NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 E 4.3067 8.2876 121.4728 55.7062 30.6933 175.2799 3 S 4.3286 8.3881 121.9010 57.8752 65.2540 173.7491 4 R 4.0025 8.9565 123.8779 59.2502 30.3581 180.5358 5 A 4.0466 7.9426 120.3643 55.1615 18.5002 179.6881 6 K 4.0330 8.0751 116.9199 59.2682 32.0963 179.4395 7 K 4.3306 8.1465 121.3631 59.0252 32.0670 178.4207 8 F 4.1319 8.2292 120.5683 61.7006 39.1690 176.7482 9 Q 4.0351 8.1675 117.2012 58.9005 28.3279 178.4407 10 R 3.8628 8.0661 119.4605 60.0040 30.2331 178.4106 11 Q 3.9930 8.3056 116.6055 57.9294 29.0908 176.4751 12 H 4.8100 8.0980 113.8308 54.0802 30.7750 172.8312 13 M 4.8325 8.2945 120.1959 53.8729 33.9362 176.4781 14 D 4.7290 8.4353 123.8523 52.4347 41.8792 176.4873 15 S 4.3231 8.3883 117.6313 62.1139 63.5155 176.2497 16 D 4.8299 7.7998 118.4524 54.1373 40.7523 176.2624 17 S 4.7303 7.4534 111.0150 56.0122 66.4810 173.9378 18 S 4.1493 8.5674 116.7642 57.8687 62.8052 172.4058 19 P 3.8523 0.0000 0.0000 65.7398 31.6069 177.8179 20 S 4.4069 7.5433 113.5250 57.3323 62.1975 174.9022 21 S 4.0147 7.4183 114.5623 58.6381 63.4730 174.8481 22 S 4.5280 8.3990 117.8017 57.1338 64.0603 175.0305 23 S 4.1687 8.6223 115.5618 60.6014 62.6535 175.4115 24 T 4.1612 7.8142 111.2814 64.0031 69.5031 175.9116 25 Y 3.9900 8.7730 124.3232 61.2003 38.6390 177.5360 26 C 4.1007 8.2295 116.4846 60.2036 38.6515 175.9549 27 N 4.3760 8.2660 117.4546 56.4429 38.0674 176.9432 28 Q 3.6904 7.7138 120.8802 59.2427 29.1765 177.8351 29 M 3.5589 8.0752 119.7280 58.6539 31.9422 178.7398 30 M 4.0035 7.8245 118.6242 58.3550 32.1326 178.9628 31 R 3.9129 7.4388 119.0901 59.5832 30.1406 178.8537 32 R 3.9951 7.6996 116.5403 58.7241 30.0066 178.1789 33 R 4.3062 7.8289 115.9781 55.1842 30.9568 175.9821 34 N 4.2387 8.0259 113.9391 55.5326 35.9936 174.4773 35 M 4.8738 8.3679 113.0735 55.2069 33.4646 178.3427 36 T 4.4214 7.9929 108.8650 62.4813 71.0725 172.9756 37 Q 4.1427 8.2835 120.4316 60.0322 29.4604 175.1273 38 G 3.8388 8.9354 114.9032 44.2845 0.0000 173.9579 39 R 4.2945 8.4061 114.8749 53.5463 33.7852 176.4982 40 C 4.4162 8.8942 119.7955 57.2143 40.7967 173.3320 41 K 4.3678 8.4337 125.7970 55.3300 32.6161 174.7586 42 P 4.6350 0.0000 0.0000 65.3695 32.0829 176.2230 43 V 4.9597 7.6504 118.7484 59.2050 34.2174 173.4609 44 N 5.0247 9.0717 121.9894 52.4101 43.6616 172.7396 45 T 4.7860 7.5569 116.0580 61.9113 72.9157 173.0396 46 F 5.0523 9.0134 124.9980 55.6495 41.8575 174.6686 47 V 4.5808 8.7967 123.1663 61.4510 33.3695 175.3335 48 H 5.0121 9.5374 129.3837 54.1805 26.3576 174.2701 49 E 4.8633 7.8327 117.6757 53.9368 34.2542 174.1460 50 P 4.4016 0.0000 0.0000 62.4827 32.4005 177.0902 51 L 4.0371 8.0708 122.8193 58.9011 41.8351 180.2297 52 V 3.8622 7.8341 111.4218 64.3191 31.2240 178.1678 53 D 4.3930 7.9612 118.3987 57.2934 40.9787 178.5580 54 V 3.8271 7.8050 118.3647 66.0862 31.7915 177.9577 55 Q 3.9990 8.3780 117.9618 58.8685 28.6454 178.1831 56 N 4.6174 8.2542 117.8975 56.2911 38.8428 177.0245 57 V 3.8346 7.7245 119.9336 65.9463 31.3768 176.6073 58 C 3.4155 7.5925 113.4361 57.6535 39.7866 173.8885 59 F 4.6926 7.4466 117.5357 57.0297 40.6709 175.8527 60 Q 4.6421 7.6156 121.2645 55.7452 28.0141 176.5366 61 E 4.2304 8.6477 127.7941 56.8280 30.4806 175.9691 62 K 4.3804 8.7343 129.0827 56.5757 32.7859 176.0505 63 V 4.5400 8.3459 118.9555 59.9952 36.8749 174.3521 64 T 4.1284 8.2535 118.7884 63.6079 69.1696 175.8171 65 C 4.6144 9.1337 123.3803 56.1271 41.1113 174.6223 66 K 3.7281 9.4763 124.4558 59.5692 31.7079 177.2879 67 N 4.6740 8.1339 113.1508 52.5198 37.4052 175.6264 68 G 3.9343 8.4051 109.4954 45.6708 0.0000 174.3315 69 Q 4.0945 8.1980 120.7381 56.3212 29.5178 176.7656 70 G 3.9273 8.3474 109.5913 46.2097 0.0000 173.5589 71 N 4.5569 7.7787 119.0306 53.4086 36.9790 175.3011 72 C 5.3268 7.4024 115.6521 56.4785 44.8220 174.0246 73 Y 5.2059 9.0728 118.3462 56.2027 42.4804 174.0528 74 K 5.0268 9.2206 124.8779 54.2439 34.4210 175.6314 75 S 4.6656 8.9147 123.2333 58.8249 62.9597 174.7697 76 N 4.5121 9.4330 120.1499 55.2546 38.6059 174.8983 77 S 5.0641 7.7903 111.2123 56.0367 66.3475 173.7325 78 S 4.4969 8.3635 114.6423 58.1351 64.2218 173.2121 79 M 4.8981 9.4646 121.3846 53.5940 36.6621 174.3927 80 H 5.0246 9.2807 118.7460 55.8650 29.8668 174.8793 81 I 5.2508 9.3185 116.6486 59.5696 41.9816 174.3427 82 T 5.0465 9.0004 118.5817 62.1513 72.2614 172.9626 83 D 5.1711 9.1441 127.0673 53.2098 43.4068 174.8847 84 C 5.6029 8.8420 119.5892 55.2223 41.8394 173.0190 85 R 5.3496 9.2124 123.8754 53.9662 33.2253 174.1210 86 L 4.0982 8.8714 129.0835 55.7316 42.7001 176.4562 87 T 4.3905 8.1870 116.3204 60.7660 70.3390 175.5759 88 N 4.4425 8.9876 120.6354 54.9076 38.5695 175.8813 89 G 3.8305 7.4033 105.9756 46.2083 0.0000 174.8477 90 S 4.1990 7.9428 117.5267 58.6108 63.1863 174.3851 91 R 4.3155 8.4858 125.2318 55.1621 31.2128 173.4654 92 Y 3.8951 8.5004 125.5871 56.8359 39.3127 174.8467 93 P 2.9700 0.0000 0.0000 63.7869 32.0426 176.7985 94 N 4.3720 7.6674 117.2302 53.3086 36.5747 173.2663 95 C 4.4916 8.2494 119.3084 55.0781 34.7734 173.3535 96 A 4.9581 8.1816 126.8035 50.8992 20.8365 175.2436 97 Y 5.2112 9.8612 117.3431 56.2436 42.5532 174.9005 98 R 4.5407 9.5914 122.5587 55.5021 31.8841 174.9778 99 T 4.9098 8.6425 123.1917 62.2377 70.3797 174.4534 100 S 4.6866 9.4848 123.0635 55.5455 63.1741 169.0042 101 P 5.0558 0.0000 0.0000 61.7499 32.2563 175.4827 102 K 4.6708 9.2152 124.6681 55.4340 36.6996 174.1140 103 E 5.2098 8.7440 118.9028 55.1872 31.7228 175.8518 104 R 4.7300 8.8434 122.4875 54.9544 35.6374 174.3468 105 H 4.8382 8.8975 117.7086 55.7994 30.1517 174.8631 106 I 4.9851 8.6554 113.9089 59.2179 41.2294 174.2268 107 I 5.0227 8.2336 123.9514 59.8498 40.4365 175.1317 108 V 4.7989 8.7367 118.4889 59.5738 36.4696 174.3689 109 A 5.0282 8.7138 124.3751 51.1897 20.9333 175.7322 110 C 5.7153 8.7723 116.8265 54.2112 39.3550 173.0647 111 E 4.6553 8.0423 116.9390 57.0115 32.0970 175.9406 112 G 3.9288 10.0911 106.7896 44.6266 0.0000 172.7331 113 S 4.3914 8.1501 113.9779 55.8171 63.6131 172.4453 114 P 4.4078 0.0000 0.0000 63.0694 31.5083 175.6791 115 Y 4.7939 8.4331 120.3291 56.7706 38.5674 174.2487 116 V 4.4174 7.8728 119.3482 58.1518 36.6829 173.1941 117 P 4.4380 0.0000 0.0000 62.7012 31.2575 177.1248 118 V 4.4942 7.8960 115.2849 60.6450 33.9011 174.9327 119 H 4.7322 7.7566 117.5332 55.4212 33.2055 172.2871 120 F 4.5697 8.9677 128.5107 57.3281 39.1984 174.3613 121 D 4.5213 8.0726 126.9538 56.0318 42.1886 175.5890 122 A 4.5345 6.2601 118.1118 51.7404 22.3680 174.9328 123 S 5.1252 8.8013 112.4628 56.7490 66.2594 173.7937 124 V 4.4256 8.7894 121.4796 61.1927 34.6064 174.0446 125 E 4.5988 8.9533 128.0009 54.2079 30.4401 174.3174 126 D 5.0132 8.6098 123.6831 52.3992 40.2270 176.6650 127 S 4.1648 7.8223 119.7669 59.2180 62.7492 173.7394 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 E 8.29 4.31 0.00 2.03 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 2.30 2.33 0.00 3 S 8.39 4.33 0.00 4.19 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 4 R 8.96 4.00 0.00 1.89 2.06 0.00 3.14 0.00 0.00 3.58 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.72 0.00 5 A 7.94 4.05 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 6 K 8.08 4.03 0.00 1.97 1.91 0.00 1.73 0.00 0.00 1.69 0.00 0.00 2.92 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.49 1.62 7.81 7 K 8.15 4.33 0.00 1.98 2.04 0.00 1.72 0.00 0.00 1.72 0.00 0.00 3.10 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.68 1.33 7.81 8 F 8.23 4.13 0.00 3.23 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 0.00 9 Q 8.17 4.04 0.00 2.42 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.51 0.00 0.00 0.00 0.00 0.00 2.57 2.77 0.00 10 R 8.07 3.86 0.00 1.81 1.98 0.00 3.38 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.70 0.00 11 Q 8.31 3.99 0.00 1.79 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.47 0.00 0.00 0.00 0.00 0.00 2.26 2.38 0.00 12 H 8.10 4.81 0.00 2.07 2.69 0.00 5.60 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 M 8.29 4.83 0.00 2.01 2.07 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.59 0.00 14 D 8.44 4.73 0.00 2.52 2.43 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 0.00 15 S 8.39 4.32 0.00 3.92 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 16 D 7.80 4.83 0.00 2.66 2.67 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 0.00 0.00 0.00 17 S 7.45 4.73 0.00 4.14 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 18 S 8.57 4.15 0.00 3.82 3.78 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 19 P 0.00 3.85 0.00 1.86 1.75 0.00 3.61 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.92 0.00 20 S 7.54 4.41 0.00 3.79 3.79 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 21 S 7.42 4.01 0.00 3.42 3.03 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 22 S 8.40 4.53 0.00 4.04 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 23 S 8.62 4.17 0.00 4.04 4.09 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 24 T 7.81 4.16 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 1.24 0.00 0.00 25 Y 8.77 3.99 0.00 3.03 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 26 C 8.23 4.10 0.00 3.15 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 27 N 8.27 4.38 0.00 2.76 2.94 0.00 0.00 6.75 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 7.71 3.69 0.00 2.05 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.78 0.00 0.00 0.00 0.00 0.00 2.14 2.28 0.00 29 M 8.08 3.56 0.00 0.77 1.10 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.35 0.00 30 M 7.82 4.00 0.00 1.73 1.79 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 2.33 0.00 31 R 7.44 3.91 0.00 2.05 2.03 0.00 3.10 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.68 0.00 32 R 7.70 4.00 0.00 1.71 1.89 0.00 3.07 0.00 0.00 3.13 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.59 0.00 33 R 7.83 4.31 0.00 1.89 2.11 0.00 3.54 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.97 0.00 34 N 8.03 4.24 0.00 2.92 2.91 0.00 0.00 6.67 7.03 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 35 M 8.37 4.87 0.00 2.03 2.09 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.38 0.00 36 T 7.99 4.42 4.42 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 1.42 0.00 0.00 37 Q 8.28 4.14 0.00 2.11 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.45 0.00 0.00 0.00 0.00 0.00 2.43 2.44 0.00 38 G 8.94 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 39 R 8.41 4.29 0.00 1.67 1.75 0.00 3.32 0.00 0.00 3.05 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.45 0.00 40 C 8.89 4.42 0.00 3.00 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 41 K 8.43 4.37 0.00 1.89 1.81 0.00 1.75 0.00 0.00 1.65 0.00 0.00 3.05 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.47 1.39 7.81 42 P 0.00 4.64 0.00 2.19 2.31 0.00 3.73 0.00 0.00 3.97 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 7.65 4.96 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 0.76 0.00 0.00 0.96 0.00 0.00 44 N 9.07 5.02 0.00 2.62 2.33 0.00 0.00 6.60 6.57 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 45 T 7.56 4.79 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 0.73 0.00 0.00 46 F 9.01 5.05 0.00 3.01 2.86 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 47 V 8.80 4.58 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 1.10 0.00 0.00 1.11 0.00 0.00 48 H 9.54 5.01 0.00 3.09 3.27 0.00 5.90 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 7.83 4.86 0.00 1.88 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 2.31 2.36 0.00 50 P 0.00 4.40 0.00 2.21 2.01 0.00 3.94 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 2.14 2.11 0.00 51 L 8.07 4.04 0.00 1.95 1.74 1.05 1.08 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 52 V 7.83 3.86 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 0.77 0.00 0.00 0.95 0.00 0.00 53 D 7.96 4.39 0.00 2.85 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 54 V 7.80 3.83 2.35 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 1.31 0.00 0.00 1.09 0.00 0.00 55 Q 8.38 4.00 0.00 2.35 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.57 0.00 0.00 0.00 0.00 0.00 2.38 2.61 0.00 56 N 8.25 4.62 0.00 3.04 3.10 0.00 0.00 6.78 7.87 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 57 V 7.72 3.83 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 1.09 0.00 0.00 0.97 0.00 0.00 58 C 7.59 3.42 0.00 2.22 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 0.00 0.00 0.00 59 F 7.45 4.69 0.00 3.14 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 60 Q 7.62 4.64 0.00 2.19 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.87 0.00 0.00 0.00 0.00 0.00 2.37 2.56 0.00 61 E 8.65 4.23 0.00 2.37 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 0.00 2.32 2.27 0.00 62 K 8.73 4.38 0.00 1.82 1.62 0.00 1.79 0.00 0.00 1.63 0.00 0.00 2.85 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.14 0.82 7.81 63 V 8.35 4.54 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 0.68 0.00 0.00 0.84 0.00 0.00 64 T 8.25 4.13 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 1.17 0.00 0.00 65 C 9.13 4.61 0.00 3.14 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 66 K 9.48 3.73 0.00 1.82 2.00 0.00 1.81 0.00 0.00 1.79 0.00 0.00 3.04 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.47 1.41 7.81 67 N 8.13 4.67 0.00 2.85 2.87 0.00 0.00 6.23 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 8.41 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 8.20 4.09 0.00 2.22 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.57 0.00 0.00 0.00 0.00 0.00 2.53 2.29 0.00 70 G 8.35 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 71 N 7.78 4.56 0.00 2.99 3.09 0.00 0.00 6.12 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 7.40 5.33 0.00 2.80 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 73 Y 9.07 5.21 0.00 2.67 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 74 K 9.22 5.03 0.00 1.73 1.64 0.00 1.60 0.00 0.00 1.65 0.00 0.00 2.71 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.31 1.33 7.81 75 S 8.91 4.67 0.00 3.95 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 76 N 9.43 4.51 0.00 2.78 2.96 0.00 0.00 6.75 7.08 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 77 S 7.79 5.06 0.00 3.83 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 78 S 8.36 4.50 0.00 3.79 3.69 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 79 M 9.46 4.90 0.00 1.89 2.00 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 2.53 2.51 0.00 80 H 9.28 5.02 0.00 3.43 3.19 0.00 5.56 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 I 9.32 5.25 1.98 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.30 1.02 0.00 0.00 82 T 9.00 5.05 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 1.25 0.00 0.00 83 D 9.14 5.17 0.00 2.60 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 8.84 5.60 0.00 2.74 2.77 0.00 0.00 0.00 0.00 0.00 0.00 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 9.21 5.35 0.00 1.90 1.79 0.00 3.14 0.00 0.00 3.12 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.60 0.00 86 L 8.87 4.10 0.00 1.72 1.52 0.55 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 87 T 8.19 4.39 4.22 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 1.25 0.00 0.00 88 N 8.99 4.44 0.00 2.72 2.90 0.00 0.00 6.92 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 89 G 7.40 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 0.00 0.00 0.00 90 S 7.94 4.20 0.00 3.80 3.69 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 91 R 8.49 4.32 0.00 1.72 1.77 0.00 3.30 0.00 0.00 3.15 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.58 0.00 92 Y 8.50 3.90 0.00 3.00 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 93 P 0.00 2.97 0.00 1.75 1.21 0.00 3.62 0.00 0.00 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.73 0.00 94 N 7.67 4.37 0.00 2.86 2.76 0.00 0.00 7.02 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 95 C 8.25 4.49 0.00 3.04 2.97 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 96 A 8.18 4.96 1.20 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 0.00 0.00 97 Y 9.86 5.21 0.00 2.77 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 98 R 9.59 4.54 0.00 1.87 2.01 0.00 3.09 0.00 0.00 3.20 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.64 0.00 99 T 8.64 4.91 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 1.29 0.00 0.00 100 S 9.48 4.69 0.00 3.85 3.72 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 0.00 101 P 0.00 5.06 0.00 2.12 1.90 0.00 3.75 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.07 0.00 102 K 9.22 4.67 0.00 1.76 1.94 0.00 1.28 0.00 0.00 1.67 0.00 0.00 2.94 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.33 1.43 7.81 103 E 8.74 5.21 0.00 1.81 1.83 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 2.07 2.32 0.00 104 R 8.84 4.73 0.00 1.74 2.00 0.00 3.42 0.00 0.00 3.19 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.80 0.00 105 H 8.90 4.84 0.00 3.14 3.22 0.00 5.55 0.00 0.00 0.00 0.00 6.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 I 8.66 4.99 1.85 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 1.31 1.34 1.19 0.00 0.00 107 I 8.23 5.02 1.67 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 1.17 0.89 0.86 0.00 0.00 108 V 8.74 4.80 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 0.66 0.00 0.00 0.83 0.00 0.00 109 A 8.71 5.03 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 0.00 110 C 8.77 5.72 0.00 2.22 1.79 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 0.00 111 E 8.04 4.66 0.00 2.02 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 2.09 2.18 0.00 112 G 10.09 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 0.00 113 S 8.15 4.39 0.00 3.82 3.77 0.00 0.00 0.00 0.00 0.00 0.00 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 2.30 2.13 0.00 3.84 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.00 0.00 115 Y 8.43 4.79 0.00 2.92 2.92 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 0.00 116 V 7.87 4.42 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 0.67 0.00 0.00 0.86 0.00 0.00 117 P 0.00 4.44 0.00 0.49 1.00 0.00 3.32 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 1.67 1.75 0.00 118 V 7.90 4.49 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 0.58 0.00 0.00 0.87 0.00 0.00 119 H 7.76 4.73 0.00 3.25 3.11 0.00 5.85 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 F 8.97 4.57 0.00 2.63 2.64 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 0.00 121 D 8.07 4.52 0.00 2.63 2.50 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 0.00 122 A 6.26 4.53 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 0.00 123 S 8.80 5.13 0.00 4.05 4.07 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 0.00 124 V 8.79 4.43 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 0.94 0.00 0.00 0.92 0.00 0.00 125 E 8.95 4.60 0.00 2.00 1.85 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 2.19 2.28 0.00 126 D 8.61 5.01 0.00 2.76 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 0.00 127 S 7.82 4.16 0.00 3.97 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