NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 D 4.5336 8.3493 120.1928 54.2899 41.5257 174.3625 2 I 3.9575 7.4733 116.8350 58.0436 39.5326 172.1882 3 E 4.9160 9.1405 117.8373 54.6724 34.1645 175.7131 4 L 5.3174 8.4578 119.0185 53.3680 45.6465 176.0708 5 T 4.7108 9.1153 119.3251 61.7373 71.8721 172.6335 6 Q 5.3084 8.8548 127.0367 54.6035 31.6292 174.4019 7 T 5.0338 8.9282 115.1793 59.3161 71.7519 171.7244 8 P 4.7136 0.0000 0.0000 62.3435 32.5182 177.2361 9 V 3.9974 8.3519 119.5985 66.2896 32.3254 175.6377 10 S 5.2240 7.5721 109.6484 57.4512 66.0133 174.1641 11 L 4.6076 9.0969 120.4764 55.0946 43.8458 173.7767 12 S 5.4210 8.7367 116.6519 57.2541 64.7360 173.1669 13 A 4.8960 9.1086 124.4510 50.9268 23.0440 174.4415 14 S 4.6765 8.5428 110.3782 56.1235 66.9175 174.1460 15 V 3.7618 8.5476 120.0160 65.1125 31.7972 176.0434 16 G 3.9761 9.2845 115.5409 45.2570 0.0000 173.3053 17 E 4.7717 7.6740 119.3964 56.0080 31.6781 175.5074 18 T 5.4945 8.0524 115.5047 61.2019 72.1139 174.1922 19 V 4.5870 8.0049 116.8629 60.1872 36.8165 174.1574 20 T 4.9992 8.1712 117.0479 62.1211 72.4795 173.6829 21 I 4.6852 8.7482 125.7554 59.7802 41.3390 174.5498 22 T 5.3374 9.2339 122.1905 61.9960 72.2340 172.1974 23 C 5.5643 9.7707 124.6749 54.8918 46.2436 172.5409 24 R 5.3602 9.2349 125.6687 54.6031 32.5617 173.8932 25 A 5.2345 9.0638 128.2282 50.7264 20.9153 177.8000 26 S 4.4510 8.6646 114.5128 59.4855 63.5559 174.1171 27 E 4.6085 7.7890 117.0980 55.1759 33.0729 174.6951 28 N 4.2167 8.6372 120.8180 54.5576 38.8249 174.9282 29 I 4.3484 9.4667 118.9651 60.2772 40.0121 175.9203 30 Y 4.1797 7.7406 120.7778 59.6789 35.0277 171.9668 31 S 4.6959 7.9113 124.6465 59.8197 64.4440 173.5772 32 Y 4.8774 7.3117 120.7708 57.6548 36.5884 174.4825 33 L 5.0586 7.5092 122.0292 53.1372 45.6231 176.0447 34 A 5.2662 9.4219 128.1311 50.2991 22.1280 175.3293 35 W 5.3554 8.4211 117.7192 55.2657 33.2084 174.6182 36 Y 5.4279 9.3662 119.3563 56.5658 42.1598 173.8135 37 Q 4.7639 9.4535 124.6427 54.2890 31.8960 173.8870 38 Q 5.0133 9.1450 127.1153 54.4019 31.9738 174.7260 39 K 4.8040 8.5313 125.4074 54.4439 35.1064 175.8094 40 Q 4.0056 8.7003 122.8089 57.8204 29.0746 176.4490 41 G 3.9074 8.9476 112.1524 46.1007 0.0000 172.5324 42 K 4.5891 7.8838 118.5180 53.8049 34.9110 175.8875 43 S 4.4273 8.2064 115.6277 57.8080 63.5233 173.0079 44 P 4.6511 0.0000 0.0000 62.9966 32.0995 175.8375 45 Q 4.8533 9.6603 122.8992 53.6412 31.8020 174.8916 46 F 4.5636 9.3932 126.0225 59.5273 39.5628 173.9013 47 L 4.2455 8.6159 125.6338 55.8999 44.2443 177.0094 48 V 4.9393 6.7516 110.0206 59.9651 36.5515 173.4307 49 Y 5.2357 8.9744 121.4036 54.4942 42.1332 174.2141 50 N 4.7330 10.2355 113.7904 54.1163 37.6128 175.7376 51 A 4.0984 8.4910 123.1440 53.6847 18.9311 179.1409 52 K 4.5298 10.6706 108.8940 56.3200 34.1196 176.2071 53 T 4.1705 7.7844 118.3558 62.6901 68.8915 174.4351 54 L 4.3509 8.5768 127.0495 54.8907 42.5799 177.5872 55 G 4.0074 8.3532 109.4485 44.9906 0.0000 173.0767 56 E 4.2013 8.7830 119.9797 57.9933 29.6999 178.2269 57 G 3.9707 8.9587 111.8870 45.2693 0.0000 173.6648 58 V 3.6629 7.5739 120.5391 61.6428 32.1235 173.9931 59 P 4.5683 0.0000 0.0000 62.3232 32.0110 177.2607 60 S 4.4044 8.6115 114.3084 60.0506 63.2166 175.2211 61 R 3.9814 8.1757 120.8395 58.7155 30.8298 175.9537 62 F 5.1494 7.9296 117.7302 55.5902 40.8985 175.6973 63 S 4.6541 9.4129 117.4792 56.5933 66.5954 172.9450 64 G 4.9158 8.8949 109.1509 44.2312 0.0000 172.6628 65 S 4.8017 9.3507 117.3034 56.7036 67.3370 172.0869 66 G 4.0361 8.8359 105.3011 44.9305 0.0000 172.4174 67 S 4.4680 7.9941 112.4289 57.8104 64.5380 174.3620 68 G 4.6932 8.0364 107.7754 46.2930 0.0000 175.1109 69 T 4.2142 7.1650 110.7529 62.7238 74.0519 173.3974 70 Q 4.8442 7.4497 119.6929 54.0691 31.0806 175.1019 71 F 5.4941 9.5936 123.4469 55.6620 42.9043 174.6549 72 S 5.3766 9.1422 115.3581 56.5626 67.1655 172.3936 73 L 4.6300 8.5508 122.4301 52.8975 44.5702 174.9137 74 K 4.8202 9.1131 127.6046 54.4808 35.6561 174.6359 75 I 4.4973 8.1464 127.0297 59.4392 39.8102 174.5834 76 N 4.4979 9.1077 125.8850 53.9540 39.6876 177.5145 77 S 4.1158 8.1388 109.5066 59.4200 61.2319 171.3066 78 L 3.9793 8.3256 132.7655 55.5158 42.4421 177.0872 79 L 4.9186 8.8989 122.8533 52.3605 43.8902 176.1441 80 P 4.8266 0.0000 0.0000 65.6171 31.4102 177.7164 81 E 4.4260 8.1929 114.8084 57.1589 30.0708 177.1378 82 D 4.6405 7.8606 119.7201 56.9089 41.1312 176.9932 83 F 4.1334 7.3058 116.5572 57.6090 39.8741 174.6742 84 G 3.8192 7.7249 107.9833 44.3731 0.0000 172.8011 85 S 5.5086 8.5579 115.4157 57.0414 66.4191 173.2290 86 Y 5.9927 8.4747 118.2137 55.7270 42.1181 174.2734 87 Y 5.4843 9.1309 118.7595 56.7110 42.9695 173.3722 88 C 4.5947 8.6742 117.5025 54.2529 43.1428 172.0359 89 Q 4.6889 8.3513 118.4548 55.4140 32.6407 172.0345 90 H 5.0518 8.3571 125.1522 54.7732 30.7983 174.1411 91 H 4.9386 8.8026 120.8151 55.2580 29.2598 173.2936 92 Y 4.1998 7.9040 118.2680 56.5296 41.4886 173.7648 93 G 3.6271 7.1661 110.5376 43.6614 0.0000 172.8579 94 T 4.0344 8.0008 116.6471 62.3621 68.9937 173.5414 95 P 4.3994 0.0000 0.0000 61.6673 32.1265 174.0949 96 P 4.6729 0.0000 0.0000 61.6831 32.9534 174.0341 97 L 4.8590 7.9290 117.5865 53.3991 45.6466 175.6384 98 T 4.7619 8.0550 114.6598 62.3105 71.1293 174.0424 99 F 5.0954 8.7529 122.3863 55.4946 41.6657 175.7395 100 G 3.9231 8.7067 109.7202 46.2845 0.0000 173.7729 101 G 4.0043 8.8519 107.2642 45.2952 0.0000 175.1099 102 G 3.3982 8.8719 105.9621 45.4429 0.0000 173.0158 103 T 5.2606 8.3161 110.3231 58.2421 72.0340 172.9233 104 K 4.3267 8.7785 128.0899 55.9042 33.3497 175.0182 105 L 5.0144 8.9727 131.4546 54.5036 43.3936 175.4100 106 E 5.3709 9.5070 125.4673 54.1847 34.0476 175.0072 107 I 3.7961 7.7924 114.4461 59.9094 38.8166 175.8565 108 K 4.1607 9.6803 125.4369 56.8846 31.6244 176.3665 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 D 8.35 4.53 0.00 2.66 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 2 I 7.47 3.96 1.83 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.54 0.92 0.00 0.00 3 E 9.14 4.92 0.00 2.03 2.05 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 2.25 2.32 0.00 4 L 8.46 5.32 0.00 1.50 1.55 0.85 0.78 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 5 T 9.12 4.71 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 1.25 0.00 0.00 6 Q 8.85 5.31 0.00 2.08 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.80 0.00 0.00 0.00 0.00 0.00 2.33 2.67 0.00 7 T 8.93 5.03 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 1.25 0.00 0.00 8 P 0.00 4.71 0.00 2.43 2.23 0.00 3.73 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.96 0.00 9 V 8.35 4.00 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 1.00 0.00 0.00 0.96 0.00 0.00 10 S 7.57 5.22 0.00 3.88 3.80 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 11 L 9.10 4.61 0.00 1.70 1.78 0.91 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 12 S 8.74 5.42 0.00 3.78 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 13 A 9.11 4.90 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 14 S 8.54 4.68 0.00 3.82 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 15 V 8.55 3.76 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 0.84 0.00 0.00 1.08 0.00 0.00 16 G 9.28 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 17 E 7.67 4.77 0.00 2.07 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 2.32 2.30 0.00 18 T 8.05 5.49 4.17 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 1.19 0.00 0.00 19 V 8.00 4.59 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 0.71 0.00 0.00 0.69 0.00 0.00 20 T 8.17 5.00 4.17 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 1.13 0.00 0.00 21 I 8.75 4.69 1.53 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.49 1.14 0.00 0.00 22 T 9.23 5.34 4.44 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 1.37 0.00 0.00 23 C 9.77 5.56 0.00 3.02 3.10 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 0.00 0.00 0.00 0.00 24 R 9.23 5.36 0.00 2.08 1.79 0.00 3.15 0.00 0.00 3.36 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.59 0.00 25 A 9.06 5.23 1.39 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 0.00 0.00 0.00 26 S 8.66 4.45 0.00 3.92 4.12 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 27 E 7.79 4.61 0.00 1.91 1.78 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 2.18 2.17 0.00 28 N 8.64 4.22 0.00 2.69 2.51 0.00 0.00 6.67 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 29 I 9.47 4.35 1.95 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.12 0.74 0.00 0.00 30 Y 7.74 4.18 0.00 3.00 1.81 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 31 S 7.91 4.70 0.00 3.90 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 32 Y 7.31 4.88 0.00 3.35 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 33 L 7.51 5.06 0.00 0.61 0.93 0.54 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 34 A 9.42 5.27 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 0.00 0.00 0.00 0.00 0.00 0.00 35 W 8.42 5.36 0.00 3.25 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 36 Y 9.37 5.43 0.00 3.20 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 37 Q 9.45 4.76 0.00 1.90 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.75 0.00 0.00 0.00 0.00 0.00 2.10 1.65 0.00 38 Q 9.15 5.01 0.00 2.11 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.48 0.00 0.00 0.00 0.00 0.00 2.31 2.32 0.00 39 K 8.53 4.80 0.00 1.77 1.74 0.00 1.79 0.00 0.00 2.06 0.00 0.00 2.85 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.46 1.44 7.81 40 Q 8.70 4.01 0.00 2.02 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.56 0.00 0.00 0.00 0.00 0.00 2.37 2.45 0.00 41 G 8.95 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 0.00 0.00 0.00 42 K 7.88 4.59 0.00 1.72 1.74 0.00 1.73 0.00 0.00 1.72 0.00 0.00 2.96 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.51 1.38 7.81 43 S 8.21 4.43 0.00 3.74 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 44 P 0.00 4.65 0.00 1.78 1.92 0.00 3.50 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.90 0.00 45 Q 9.66 4.85 0.00 1.96 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.94 0.00 0.00 0.00 0.00 0.00 2.31 2.44 0.00 46 F 9.39 4.56 0.00 3.15 3.18 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 47 L 8.62 4.25 0.00 1.67 1.41 1.13 -0.03 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 48 V 6.75 4.94 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 0.79 0.00 0.00 1.16 0.00 0.00 49 Y 8.97 5.24 0.00 2.99 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 50 N 10.24 4.73 0.00 2.59 2.65 0.00 0.00 7.63 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 51 A 8.49 4.10 1.66 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 0.00 0.00 0.00 0.00 0.00 0.00 52 K 10.67 4.53 0.00 1.90 1.91 0.00 1.58 0.00 0.00 1.69 0.00 0.00 2.99 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.41 1.33 7.81 53 T 7.78 4.17 3.31 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 1.19 0.00 0.00 54 L 8.58 4.35 0.00 1.52 1.55 0.94 1.01 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 55 G 8.35 4.01 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 0.00 0.00 0.00 0.00 0.00 0.00 56 E 8.78 4.20 0.00 2.03 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 2.37 2.39 0.00 57 G 8.96 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 58 V 7.57 3.66 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 0.34 0.00 0.00 0.87 0.00 0.00 59 P 0.00 4.57 0.00 2.41 2.24 0.00 3.57 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.08 0.00 60 S 8.61 4.40 0.00 4.01 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 61 R 8.18 3.98 0.00 1.77 1.59 0.00 3.19 0.00 0.00 3.35 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.65 0.00 62 F 7.93 5.15 0.00 2.88 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 63 S 9.41 4.65 0.00 3.72 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 64 G 8.89 4.92 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 65 S 9.35 4.80 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 66 G 8.84 4.04 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 S 7.99 4.47 0.00 3.94 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 68 G 8.04 4.69 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 69 T 7.16 4.21 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 1.19 0.00 0.00 70 Q 7.45 4.84 0.00 1.88 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.72 0.00 0.00 0.00 0.00 0.00 2.19 2.39 0.00 71 F 9.59 5.49 0.00 3.20 3.23 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 72 S 9.14 5.38 0.00 3.80 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 73 L 8.55 4.63 0.00 0.27 0.35 0.55 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 74 K 9.11 4.82 0.00 1.62 1.43 0.00 1.53 0.00 0.00 1.55 0.00 0.00 2.76 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.15 1.33 7.81 75 I 8.15 4.50 1.44 0.00 0.00 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.46 0.28 0.22 0.00 0.00 76 N 9.11 4.50 0.00 2.44 2.64 0.00 0.00 7.26 7.32 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 77 S 8.14 4.12 0.00 4.02 4.35 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 78 L 8.33 3.98 0.00 1.66 1.42 0.86 -0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 79 L 8.90 4.92 0.00 1.79 1.82 0.94 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 80 P 0.00 4.83 0.00 2.32 2.42 0.00 3.76 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.02 0.00 81 E 8.19 4.43 0.00 2.18 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 0.00 2.37 2.35 0.00 82 D 7.86 4.64 0.00 2.62 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 83 F 7.31 4.13 0.00 3.32 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 84 G 7.72 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 0.00 0.00 0.00 85 S 8.56 5.51 0.00 3.87 3.66 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 0.00 0.00 0.00 0.00 86 Y 8.47 5.99 0.00 3.00 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 87 Y 9.13 5.48 0.00 3.20 3.10 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 0.00 0.00 0.00 0.00 88 C 8.67 4.59 0.00 1.86 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 89 Q 8.35 4.69 0.00 1.75 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.83 0.00 0.00 0.00 0.00 0.00 1.75 1.16 0.00 90 H 8.36 5.05 0.00 3.12 3.08 0.00 5.78 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 H 8.80 4.94 0.00 3.16 3.34 0.00 5.55 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 Y 7.90 4.20 0.00 1.87 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 0.00 0.00 0.00 0.00 93 G 7.17 3.63 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 0.00 0.00 0.00 94 T 8.00 4.03 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 1.16 0.00 0.00 95 P 0.00 4.40 0.00 1.99 1.91 0.00 3.59 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.96 0.00 96 P 0.00 4.67 0.00 2.18 2.05 0.00 3.69 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.97 0.00 97 L 7.93 4.86 0.00 1.52 1.56 0.77 0.74 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 98 T 8.06 4.76 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 1.28 0.00 0.00 99 F 8.75 5.10 0.00 2.91 3.02 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 0.00 100 G 8.71 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 0.00 101 G 8.85 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 0.00 102 G 8.87 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 0.00 0.00 0.00 103 T 8.32 5.26 4.54 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 1.34 0.00 0.00 104 K 8.78 4.33 0.00 1.91 1.81 0.00 1.76 0.00 0.00 1.79 0.00 0.00 3.04 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.72 1.52 7.81 105 L 8.97 5.01 0.00 1.94 1.95 1.02 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 106 E 9.51 5.37 0.00 1.93 1.82 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 2.31 2.30 0.00 107 I 7.79 3.80 1.53 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 -0.27 -0.08 0.00 0.00 108 K 9.68 4.16 0.00 1.86 1.72 0.00 1.74 0.00 0.00 1.77 0.00 0.00 3.05 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.45 7.81