NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2689 8.3144 120.1355 55.5628 33.5650 174.7352 2 E 3.7838 8.5764 120.7567 55.1785 29.8715 175.6799 3 T 4.2573 8.7120 118.2311 61.1505 72.2445 175.1005 4 A 3.9891 8.4989 123.2156 55.2740 18.5400 179.9433 5 A 3.9692 8.0010 118.6422 55.2807 18.5104 179.5725 6 A 4.0163 8.1425 119.3851 55.1196 18.3454 179.7527 7 K 4.0080 8.4219 118.4711 59.5554 32.2757 178.7721 8 F 4.0756 8.4466 120.9555 61.2802 39.3195 176.8983 9 E 4.0168 8.3018 117.8609 59.5641 29.1101 179.3726 10 R 3.9023 7.9250 117.3146 59.6127 30.2156 178.2601 11 Q 3.9471 8.0917 117.0856 58.2211 29.0327 176.4441 12 H 4.6168 7.9167 113.9999 53.9050 31.7591 173.3791 13 M 4.7202 7.9601 118.2368 53.9353 33.6800 176.4507 14 D 4.7580 9.0966 122.7352 52.9240 41.6430 175.6801 15 S 4.4769 8.5314 116.7340 59.3638 63.5964 175.4551 16 S 4.4315 7.9787 114.5390 59.5589 63.3952 174.3006 17 T 4.7473 7.4821 109.8600 59.9575 71.4697 174.0348 18 S 4.2623 8.5914 118.2462 60.5652 63.4580 173.9473 19 A 3.8978 6.9824 119.5116 50.6878 21.3674 175.5446 20 A 3.4755 8.5573 124.0675 52.2014 18.6493 178.2047 21 S 4.6447 8.3886 115.1061 58.0221 64.6448 173.5785 22 S 4.6328 7.4747 114.8875 57.1244 65.3449 175.3494 23 S 4.1909 8.6552 115.6036 61.3790 62.8634 175.0778 24 N 4.6235 7.9477 116.1854 54.0106 39.0381 176.1252 25 Y 3.9920 8.0961 120.1781 61.1778 38.6659 177.6205 26 C 4.2113 8.2529 116.5606 60.0068 39.6624 175.7116 27 N 4.4201 8.2567 117.5786 56.6125 38.1398 177.3473 28 Q 3.9358 7.9684 119.1236 59.2859 28.8545 178.7071 29 M 3.7144 7.7670 119.8853 58.3373 31.8284 178.7193 30 M 4.0462 8.1513 119.3270 58.0842 32.0414 178.8301 31 K 3.9260 7.6487 118.5337 59.7834 32.2803 179.2891 32 S 4.1901 7.9322 113.9065 61.0161 62.7408 175.8571 33 R 4.3013 7.7007 118.4591 55.4674 29.9768 176.1026 34 N 4.3261 7.8527 114.9594 54.5042 34.9171 175.0925 35 L 4.3542 7.9648 117.8281 55.7179 42.1116 178.1446 36 T 5.3915 7.5559 107.1108 60.4149 69.2921 175.0547 37 K 4.1709 8.3790 124.6047 59.8508 32.3492 177.4070 38 D 4.7320 7.9043 116.0247 55.2595 42.3453 176.1642 39 R 3.9800 7.2694 112.9077 55.1466 31.5952 174.5524 40 C 4.6756 8.7273 116.8332 55.9447 39.9534 173.9092 41 K 4.2177 8.0653 127.1924 55.8528 32.4469 175.1309 42 P 4.6465 0.0000 0.0000 65.4653 32.6139 176.4720 43 V 5.1140 7.5541 110.7597 59.9461 35.7933 174.3159 44 N 4.6611 8.8358 119.8604 52.9913 42.6998 173.0820 45 T 4.8500 7.8104 119.8749 61.6281 71.9448 172.7889 46 F 4.8670 8.9875 124.6157 55.6440 42.0880 174.6376 47 V 4.6098 8.9027 122.8904 61.1116 33.4897 175.6700 48 H 5.4890 8.7479 128.6177 53.8029 26.2212 173.3876 49 E 4.8025 7.7003 117.9147 53.2876 34.6493 176.4765 50 S 4.3439 8.3938 115.0033 58.2904 64.9689 174.9630 51 L 4.0001 8.5540 124.7680 58.4774 41.9138 179.2406 52 A 4.2086 8.0007 120.1528 55.3950 18.1330 179.2113 53 D 4.3572 7.9490 116.5498 57.3234 41.1392 178.9140 54 V 3.7925 7.7847 118.4537 66.1001 31.7505 178.1267 55 Q 3.9169 8.5892 118.0090 58.8540 28.5229 178.6653 56 A 4.0603 8.0988 121.4352 54.5323 18.2770 179.6461 57 V 3.4748 7.6491 117.1339 66.0108 31.2996 177.0220 58 C 3.7099 7.7436 114.7439 58.1220 39.9372 174.1900 59 S 4.5631 7.4986 113.9639 58.0023 63.9576 174.8082 60 Q 4.3483 7.3825 121.7290 56.0590 30.5082 177.1357 61 K 4.2827 8.1582 130.7741 56.7357 33.0776 175.6331 62 N 4.4810 8.8028 127.2620 53.6286 39.2512 174.3026 63 V 4.5827 8.3858 117.8552 59.3458 36.8854 174.4930 64 A 4.3073 8.3848 125.2793 52.0987 18.9938 178.5954 65 C 4.6795 8.9591 120.2161 56.2903 41.0869 175.2018 66 K 3.7677 9.1526 121.5508 59.6265 31.5587 178.1491 67 N 4.5970 8.0538 113.1432 52.8160 37.5246 175.6516 68 G 3.9765 8.1631 108.7620 45.6115 0.0000 174.5163 69 Q 4.1658 8.3984 119.0722 56.5222 29.1751 176.6689 70 T 4.5340 8.3270 108.8775 61.6551 69.2490 173.7988 71 N 4.9729 8.0292 117.9432 53.7481 38.6713 174.8707 72 C 5.3431 7.4215 116.2664 56.7887 44.2682 172.4474 73 Y 5.0775 8.7205 117.9018 56.5256 42.2719 173.8281 74 Q 5.1474 9.0756 125.4327 54.0959 31.3939 174.8978 75 S 4.4427 8.7095 121.7668 58.5457 63.2816 174.2810 76 Y 4.4438 8.9444 121.1523 60.6428 37.9069 176.3204 77 S 4.9896 7.8157 112.7290 56.5646 64.6344 174.0030 78 T 4.2307 8.2424 113.5430 61.8767 69.7881 173.5380 79 M 5.0489 8.9459 121.9904 53.3736 36.9114 174.6403 80 S 4.8476 9.2802 117.0916 58.2985 63.5680 173.1002 81 I 5.2382 9.0088 120.3273 59.4720 41.5795 174.2484 82 T 5.0304 8.9515 119.8230 61.9300 71.7566 172.5326 83 D 5.0896 9.1469 127.0416 53.3800 43.3065 174.2491 84 C 5.6781 9.2386 123.0875 55.2323 42.2885 172.9777 85 R 5.3133 8.8749 123.0329 54.1722 33.3226 173.8983 86 E 4.1698 9.1172 127.8761 56.7590 30.5170 176.4989 87 T 4.3988 8.4506 117.1496 60.0986 71.0873 175.9338 88 G 3.6397 8.6403 109.8536 48.1975 0.0000 174.7405 89 S 4.3835 7.4230 112.8854 58.9211 63.3200 174.5300 90 S 4.0482 7.6448 116.6318 57.9976 62.6553 173.6951 91 K 4.2638 8.7088 128.6671 55.3073 33.8386 174.2363 92 Y 4.1813 8.7580 127.8305 57.9857 38.8719 174.2020 93 P 3.3828 0.0000 0.0000 62.6039 32.4266 176.5742 94 N 4.6365 7.8482 119.9669 52.2290 36.9580 173.4754 95 C 4.6016 7.8216 116.6331 56.7165 42.5714 173.4167 96 A 5.0817 8.1773 124.6389 50.4773 22.1827 174.5481 97 Y 5.0553 9.1499 118.2277 56.0637 42.5813 174.8148 98 K 4.4559 9.2046 124.4491 55.9434 33.9879 175.3023 99 T 5.1235 8.5612 123.8547 62.4796 70.2328 174.1113 100 T 4.6251 8.8611 122.7073 61.7797 72.0831 172.6211 101 Q 4.9813 8.7369 127.3278 54.8182 30.8172 174.0960 102 A 4.6569 8.8251 126.0394 51.1614 23.7166 174.6661 103 N 5.3674 8.6917 116.1049 51.7551 40.6756 174.4585 104 K 4.7906 8.7922 122.5010 54.6317 37.4007 175.8283 105 H 4.8044 8.8510 118.8261 55.8964 30.0919 174.5636 106 I 4.8273 8.4057 115.1444 59.3236 40.6587 174.3928 107 I 4.8725 8.1220 124.4277 59.7134 40.0468 175.0593 108 V 4.7801 8.6048 119.3555 59.3499 35.9430 174.3690 109 A 5.0502 8.6896 124.7536 50.9479 20.7933 175.6399 110 C 5.1941 8.6751 118.8313 55.3138 40.6293 173.3023 111 E 4.7393 8.6092 119.8687 55.9522 34.4708 175.3137 112 G 4.0176 9.8418 107.3046 44.8442 0.0000 171.8230 113 N 5.0580 8.1192 115.7395 50.9121 40.6405 172.2607 114 P 4.3260 0.0000 0.0000 62.6279 32.0399 175.7990 115 Y 4.8559 8.3387 123.0080 56.9129 39.0756 174.7169 116 V 4.4561 8.1987 119.4254 58.5426 36.7166 173.3627 117 P 4.5311 0.0000 0.0000 62.8170 31.1633 176.9343 118 V 4.4701 8.5981 115.6074 61.1647 33.9552 175.2561 119 H 5.0764 7.9123 119.9140 54.7071 33.5716 171.5894 120 F 4.5770 8.7998 127.7778 57.4303 39.4891 174.3582 121 D 4.5845 8.3944 126.8400 56.0027 41.8313 175.9284 122 A 4.6661 6.6729 117.0765 51.2513 22.5314 174.6970 123 S 5.2081 8.8074 113.4211 56.7336 65.8702 174.6185 124 V 4.1522 8.6453 115.0528 61.7724 32.1843 175.1270 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 K 8.31 4.27 0.00 1.75 1.85 0.00 1.62 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.35 1.50 7.81 2 E 8.58 3.78 0.00 2.01 1.88 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 2.32 2.38 0.00 3 T 8.71 4.26 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 1.22 0.00 0.00 4 A 8.50 3.99 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 5 A 8.00 3.97 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 A 8.14 4.02 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 7 K 8.42 4.01 0.00 1.93 2.04 0.00 1.66 0.00 0.00 1.60 0.00 0.00 2.94 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.46 1.45 7.81 8 F 8.45 4.08 0.00 3.16 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 9 E 8.30 4.02 0.00 2.33 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 0.00 2.49 2.67 0.00 10 R 7.92 3.90 0.00 1.80 2.08 0.00 3.37 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 1.62 1.67 0.00 11 Q 8.09 3.95 0.00 1.88 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.52 0.00 0.00 0.00 0.00 0.00 2.20 2.36 0.00 12 H 7.92 4.62 0.00 2.08 2.67 0.00 5.61 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 M 7.96 4.72 0.00 1.96 2.17 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.66 0.00 14 D 9.10 4.76 0.00 2.69 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 15 S 8.53 4.48 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 16 S 7.98 4.43 0.00 3.97 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 17 T 7.48 4.75 4.25 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 1.28 0.00 0.00 18 S 8.59 4.26 0.00 3.84 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 19 A 6.98 3.90 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 A 8.56 3.48 0.81 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 0.00 0.00 21 S 8.39 4.64 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 22 S 7.47 4.63 0.00 4.00 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 23 S 8.66 4.19 0.00 4.03 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 24 N 7.95 4.62 0.00 2.82 2.89 0.00 0.00 6.50 7.36 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 25 Y 8.10 3.99 0.00 3.05 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 26 C 8.25 4.21 0.00 3.18 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 27 N 8.26 4.42 0.00 2.91 2.92 0.00 0.00 7.13 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 28 Q 7.97 3.94 0.00 2.03 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.82 0.00 0.00 0.00 0.00 0.00 2.31 2.43 0.00 29 M 7.77 3.71 0.00 0.85 1.23 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.66 0.00 30 M 8.15 4.05 0.00 1.73 1.93 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 2.47 0.00 31 K 7.65 3.93 0.00 1.93 1.89 0.00 1.62 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.41 1.46 7.81 32 S 7.93 4.19 0.00 3.82 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 33 R 7.70 4.30 0.00 1.91 2.06 0.00 3.58 0.00 0.00 3.20 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.92 0.00 34 N 7.85 4.33 0.00 2.90 2.95 0.00 0.00 6.90 7.40 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 35 L 7.96 4.35 0.00 1.81 1.64 0.81 0.43 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 36 T 7.56 5.39 4.39 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 1.38 0.00 0.00 37 K 8.38 4.17 0.00 1.78 1.92 0.00 1.78 0.00 0.00 1.73 0.00 0.00 2.98 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.47 1.51 7.81 38 D 7.90 4.73 0.00 2.68 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 39 R 7.27 3.98 0.00 1.83 1.78 0.00 2.92 0.00 0.00 3.29 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.60 0.00 40 C 8.73 4.68 0.00 3.11 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 41 K 8.07 4.22 0.00 1.94 1.78 0.00 1.75 0.00 0.00 1.66 0.00 0.00 3.08 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.59 1.40 7.81 42 P 0.00 4.65 0.00 2.20 2.32 0.00 3.74 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.02 0.00 43 V 7.55 5.11 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 0.74 0.00 0.00 0.96 0.00 0.00 44 N 8.84 4.66 0.00 2.60 2.27 0.00 0.00 7.06 6.80 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 45 T 7.81 4.85 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 0.89 0.00 0.00 46 F 8.99 4.87 0.00 2.95 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 47 V 8.90 4.61 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 1.17 0.00 0.00 1.01 0.00 0.00 48 H 8.75 5.49 0.00 3.11 3.39 0.00 5.62 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 7.70 4.80 0.00 1.95 1.84 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 2.27 2.28 0.00 50 S 8.39 4.34 0.00 4.07 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 51 L 8.55 4.00 0.00 1.83 1.75 1.03 1.28 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 52 A 8.00 4.21 1.34 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 0.00 0.00 0.00 53 D 7.95 4.36 0.00 2.86 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 7.78 3.79 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 1.24 0.00 0.00 1.04 0.00 0.00 55 Q 8.59 3.92 0.00 2.30 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.32 2.43 0.00 56 A 8.10 4.06 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 57 V 7.65 3.47 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 1.07 0.00 0.00 0.99 0.00 0.00 58 C 7.74 3.71 0.00 2.86 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 59 S 7.50 4.56 0.00 3.94 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 60 Q 7.38 4.35 0.00 1.70 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.93 0.00 0.00 0.00 0.00 0.00 2.09 2.28 0.00 61 K 8.16 4.28 0.00 1.93 1.79 0.00 1.58 0.00 0.00 1.71 0.00 0.00 2.92 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.47 1.43 7.81 62 N 8.80 4.48 0.00 2.79 2.66 0.00 0.00 7.01 7.71 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 63 V 8.39 4.58 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 0.65 0.00 0.00 0.81 0.00 0.00 64 A 8.38 4.31 1.19 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 0.00 0.00 0.00 65 C 8.96 4.68 0.00 3.08 3.01 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 66 K 9.15 3.77 0.00 1.71 1.88 0.00 1.89 0.00 0.00 1.77 0.00 0.00 3.04 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.47 1.57 7.81 67 N 8.05 4.60 0.00 2.81 2.90 0.00 0.00 6.29 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 8.16 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 69 Q 8.40 4.17 0.00 2.09 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.76 0.00 0.00 0.00 0.00 0.00 2.36 2.48 0.00 70 T 8.33 4.53 4.18 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 1.23 0.00 0.00 71 N 8.03 4.97 0.00 3.05 3.15 0.00 0.00 6.08 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 7.42 5.34 0.00 2.84 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 73 Y 8.72 5.08 0.00 2.84 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 74 Q 9.08 5.15 0.00 2.01 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.99 0.00 0.00 0.00 0.00 0.00 2.24 2.25 0.00 75 S 8.71 4.44 0.00 3.92 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 76 Y 8.94 4.44 0.00 3.03 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 77 S 7.82 4.99 0.00 3.94 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 78 T 8.24 4.23 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 1.03 0.00 0.00 79 M 8.95 5.05 0.00 1.95 2.00 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.49 0.00 80 S 9.28 4.85 0.00 3.90 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 81 I 9.01 5.24 1.89 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 1.36 0.77 1.05 0.00 0.00 82 T 8.95 5.03 4.39 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 1.26 0.00 0.00 83 D 9.15 5.09 0.00 2.72 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 C 9.24 5.68 0.00 2.88 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 85 R 8.87 5.31 0.00 1.99 1.78 0.00 3.18 0.00 0.00 3.14 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.65 0.00 86 E 9.12 4.17 0.00 2.11 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 2.14 1.94 0.00 87 T 8.45 4.40 4.21 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 0.00 0.00 1.17 0.00 0.00 88 G 8.64 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 89 S 7.42 4.38 0.00 3.89 3.89 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 90 S 7.64 4.05 0.00 3.83 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 91 K 8.71 4.26 0.00 1.81 1.61 0.00 1.72 0.00 0.00 1.57 0.00 0.00 2.86 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.37 1.39 7.81 92 Y 8.76 4.18 0.00 2.95 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 93 P 0.00 3.38 0.00 1.79 1.23 0.00 3.66 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.75 0.00 94 N 7.85 4.64 0.00 2.84 2.76 0.00 0.00 7.00 7.58 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 95 C 7.82 4.60 0.00 3.14 3.04 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 96 A 8.18 5.08 1.11 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 0.00 0.00 97 Y 9.15 5.06 0.00 2.99 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 98 K 9.20 4.46 0.00 1.85 1.73 0.00 1.64 0.00 0.00 1.68 0.00 0.00 2.87 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.44 1.45 7.81 99 T 8.56 5.12 4.31 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 1.28 0.00 0.00 100 T 8.86 4.63 4.27 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 1.23 0.00 0.00 101 Q 8.74 4.98 0.00 1.95 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.75 0.00 0.00 0.00 0.00 0.00 2.17 2.35 0.00 102 A 8.83 4.66 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 0.00 103 N 8.69 5.37 0.00 2.56 2.74 0.00 0.00 6.67 7.61 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 0.00 104 K 8.79 4.79 0.00 1.73 1.69 0.00 1.71 0.00 0.00 1.70 0.00 0.00 2.89 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.39 1.44 7.81 105 H 8.85 4.80 0.00 3.09 3.23 0.00 5.58 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 I 8.41 4.83 1.80 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.74 1.14 0.00 0.00 107 I 8.12 4.87 1.68 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 1.14 0.72 0.79 0.00 0.00 108 V 8.60 4.78 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 0.67 0.00 0.00 0.82 0.00 0.00 109 A 8.69 5.05 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 0.00 110 C 8.68 5.19 0.00 1.96 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 0.00 111 E 8.61 4.74 0.00 1.84 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 2.25 2.23 0.00 112 G 9.84 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 0.00 0.00 0.00 113 N 8.12 5.06 0.00 2.64 2.69 0.00 0.00 6.92 7.69 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 0.00 114 P 0.00 4.33 0.00 2.09 1.98 0.00 3.74 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.08 0.00 115 Y 8.34 4.86 0.00 2.77 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 0.00 116 V 8.20 4.46 1.94 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 0.70 0.00 0.00 0.89 0.00 0.00 117 P 0.00 4.53 0.00 0.49 1.25 0.00 3.33 0.00 0.00 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.78 0.00 118 V 8.60 4.47 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 0.57 0.00 0.00 0.96 0.00 0.00 119 H 7.91 5.08 0.00 3.28 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 8.80 4.58 0.00 2.68 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 0.00 121 D 8.39 4.58 0.00 2.60 2.57 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 0.00 0.00 0.00 0.00 122 A 6.67 4.67 1.16 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 0.00 0.00 0.00 0.00 0.00 0.00 123 S 8.81 5.21 0.00 4.02 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 0.00 124 V 8.65 4.15 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 0.65 0.00 0.00 0.97 0.00 0.00