NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -2 R 4.1604 8.2431 119.6938 57.5016 31.3655 174.9464 -1 G 3.5430 8.8086 110.3297 45.5958 0.0000 171.8749 0 S 3.7720 7.9757 116.9782 58.6753 63.3479 172.0251 1 M 5.1222 8.3017 124.1850 54.6131 35.1576 173.5789 2 I 5.0022 9.2614 127.0006 58.8318 40.3899 174.2516 3 Q 5.1845 8.7193 125.9970 54.2470 32.4526 173.7491 4 A 4.7222 9.3783 128.6593 50.7969 21.1449 175.8224 5 T 4.7133 8.1735 119.8474 62.9134 70.3390 173.9528 6 F 5.2365 9.1267 126.6850 55.9104 41.4546 175.1688 7 I 5.3876 8.1695 123.4013 58.7701 40.0258 174.6382 8 R 4.5713 8.5613 126.2853 54.6724 32.6710 173.7906 9 R 4.7240 8.3140 128.0498 54.4338 31.3639 175.9890 10 K 3.6113 8.9535 128.8601 57.3591 29.7654 177.1566 11 G 4.0917 8.0807 107.4617 45.6546 0.0000 172.7091 12 I 4.4474 7.2779 113.0569 58.4880 39.6607 175.0652 13 L 4.2686 8.1910 123.3589 54.9500 42.0881 176.5529 14 E 4.9138 8.6139 120.7472 56.8454 32.5390 175.4541 15 S 5.4992 8.0129 112.3406 58.8887 66.5622 173.5862 16 V 5.0220 7.8054 115.4753 61.8596 34.1468 171.6060 17 E 4.8514 8.3903 121.9897 54.5250 32.8157 174.7139 18 L 5.2738 8.7066 123.3889 52.0957 45.0008 175.4373 19 T 5.0664 8.6929 118.0133 61.7529 70.2934 174.2008 20 G 4.1418 9.5425 117.6208 45.8627 0.0000 174.3617 21 H 4.1498 8.2989 113.3645 57.1555 28.6249 174.9456 22 A 4.4356 7.9006 123.3244 51.3196 20.8219 176.6707 23 G 3.9016 8.6659 106.3932 44.9038 0.0000 172.1404 24 S 5.3719 7.5027 111.9442 58.4281 64.3766 172.8233 25 G 4.6569 8.4977 117.1882 45.2420 0.0000 173.2718 26 E 5.0459 6.3189 114.2361 56.2665 34.2730 175.0417 27 Y 4.5085 7.7867 117.8295 58.9586 38.4649 178.1091 28 G 3.7516 8.2676 109.4997 48.0810 0.0000 174.4136 29 F 2.7258 7.5085 122.0762 60.6504 39.5220 176.5754 30 D 4.0185 7.3845 118.0103 57.6381 40.8474 179.1952 31 I 3.4421 6.9794 119.2877 64.5726 36.9795 178.5886 32 V 3.4604 7.3410 118.6762 66.0395 31.2272 177.8032 33 C 3.8448 7.3015 115.7318 62.7233 27.8086 175.7947 34 A 3.8819 8.2969 122.4129 54.9319 17.8788 179.6591 35 A 3.8917 7.6682 118.9618 55.2422 18.4447 180.1086 36 V 3.5556 7.9865 117.0768 66.3571 31.6279 178.4746 37 S 4.1560 8.3863 115.1974 61.6843 62.4716 177.0245 38 T 3.8419 7.7024 118.5647 66.7218 68.4519 176.8226 39 L 4.0647 7.8946 120.8270 57.9753 41.1640 179.9985 40 S 3.7716 8.5688 115.4088 61.9011 62.9400 176.7222 41 M 4.0217 8.4038 121.6561 57.9979 31.5348 178.4372 42 N 4.2436 8.3645 117.9050 56.5145 39.1643 176.6627 43 L 3.7383 7.5562 121.3433 57.9808 41.8976 179.2021 44 V 3.3918 7.2029 117.5978 65.9904 31.4151 177.8808 45 N 4.2986 8.0127 115.8671 56.1999 38.3917 177.4223 46 A 3.9761 8.6596 122.5483 54.8453 18.3983 179.7668 47 L 3.8851 7.7786 117.8836 57.7443 41.4552 179.2792 48 E 4.0825 7.6165 119.5234 58.6624 29.7095 178.7674 49 V 3.6947 7.6926 117.0905 65.9398 31.8229 177.0173 50 L 4.1444 7.6773 116.6089 57.1273 42.0349 177.7959 51 A 4.1744 8.1204 118.4957 52.0229 18.5136 176.7481 52 D 4.3714 8.0728 113.5356 54.7315 38.8392 172.5139 53 C 4.6743 8.0019 119.5518 57.6010 33.0581 172.9332 54 T 4.2853 8.3939 121.9776 61.4021 67.9379 173.4896 55 V 4.4471 7.9280 127.2092 61.0212 34.6282 175.1432 56 S 4.4110 8.4017 123.0588 58.3212 63.4691 173.5202 57 L 4.8477 8.0131 126.7367 53.5169 44.8863 175.1304 58 Q 4.5376 8.1031 116.5891 55.7459 32.1717 172.2295 59 M 6.0352 8.9910 124.9713 54.8300 36.7005 174.4056 60 D 4.6661 8.7400 121.4713 51.3456 41.0311 175.6868 61 E 3.7162 8.7867 125.3470 59.4829 29.7049 178.3856 62 F 4.6433 7.2660 115.9775 57.3102 40.4393 174.4395 63 D 4.3483 9.7315 118.6997 55.7193 37.9043 175.3873 64 G 4.1399 7.9044 109.2437 44.9314 0.0000 173.3302 65 G 4.2093 8.0465 107.4274 44.7320 0.0000 172.2164 66 Y 5.2563 8.5733 122.5893 56.3675 42.1131 173.4041 67 M 4.9911 9.6835 126.1366 52.8384 35.7034 175.6679 68 K 4.8673 7.9396 122.7878 56.0318 34.0474 173.7621 69 I 4.2727 8.0076 127.4239 59.9739 38.5649 174.1029 70 D 5.3515 8.8909 126.7765 52.4567 44.5489 175.9112 71 L 4.8447 9.4923 122.6516 54.0559 43.5703 178.4703 72 S 3.9332 8.3671 116.1989 61.1276 62.7187 174.9412 73 Y 4.8494 7.5236 114.2734 57.5109 38.7797 174.9052 74 I 4.2533 7.7993 123.0006 60.1926 37.9595 176.3094 75 T 3.8510 8.8056 121.3495 65.2854 67.3326 173.8712 76 N 4.8819 8.1020 117.0149 52.5702 37.5588 176.8284 77 K 3.9962 8.3151 121.3781 60.3837 32.5295 178.0477 78 S 4.3679 7.9199 113.5138 59.3549 63.6146 174.4265 79 D 4.3804 7.9532 120.6971 54.8917 42.1714 177.0009 80 E 4.0262 8.8951 125.7664 59.2873 29.5628 179.6748 81 K 3.9413 8.7893 119.0413 59.5546 32.0670 179.2470 82 V 3.6239 8.1791 117.8845 66.4877 31.2491 177.9274 83 Q 4.1754 8.2645 117.4933 58.4413 28.4874 178.3590 84 L 3.9467 8.1515 121.6395 58.2935 42.3135 178.8440 85 L 4.0195 7.7786 118.4438 57.9678 41.5414 179.5193 86 F 4.5003 8.1942 120.4296 61.2942 39.3717 176.9788 87 E 3.8955 8.6144 118.4053 59.6017 29.3337 179.3522 88 A 4.0379 8.3159 120.6667 55.0543 18.3953 179.4522 89 F 4.4124 8.2426 118.9112 61.4119 39.4543 177.1826 90 L 3.2673 8.0807 120.1528 57.4520 41.7449 178.7877 91 L 3.9034 7.9175 120.6496 57.8729 42.0759 178.9628 92 G 3.6302 8.4288 106.0090 48.1678 0.0000 175.6558 93 I 3.6743 7.5992 122.9496 63.9494 37.0918 178.8754 94 T 3.8334 7.6395 116.6359 66.7188 68.2381 176.6318 95 N 4.3372 8.1900 118.3942 56.2102 38.5741 177.1900 96 L 3.5468 8.0940 121.5294 58.1793 41.9067 178.7850 97 A 4.1770 7.8468 119.9295 54.2515 18.2259 179.2845 98 E 3.8904 7.6786 117.1039 59.6131 29.9226 178.4177 99 N 4.6109 8.8436 116.1634 55.0544 40.1780 175.7266 100 S 5.0395 7.7377 114.5316 54.6490 63.2515 172.5739 101 P 4.7708 0.0000 0.0000 64.7745 31.8758 178.9644 102 E 3.9614 8.0847 115.2855 58.0961 29.9530 177.8104 103 F 5.3408 7.7397 117.8106 57.5489 42.0568 175.5896 104 V 5.0988 8.1559 117.2312 61.3820 34.5573 175.1086 105 T 4.8967 9.2638 122.6833 61.8862 72.7710 172.7979 106 A 5.3434 8.6063 126.0481 50.2772 22.3470 175.3423 107 K 4.7232 9.4346 120.6266 55.1289 36.6951 175.6787 108 I 5.0417 8.4530 121.8598 59.9882 39.9028 174.4142 109 M 4.6350 8.9684 126.3616 53.7854 32.8226 175.6806 110 T 4.9993 8.4930 113.9781 60.3693 71.4279 174.7503 111 Q 4.2416 8.8002 121.1069 56.2055 29.2923 175.3475 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 R 8.24 4.16 0.00 1.79 1.91 0.00 3.34 0.00 0.00 3.20 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.57 0.00 -1 G 8.81 3.54 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 0.00 0.00 0.00 0.00 0 S 7.98 3.77 0.00 3.76 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 1 M 8.30 5.12 0.00 2.02 1.93 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.67 0.00 2 I 9.26 5.00 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 1.24 1.78 1.07 0.00 0.00 3 Q 8.72 5.18 0.00 2.13 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.86 0.00 0.00 0.00 0.00 0.00 2.32 2.49 0.00 4 A 9.38 4.72 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 5 T 8.17 4.71 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 1.22 0.00 0.00 6 F 9.13 5.24 0.00 3.04 2.85 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 0.00 0.00 0.00 7 I 8.17 5.39 1.90 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 1.12 2.15 0.96 0.00 0.00 8 R 8.56 4.57 0.00 1.77 1.73 0.00 3.08 0.00 0.00 3.21 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.54 0.00 9 R 8.31 4.72 0.00 1.79 1.94 0.00 3.44 0.00 0.00 3.39 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.54 0.00 10 K 8.95 3.61 0.00 1.99 1.79 0.00 1.87 0.00 0.00 1.82 0.00 0.00 2.91 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.39 1.42 7.81 11 G 8.08 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 0.00 0.00 0.00 12 I 7.28 4.45 2.09 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 1.50 1.02 0.91 0.00 0.00 13 L 8.19 4.27 0.00 0.80 0.63 0.26 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 14 E 8.61 4.91 0.00 1.92 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 2.21 2.31 0.00 15 S 8.01 5.50 0.00 3.90 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 0.00 16 V 7.81 5.02 2.22 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 0.96 0.00 0.00 -0.11 0.00 0.00 17 E 8.39 4.85 0.00 1.89 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 0.00 2.35 2.31 0.00 18 L 8.71 5.27 0.00 1.27 1.33 0.95 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 19 T 8.69 5.07 4.53 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 1.32 0.00 0.00 20 G 9.54 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 21 H 8.30 4.15 0.00 3.23 3.44 0.00 5.50 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 A 7.90 4.44 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 23 G 8.67 3.90 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 0.00 0.00 0.00 24 S 7.50 5.37 0.00 3.90 3.88 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 25 G 8.50 4.66 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 0.00 26 E 6.32 5.05 0.00 2.40 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 0.00 2.23 2.27 0.00 27 Y 7.79 4.51 0.00 3.09 2.91 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 28 G 8.27 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 0.00 0.00 0.00 29 F 7.51 2.73 0.00 2.83 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 30 D 7.38 4.02 0.00 2.82 2.59 0.00 0.00 0.00 0.00 0.00 0.00 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 I 6.98 3.44 1.68 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.68 0.75 0.00 0.00 32 V 7.34 3.46 1.77 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 1.13 0.00 0.00 0.64 0.00 0.00 33 C 7.30 3.84 0.00 2.80 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 34 A 8.30 3.88 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 A 7.67 3.89 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 36 V 7.99 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 1.12 0.00 0.00 0.99 0.00 0.00 37 S 8.39 4.16 0.00 3.90 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 38 T 7.70 3.84 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 1.21 0.00 0.00 39 L 7.89 4.06 0.00 2.07 2.06 0.96 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 40 S 8.57 3.77 0.00 4.00 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 41 M 8.40 4.02 0.00 1.93 2.15 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 2.57 2.77 0.00 42 N 8.36 4.24 0.00 2.89 2.94 0.00 0.00 6.71 7.51 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 43 L 7.56 3.74 0.00 1.38 1.20 0.79 -0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 44 V 7.20 3.39 2.08 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 0.87 0.00 0.00 0.81 0.00 0.00 45 N 8.01 4.30 0.00 2.87 2.80 0.00 0.00 6.95 6.96 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 46 A 8.66 3.98 1.32 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 0.00 0.00 0.00 47 L 7.78 3.89 0.00 1.84 1.82 0.72 0.73 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 48 E 7.62 4.08 0.00 1.87 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 2.29 2.14 0.00 49 V 7.69 3.69 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 0.87 0.00 0.00 0.94 0.00 0.00 50 L 7.68 4.14 0.00 1.77 1.69 0.91 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 51 A 8.12 4.17 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 52 D 8.07 4.37 0.00 2.77 2.73 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 0.00 53 C 8.00 4.67 0.00 3.04 2.85 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 0.00 0.00 0.00 54 T 8.39 4.29 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 1.21 0.00 0.00 55 V 7.93 4.45 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 0.85 0.00 0.00 0.81 0.00 0.00 56 S 8.40 4.41 0.00 3.82 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 57 L 8.01 4.85 0.00 1.56 1.52 0.80 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 58 Q 8.10 4.54 0.00 2.16 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.58 0.00 0.00 0.00 0.00 0.00 2.45 2.37 0.00 59 M 8.99 6.04 0.00 1.88 1.88 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.30 0.00 60 D 8.74 4.67 0.00 2.88 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 61 E 8.79 3.72 0.00 1.31 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 2.13 2.11 0.00 62 F 7.27 4.64 0.00 3.12 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 63 D 9.73 4.35 0.00 2.93 2.74 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 0.00 0.00 0.00 0.00 64 G 7.90 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 65 G 8.05 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 0.00 0.00 0.00 0.00 66 Y 8.57 5.26 0.00 3.08 3.09 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 67 M 9.68 4.99 0.00 1.76 1.66 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.18 0.00 68 K 7.94 4.87 0.00 1.39 1.56 0.00 1.60 0.00 0.00 0.61 0.00 0.00 3.07 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.40 1.37 7.81 69 I 8.01 4.27 1.68 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.71 0.59 0.00 0.00 70 D 8.89 5.35 0.00 2.70 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 71 L 9.49 4.84 0.00 1.86 1.63 0.99 0.50 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 72 S 8.37 3.93 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 73 Y 7.52 4.85 0.00 2.99 2.91 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 74 I 7.80 4.25 1.89 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.96 1.03 0.00 0.00 75 T 8.81 3.85 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 76 N 8.10 4.88 0.00 2.92 3.01 0.00 0.00 5.95 7.10 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 77 K 8.32 4.00 0.00 1.89 2.24 0.00 1.66 0.00 0.00 1.86 0.00 0.00 3.01 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.53 1.44 7.81 78 S 7.92 4.37 0.00 3.89 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 79 D 7.95 4.38 0.00 2.71 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 80 E 8.90 4.03 0.00 2.06 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 2.41 2.41 0.00 81 K 8.79 3.94 0.00 2.04 1.86 0.00 1.57 0.00 0.00 1.69 0.00 0.00 2.99 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.50 7.81 82 V 8.18 3.62 2.32 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 1.18 0.00 0.00 0.94 0.00 0.00 83 Q 8.26 4.18 0.00 2.15 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.59 0.00 0.00 0.00 0.00 0.00 2.58 2.53 0.00 84 L 8.15 3.95 0.00 1.87 1.81 0.93 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 85 L 7.78 4.02 0.00 1.77 1.72 0.90 1.10 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 86 F 8.19 4.50 0.00 3.26 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 87 E 8.61 3.90 0.00 2.29 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 2.58 2.47 0.00 88 A 8.32 4.04 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.24 4.41 0.00 3.20 3.62 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.08 3.27 0.00 1.25 1.61 -0.51 -0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 91 L 7.92 3.90 0.00 1.86 1.80 0.87 0.84 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 92 G 8.43 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 93 I 7.60 3.67 1.74 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.54 0.99 0.00 0.00 94 T 7.64 3.83 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 1.16 0.00 0.00 95 N 8.19 4.34 0.00 2.76 2.85 0.00 0.00 6.71 6.22 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 96 L 8.09 3.55 0.00 1.84 1.85 0.92 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 97 A 7.85 4.18 1.43 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 0.00 0.00 98 E 7.68 3.89 0.00 2.17 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 0.00 2.32 2.34 0.00 99 N 8.84 4.61 0.00 2.69 2.89 0.00 0.00 6.87 7.45 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 0.00 100 S 7.74 5.04 0.00 4.07 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 0.00 101 P 0.00 4.77 0.00 2.14 2.10 0.00 3.85 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 2.10 2.32 0.00 102 E 8.08 3.96 0.00 1.69 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 1.47 1.47 0.00 103 F 7.74 5.34 0.00 3.24 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 0.00 104 V 8.16 5.10 2.15 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 0.82 0.00 0.00 1.02 0.00 0.00 105 T 9.26 4.90 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 1.24 0.00 0.00 106 A 8.61 5.34 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 0.00 107 K 9.43 4.72 0.00 1.85 1.90 0.00 1.16 0.00 0.00 1.83 0.00 0.00 3.01 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.33 1.46 7.81 108 I 8.45 5.04 1.86 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 0.69 0.88 0.00 0.00 109 M 8.97 4.64 0.00 2.10 2.20 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.61 0.00 110 T 8.49 5.00 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 1.19 0.00 0.00 111 Q 8.80 4.24 0.00 1.85 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.58 0.00 0.00 0.00 0.00 0.00 2.28 2.28 0.00