176.7363 92 K 3.9029 8.8182 125.5634 59.1923 32.7044 177.9048 93 G 3.8603 8.2451 106.3407 44.4515 0.0000 175.3333 94 G 3.9321 8.0050 110.2577 45.2310 0.0000 173.4387 95 F 3.9629 9.0037 119.4632 62.0309 39.2638 178.4727 96 N 4.1419 8.2499 115.1336 56.0846 38.3612 177.2264 97 S 4.0970 7.9232 114.3399 61.0764 62.4829 175.9094 98 L 2.8030 7.0033 122.5050 57.6561 41.7786 178.8369 99 V 3.1928 7.2004 118.4148 65.8280 31.2546 177.4435 100 L 3.8589 8.0965 120.2153 58.3873 41.9549 178.1745 101 N 4.7219 8.1041 118.0566 56.3205 38.6860 176.7460 102 F 3.9132 8.5117 118.8820 60.3081 38.8106 177.6756 103 V 3.6345 7.6566 117.0789 66.1958 31.5523 177.8399 104 E 4.1135 8.6503 117.0036 58.8792 29.1534 177.5874 105 K 4.2068 7.4773 117.8576 57.0391 33.3160 176.3731 106 E 4.0175 7.8545 121.3487 56.5283 30.3590 176.6648 107 D 4.6438 8.3489 121.7686 52.6596 43.6192 174.6731 108 L 4.8223 8.2100 124.8887 51.8192 45.6932 176.0282 109 S 4.3532 8.4256 117.3382 58.3107 64.6231 175.1012 110 Q 4.0991 8.5226 119.3988 58.5815 28.0896 178.2694 111 D 4.2903 7.9560 121.3150 57.5054 41.0543 178.1160 112 E 3.9232 7.9085 118.8995 59.6809 29.5731 179.2080 113 I 3.7063 7.8682 119.7859 64.8365 37.1030 178.3300 114 E 3.9714 8.2002 119.0877 59.2086 29.3322 178.8475 115 E 3.9563 8.2725 118.9284 59.5788 29.5178 179.3793 116 L 3.9498 7.9235 118.4700 58.0844 41.7089 179.5154 117 R 3.7143 7.9539 118.3460 59.8094 29.9548 178.2388 118 N 4.3540 8.8353 116.5720 56.0528 38.2677 177.6047 119 I 3.7387 7.5576 120.5537 64.1920 37.3597 178.0391 120 L 4.1077 8.3826 119.0765 58.0291 41.6200 178.5566 121 N 4.2326 7.9210 115.5422 55.1416 38.8339 174.5711 122 K 4.2762 7.7686 122.6739 56.6980 32.5911 175.8417 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 3 N 8.42 4.64 0.00 2.66 2.88 0.00 0.00 6.98 6.73 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 4 K 7.88 3.77 0.00 1.63 1.24 0.00 1.51 0.00 0.00 1.57 0.00 0.00 2.48 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.29 1.18 7.81 5 T 8.91 4.46 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 1.24 0.00 0.00 6 Y 8.30 4.79 0.00 2.98 2.98 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 7 E 8.73 4.86 0.00 2.02 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 2.31 2.40 0.00 8 I 7.85 3.85 0.92 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.29 -0.36 -0.46 0.00 0.00 9 S 8.68 4.53 0.00 4.05 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 10 S 8.62 4.37 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 11 A 8.04 4.12 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 E 7.97 3.94 0.00 2.08 1.67 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 2.16 2.23 0.00 13 W 8.07 4.12 0.00 3.57 3.33 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 14 E 8.44 4.01 0.00 2.38 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 1.76 2.26 0.00 15 V 7.77 3.51 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 0.94 0.00 0.00 0.97 0.00 0.00 16 M 7.81 3.38 0.00 1.09 1.77 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 2.23 0.00 17 N 8.15 4.82 0.00 2.93 3.07 0.00 0.00 7.10 7.16 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 18 I 7.66 3.76 1.96 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 1.74 0.94 0.91 0.00 0.00 19 I 7.91 3.76 1.71 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.72 0.88 0.00 0.00 20 W 7.86 4.54 0.00 3.70 3.26 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 21 M 8.23 4.32 0.00 2.07 2.34 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.89 2.67 0.00 22 K 8.56 4.15 0.00 1.87 2.06 0.00 1.79 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.51 1.67 7.81 23 K 9.15 4.43 0.00 2.01 2.09 0.00 2.01 0.00 0.00 1.71 0.00 0.00 3.08 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.42 1.54 7.81 24 Y 8.43 5.25 0.00 2.85 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 25 A 8.71 4.86 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 26 S 8.87 5.28 0.00 3.96 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 27 A 8.92 3.90 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 28 N 8.23 4.23 0.00 2.76 2.90 0.00 0.00 7.05 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 29 N 8.19 4.23 0.00 3.08 2.92 0.00 0.00 7.09 7.07 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 30 I 7.76 3.68 1.96 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.61 0.85 0.00 0.00 31 I 8.17 3.67 1.99 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 1.42 0.74 0.92 0.00 0.00 32 E 8.32 3.90 0.00 2.11 1.97 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 2.32 2.50 0.00 33 E 8.21 4.09 0.00 2.18 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 2.33 2.50 0.00 34 I 7.82 3.53 1.75 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 1.37 1.00 0.29 0.00 0.00 35 Q 7.69 4.29 0.00 2.23 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.98 0.00 0.00 0.00 0.00 0.00 2.38 2.24 0.00 36 M 7.50 4.15 0.00 1.89 2.22 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.55 0.00 37 Q 8.15 4.06 0.00 1.87 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.65 7.02 0.00 0.00 0.00 0.00 0.00 2.28 2.26 0.00 38 K 5.66 3.92 0.00 0.79 1.22 0.00 1.60 0.00 0.00 1.51 0.00 0.00 2.94 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.10 0.71 7.81 39 D 8.25 4.92 0.00 2.58 2.61 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 0.00 0.00 0.00 0.00 40 W 7.94 5.11 0.00 3.29 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 41 S 8.48 4.37 0.00 3.92 3.76 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 42 P 0.00 4.42 0.00 2.21 2.09 0.00 3.68 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.19 0.00 43 K 7.88 4.05 0.00 1.80 1.85 0.00 1.57 0.00 0.00 1.65 0.00 0.00 3.02 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.52 7.81 44 T 7.84 3.78 4.50 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 1.01 0.00 0.00 45 I 7.85 3.80 1.93 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.88 0.93 0.00 0.00 46 R 8.44 3.83 0.00 1.87 1.96 0.00 3.14 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.75 0.00 47 T 7.65 3.82 4.38 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 1.16 0.00 0.00 48 L 7.95 3.97 0.00 1.77 1.64 0.88 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 49 I 7.85 3.47 1.69 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.67 -0.10 0.00 0.00 50 T 8.11 3.89 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 1.25 0.00 0.00 51 R 8.27 3.85 0.00 1.73 1.91 0.00 3.05 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.82 0.00 52 L 8.10 4.00 0.00 1.76 1.64 0.72 0.40 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 53 Y 8.03 4.53 0.00 2.99 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 54 K 8.23 3.62 0.00 1.51 1.64 0.00 1.62 0.00 0.00 1.66 0.00 0.00 2.98 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.31 1.50 7.81 55 K 7.84 3.41 0.00 1.78 1.75 0.00 1.80 0.00 0.00 2.03 0.00 0.00 3.03 0.00 0.00 2.86 0.00 0.00 0.00 0.00 0.69 1.27 7.81 56 G 7.53 3.65 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 0.00 0.00 0.00 57 F 8.37 4.47 0.00 3.20 2.95 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 0.00 0.00 0.00 58 I 7.52 5.01 1.93 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.37 0.80 0.00 0.00 59 D 8.50 5.38 0.00 2.62 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 0.00 0.00 0.00 60 R 7.79 5.20 0.00 1.03 0.67 0.00 2.21 0.00 0.00 2.59 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.79 0.00 61 K 8.66 4.83 0.00 1.99 1.83 0.00 1.87 0.00 0.00 1.92 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.52 1.56 7.81 62 K 8.74 4.63 0.00 1.75 1.62 0.00 1.45 0.00 0.00 1.36 0.00 0.00 2.35 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.06 0.72 7.81 63 D 9.14 4.67 0.00 2.67 2.42 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 64 N 9.19 3.90 0.00 2.92 3.21 0.00 0.00 6.25 7.13 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 65 K 7.75 3.71 0.00 1.84 1.86 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.26 1.38 7.81 66 I 7.57 4.29 1.90 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.86 0.87 0.00 0.00 67 F 8.41 4.60 0.00 2.87 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 0.00 0.00 0.00 0.00 68 Q 8.74 4.72 0.00 1.43 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.88 0.00 0.00 0.00 0.00 0.00 2.23 2.11 0.00 69 Y 9.37 4.72 0.00 2.81 2.71 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 70 Y 8.15 5.16 0.00 3.12 3.40 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 71 S 8.99 4.64 0.00 3.58 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 72 L 9.08 4.82 0.00 1.77 1.74 1.02 1.01 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 73 V 7.84 4.61 2.38 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 0.89 0.00 0.00 1.35 0.00 0.00 74 E 8.84 4.26 0.00 2.09 1.92 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 2.47 2.44 0.00 75 E 8.83 2.90 0.00 1.16 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 1.52 1.47 0.00 76 S 7.79 4.05 0.00 4.01 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 77 D 8.00 4.45 0.00 2.96 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 78 I 8.00 3.98 2.16 0.00 0.00 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 1.83 1.90 1.46 0.00 0.00 79 K 8.44 4.12 0.00 1.85 1.80 0.00 1.56 0.00 0.00 1.49 0.00 0.00 3.10 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.65 1.66 7.81 80 Y 8.01 4.14 0.00 3.06 3.25 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 81 K 8.58 3.60 0.00 1.93 2.11 0.00 1.83 0.00 0.00 1.77 0.00 0.00 3.01 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.46 1.53 7.81 82 T 8.30 3.99 4.51 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 83 S 8.39 4.24 0.00 3.90 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 84 K 8.37 3.87 0.00 1.58 1.64 0.00 1.48 0.00 0.00 1.28 0.00 0.00 2.13 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.32 1.26 7.81 85 N 8.21 4.37 0.00 3.14 2.95 0.00 0.00 6.67 8.30 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 86 F 8.36 4.15 0.00 3.21 3.22 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 87 I 8.36 3.88 2.05 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.05 1.04 0.00 0.00 88 N 7.81 4.47 0.00 2.72 2.88 0.00 0.00 6.99 7.67 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 89 K 7.70 4.02 0.00 1.70 1.95 0.00 1.79 0.00 0.00 1.63 0.00 0.00 2.96 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.23 1.35 7.81 90 V 7.25 3.79 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 0.13 0.00 0.00 0.32 0.00 0.00 91 Y 7.97 4.46 0.00 3.08 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 92 K 8.82 3.90 0.00 1.87 1.95 0.00 1.55 0.00 0.00 1.68 0.00 0.00 3.05 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.40 7.81 93 G 8.25 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 94 G 8.00 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 95 F 9.00 3.96 0.00 3.10 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 96 N 8.25 4.14 0.00 2.85 2.83 0.00 0.00 6.63 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 97 S 7.92 4.10 0.00 4.01 3.95 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 0.00 0.00 0.00 98 L 7.00 2.80 0.00 0.84 1.21 0.87 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 99 V 7.20 3.19 1.87 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 0.78 0.00 0.00 0.05 0.00 0.00 100 L 8.10 3.86 0.00 1.75 1.86 0.92 0.57 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 0.00 101 N 8.10 4.72 0.00 3.15 3.15 0.00 0.00 6.77 7.31 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 0.00 102 F 8.51 3.91 0.00 3.14 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 0.00 103 V 7.66 3.63 2.24 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 0.86 0.00 0.00 0.98 0.00 0.00 104 E 8.65 4.11 0.00 2.22 2.21 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 2.29 2.35 0.00 105 K 7.48 4.21 0.00 1.70 1.68 0.00 1.68 0.00 0.00 1.58 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.48 7.81 106 E 7.85 4.02 0.00 1.80 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 2.38 2.29 0.00 107 D 8.35 4.64 0.00 2.63 2.53 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.21 4.82 0.00 1.55 1.50 0.93 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 109 S 8.43 4.35 0.00 4.27 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 0.00 110 Q 8.52 4.10 0.00 2.30 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.01 6.96 0.00 0.00 0.00 0.00 0.00 2.41 2.45 0.00 111 D 7.96 4.29 0.00 2.75 2.75 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 0.00 112 E 7.91 3.92 0.00 1.93 2.00 0.00 0.00 0.00 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 2.51 0.00 113 I 7.87 3.71 1.99 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 1.53 0.55 0.91 0.00 0.00 114 E 8.20 3.97 0.00 2.35 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 2.49 0.00 115 E 8.27 3.96 0.00 2.21 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 2.35 2.48 0.00 116 L 7.92 3.95 0.00 1.85 1.72 0.91 0.62 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 0.00 117 R 7.95 3.71 0.00 2.11 1.97 0.00 3.09 0.00 0.00 3.17 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.69 0.00 118 N 8.84 4.35 0.00 3.01 2.84 0.00 0.00 6.97 7.85 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 0.00 119 I 7.56 3.74 1.98 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.62 0.90 0.00 0.00 120 L 8.38 4.11 0.00 1.58 1.74 0.94 0.98 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 0.00 121 N 7.92 4.23 0.00 2.83 2.87 0.00 0.00 7.48 7.26 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 0.00 122 K 7.77 4.28 0.00 2.00 1.88 0.00 1.77 0.00 0.00 1.72 0.00 0.00 3.00 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.49 1.48 7.81