NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4523 8.3044 120.3580 54.8509 34.0652 175.3307 2 N 4.7106 7.9410 115.1985 51.3536 41.6102 171.7133 3 Y 4.3948 9.1100 127.2354 56.1529 41.0840 173.4693 4 K 3.6922 8.3111 125.3694 56.3828 29.0432 175.9494 5 K 4.4903 7.3008 116.1050 54.7377 34.5339 174.1155 6 P 4.7414 0.0000 0.0000 62.2491 33.0035 175.0662 7 K 5.1417 8.7229 118.7884 55.6860 36.8829 174.7082 8 L 4.5786 8.6469 119.6465 52.7777 45.2932 176.4930 9 L 4.6702 8.3596 122.0682 53.9264 42.6691 175.2266 10 Y 4.9009 8.2844 126.1016 56.3345 40.5829 173.8353 11 C 4.5327 6.8844 124.3703 56.6194 31.1495 174.2302 12 S 3.3930 7.5457 116.9579 60.7349 63.3724 176.3636 13 N 4.2527 7.6330 119.0648 55.9404 38.6585 175.2897 14 G 3.8293 8.0124 103.1604 44.9948 0.0000 172.4703 15 G 3.3257 10.1035 108.9030 45.3743 0.0000 171.6606 16 H 4.5150 7.1598 119.0092 54.9998 34.2613 172.0913 17 F 5.9914 9.1961 119.9407 55.3047 41.2246 175.1098 18 L 4.7974 8.6481 125.6188 54.8224 42.6628 175.9511 19 R 4.8522 9.1177 122.9523 54.3940 32.9930 174.6028 20 I 4.9604 8.0471 120.2101 59.6723 40.1728 175.2237 21 L 4.6320 8.9255 127.3714 52.6668 43.6928 175.8232 22 P 4.7199 0.0000 0.0000 63.5208 31.5007 176.2105 23 D 4.5840 8.0203 117.6410 53.8353 41.5609 175.4224 24 G 3.8116 7.9676 104.4441 47.8617 0.0000 173.8024 25 T 4.8084 7.6191 113.7120 61.3682 73.0799 174.4043 26 V 5.2578 8.5817 123.3769 60.1954 34.1970 174.0750 27 D 4.8196 8.6231 125.9133 52.0012 43.1343 174.5612 28 G 4.2933 8.2414 106.5646 46.0728 0.0000 173.2090 29 T 4.3677 8.5128 111.4080 60.8068 71.6004 173.7974 30 R 4.2824 8.5974 129.1276 56.2861 30.6573 176.2572 31 D 4.8216 7.7935 117.6085 51.6668 41.8151 175.3896 32 R 4.1937 8.7912 125.6305 59.1774 30.4747 178.1593 33 S 4.1332 8.3476 111.2578 61.0712 62.3499 173.9324 34 D 4.3304 8.1415 119.1992 55.2869 41.1915 177.4654 35 Q 4.4014 8.2481 127.9758 53.0310 27.5270 172.9928 36 H 4.5247 8.4110 127.7314 56.6168 34.7316 176.1390 37 I 3.6928 8.4493 111.9704 64.0147 35.7882 175.1550 38 Q 4.0553 7.8807 119.6529 56.4028 28.8598 175.3186 39 L 4.8969 8.3095 123.5472 52.8334 45.4291 175.8652 40 Q 4.6501 8.5026 121.1606 54.4212 30.5059 174.6567 41 L 4.8907 8.4491 124.6113 53.9029 42.8669 176.4663 42 S 4.8582 9.0703 117.8055 56.8281 67.9079 172.5302 43 A 5.1637 8.6033 123.2607 49.9351 20.0546 175.6688 44 E 4.4202 9.1193 122.8071 57.1759 31.3833 175.6030 45 S 4.8135 7.5074 112.5221 55.6862 66.8202 173.4109 46 V 3.7184 8.3126 121.4772 63.2507 31.3568 176.2573 47 G 3.9604 9.0557 112.1352 45.9785 0.0000 171.7648 48 E 5.2009 8.4332 118.7197 54.2982 33.1380 175.5709 49 V 4.8414 9.0841 116.1356 59.9908 36.7111 173.8848 50 Y 5.0531 9.7935 121.3329 56.2769 41.0254 174.7533 51 I 4.7812 8.0489 121.2641 59.5397 40.0110 174.8636 52 K 5.1617 8.3687 124.8997 54.6645 35.9914 175.5476 53 S 4.7530 9.7377 119.2180 57.9674 63.5899 174.5331 54 T 4.3240 7.9258 113.9189 61.5791 69.0396 174.5400 55 E 4.3068 8.1354 122.3732 58.3911 30.8682 176.8319 56 T 4.1555 7.7580 106.6327 65.0397 69.6489 176.3691 57 G 4.2434 6.9321 111.5525 45.5210 0.0000 173.3311 58 Q 4.4708 8.3360 117.1094 53.8839 32.6090 174.3194 59 Y 5.1036 7.5255 118.3922 56.2458 41.0163 175.0383 60 L 4.4927 9.2925 126.3412 54.8802 43.0818 175.4604 61 A 5.4070 8.6069 127.4773 49.2705 23.1839 174.0304 62 M 4.8923 8.5557 119.7152 53.9326 33.8223 176.1923 63 D 5.1340 8.6874 128.1244 54.4326 42.5752 175.9577 64 T 4.7132 8.5936 106.5256 64.0337 69.3891 175.2369 65 D 4.3603 8.0676 120.6221 55.1924 41.3326 177.1358 66 G 3.3866 7.7374 107.1730 44.9486 0.0000 173.9239 67 L 4.5122 7.3883 119.1350 54.4559 42.5735 175.4276 68 L 5.1740 8.1421 120.4744 54.1642 43.3761 175.5125 69 Y 4.8746 8.7411 119.6542 55.8502 42.0042 173.6786 70 G 4.2800 8.8384 108.1984 45.6512 0.0000 173.2785 71 S 4.8899 8.8203 121.3420 57.6044 63.3948 175.1163 72 Q 3.7017 8.9546 127.8049 58.2204 29.2291 175.8749 73 T 4.7193 7.4635 105.6176 58.4675 71.7210 171.6010 74 P 4.7470 0.0000 0.0000 62.7478 31.3317 175.1590 75 N 5.1970 8.6541 121.1316 51.0620 42.3215 174.5773 76 E 3.6108 8.9710 122.2051 59.6302 29.6508 179.6358 77 E 3.9275 8.2632 117.7656 59.3401 29.2386 178.7509 78 C 5.0498 9.3255 116.9229 61.2822 28.8146 172.9150 79 L 4.0643 7.8316 122.9798 54.0726 42.9541 175.7850 80 F 5.1207 8.9900 123.5907 55.8094 43.8651 173.5244 81 L 5.5672 9.3583 121.1061 52.6283 43.4102 175.3915 82 E 5.9032 8.8181 124.4297 54.1072 31.8711 174.7770 83 R 4.7513 8.2564 123.0730 54.7254 35.6560 173.5769 84 L 4.6686 8.5066 122.5220 54.1949 42.5414 175.4950 85 E 4.7840 8.8717 126.4366 54.5040 32.6362 175.9771 86 E 4.1247 8.5926 120.8683 57.6524 30.1356 177.7010 87 N 4.3873 8.7553 116.8183 53.3018 38.3097 172.4186 88 H 3.9893 7.8646 113.0628 57.5221 28.0375 173.3570 89 Y 5.2751 7.8820 116.8756 56.8788 43.1556 175.8633 90 N 5.5688 9.8749 119.7436 52.0257 41.8450 173.9127 91 T 4.9355 7.9901 110.3483 60.2419 73.2304 172.1994 92 Y 5.6517 8.1275 117.6948 56.8307 42.5287 174.3868 93 I 5.4711 8.8535 123.6391 58.0947 41.7288 174.8897 94 S 2.7900 8.3970 120.8611 57.8061 62.9958 173.5229 95 K 3.8608 8.3732 129.1041 58.1489 31.1942 178.6151 96 K 3.6911 7.8898 123.0869 59.3295 33.0972 176.9031 97 H 4.4448 7.3785 113.6450 54.3032 29.0229 173.2896 98 A 4.4924 7.2553 124.8152 53.6588 19.9306 179.8739 99 E 3.8945 7.7021 112.9584 58.5603 29.5925 178.0257 100 K 3.7579 7.3597 116.4520 56.2939 32.7127 176.2251 101 N 3.9166 7.4415 115.8994 54.0736 36.5046 173.4781 102 W 5.4978 7.1302 117.2503 54.1481 32.4724 176.4639 103 F 5.7113 9.1025 122.5838 54.9208 41.6588 176.1020 104 V 4.0022 8.5811 122.4966 61.9727 30.8605 174.8078 105 G 4.3502 8.3016 113.5734 44.1460 0.0000 168.5689 106 L 5.3570 8.4539 118.1764 53.0377 45.6476 177.3535 107 K 4.3272 9.4655 120.9724 55.4975 33.8947 177.4771 108 K 4.0514 8.3646 119.0414 58.6646 32.3034 177.1431 109 N 4.5350 8.0772 115.3610 53.2746 39.2807 174.2312 110 G 3.6180 7.6178 103.8305 47.5633 0.0000 173.3847 111 S 5.1540 7.6150 113.9965 55.8529 66.5564 173.9167 112 C 4.4251 8.6294 118.2756 58.3387 30.2905 172.8165 113 K 4.3088 9.5046 126.0277 55.3121 32.0393 176.2646 114 R 3.7092 8.6720 126.1851 56.0060 30.9268 177.3326 115 G 3.3757 8.3438 112.1169 48.2470 0.0000 175.1664 116 P 4.5769 0.0000 0.0000 62.0415 31.0342 177.1481 117 R 4.6437 7.6234 113.0054 57.4255 32.5586 175.1716 118 T 4.6865 7.6401 107.3643 60.6386 71.1037 172.3966 119 H 4.6568 7.7147 117.8207 55.3038 32.7236 172.2606 120 Y 4.3481 8.4573 121.9926 58.6977 39.0240 175.2781 121 G 3.7403 8.3412 113.9434 45.2585 0.0000 173.6107 122 Q 4.2855 7.3253 118.8915 54.9696 30.1788 175.9619 123 K 4.1560 8.3771 120.5012 56.4510 32.4514 177.9609 124 A 4.2222 7.7404 121.5076 54.4705 19.5013 179.3724 125 I 3.5412 7.5394 108.0592 63.6834 37.7681 175.9212 126 L 4.0762 7.0782 118.7405 55.0609 41.7299 176.9270 127 F 5.6823 9.9376 124.0566 54.5726 42.8011 174.5528 128 L 5.1428 8.5395 123.6478 52.5738 44.8455 173.6585 129 P 5.5663 0.0000 0.0000 62.2890 31.6816 175.8260 130 L 4.6163 8.4363 125.4530 52.9180 43.6066 174.5305 131 P 4.8254 0.0000 0.0000 62.7742 32.0535 175.8241 132 V 4.3815 8.1412 122.2243 60.5417 34.9588 171.5444 133 S 3.5871 8.8039 123.2499 57.8936 62.7541 170.7866 134 S 4.7160 8.5707 121.3992 56.3911 64.3158 172.8037 135 D 4.7265 8.4256 126.0179 52.1875 42.9562 175.8987 136 L 4.1515 8.5174 125.3694 56.1768 41.7900 176.9727 137 E 3.6381 8.4713 110.4466 58.0495 26.0075 171.7096 138 H 4.7787 8.2766 118.3205 54.4686 31.5098 172.6408 139 H 4.8632 8.7229 123.1115 54.0413 31.8246 171.9673 140 H 4.9566 8.2509 114.9907 53.8154 31.4952 172.0834 141 H 4.4723 8.5777 119.0852 55.5541 30.4705 173.4860 142 H 4.8224 8.3294 125.6874 54.3690 31.4889 174.2237 143 H 4.2416 8.7327 121.3673 56.4173 28.4726 175.2533 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 M 8.30 4.45 0.00 2.02 2.19 0.00 0.00 0.00 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.64 0.00 2 N 7.94 4.71 0.00 2.77 2.67 0.00 0.00 6.68 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 3 Y 9.11 4.39 0.00 2.92 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 4 K 8.31 3.69 0.00 1.54 1.68 0.00 1.57 0.00 0.00 1.54 0.00 0.00 2.54 0.00 0.00 2.31 0.00 0.00 0.00 0.00 1.24 1.26 7.81 5 K 7.30 4.49 0.00 1.75 1.73 0.00 1.86 0.00 0.00 1.81 0.00 0.00 3.12 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.39 1.70 7.81 6 P 0.00 4.74 0.00 2.06 2.14 0.00 3.81 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.92 0.00 7 K 8.72 5.14 0.00 1.86 1.84 0.00 1.26 0.00 0.00 1.72 0.00 0.00 2.84 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.29 1.58 7.81 8 L 8.65 4.58 0.00 0.59 0.77 0.00 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 9 L 8.36 4.67 0.00 1.58 1.52 0.95 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 10 Y 8.28 4.90 0.00 3.13 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 11 C 6.88 4.53 0.00 2.86 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 12 S 7.55 3.39 0.00 4.04 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 13 N 7.63 4.25 0.00 2.77 2.86 0.00 0.00 7.17 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 14 G 8.01 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 15 G 10.10 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 0.00 0.00 0.00 16 H 7.16 4.51 0.00 2.97 3.11 0.00 5.80 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 F 9.20 5.99 0.00 3.05 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 0.00 18 L 8.65 4.80 0.00 1.72 1.64 1.03 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 19 R 9.12 4.85 0.00 1.90 2.03 0.00 2.92 0.00 0.00 3.30 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.54 0.00 20 I 8.05 4.96 1.82 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 1.33 0.66 0.96 0.00 0.00 21 L 8.93 4.63 0.00 1.54 1.57 0.93 0.83 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 22 P 0.00 4.72 0.00 2.20 2.20 0.00 3.39 0.00 0.00 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.96 0.00 23 D 8.02 4.58 0.00 2.64 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 G 7.97 3.81 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 0.00 25 T 7.62 4.81 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 1.25 0.00 0.00 26 V 8.58 5.26 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 1.15 0.00 0.00 1.01 0.00 0.00 27 D 8.62 4.82 0.00 2.78 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 28 G 8.24 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 0.00 0.00 0.00 0.00 29 T 8.51 4.37 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 1.39 0.00 0.00 30 R 8.60 4.28 0.00 1.45 1.69 0.00 3.05 0.00 0.00 3.01 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 1.25 0.00 31 D 7.79 4.82 0.00 2.70 2.56 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.79 4.19 0.00 1.91 2.06 0.00 3.45 0.00 0.00 3.18 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.73 0.00 33 S 8.35 4.13 0.00 3.85 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 34 D 8.14 4.33 0.00 2.73 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 35 Q 8.25 4.40 0.00 2.08 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.77 0.00 0.00 0.00 0.00 0.00 2.31 2.55 0.00 36 H 8.41 4.52 0.00 3.30 3.19 0.00 5.62 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 37 I 8.45 3.69 1.93 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.65 1.05 0.00 0.00 38 Q 7.88 4.06 0.00 1.98 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.75 0.00 0.00 0.00 0.00 0.00 2.31 2.30 0.00 39 L 8.31 4.90 0.00 1.56 1.51 0.93 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 40 Q 8.50 4.65 0.00 1.97 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.82 0.00 0.00 0.00 0.00 0.00 2.26 2.42 0.00 41 L 8.45 4.89 0.00 1.51 1.59 0.88 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 42 S 9.07 4.86 0.00 3.79 3.71 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 43 A 8.60 5.16 1.25 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 0.00 0.00 44 E 9.12 4.42 0.00 2.16 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 0.00 2.25 2.37 0.00 45 S 7.51 4.81 0.00 3.94 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 46 V 8.31 3.72 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 0.78 0.00 0.00 0.94 0.00 0.00 47 G 9.06 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 0.00 0.00 0.00 48 E 8.43 5.20 0.00 1.98 1.69 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 2.16 2.36 0.00 49 V 9.08 4.84 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 0.92 0.00 0.00 1.04 0.00 0.00 50 Y 9.79 5.05 0.00 2.81 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 51 I 8.05 4.78 1.64 0.00 0.00 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.70 0.78 0.00 0.00 52 K 8.37 5.16 0.00 1.81 1.95 0.00 1.53 0.00 0.00 1.55 0.00 0.00 2.64 0.00 0.00 2.50 0.00 0.00 0.00 0.00 0.74 1.48 7.81 53 S 9.74 4.75 0.00 4.01 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 54 T 7.93 4.32 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 1.20 0.00 0.00 55 E 8.14 4.31 0.00 1.78 1.59 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 1.94 2.19 0.00 56 T 7.76 4.16 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 1.30 0.00 0.00 57 G 6.93 4.24 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 0.00 58 Q 8.34 4.47 0.00 2.01 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.57 7.29 0.00 0.00 0.00 0.00 0.00 2.28 2.34 0.00 59 Y 7.53 5.10 0.00 2.93 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 0.00 60 L 9.29 4.49 0.00 1.68 1.56 0.87 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 61 A 8.61 5.41 0.92 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 62 M 8.56 4.89 0.00 2.15 2.25 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.69 0.00 63 D 8.69 5.13 0.00 3.14 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 64 T 8.59 4.71 4.45 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 1.40 0.00 0.00 65 D 8.07 4.36 0.00 2.68 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 66 G 7.74 3.39 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 0.00 67 L 7.39 4.51 0.00 1.78 1.64 0.87 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 68 L 8.14 5.17 0.00 1.55 1.57 0.96 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 69 Y 8.74 4.87 0.00 2.96 3.05 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 70 G 8.84 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 0.00 0.00 0.00 0.00 71 S 8.82 4.89 0.00 4.13 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 72 Q 8.95 3.70 0.00 2.03 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.55 0.00 0.00 0.00 0.00 0.00 2.31 2.28 0.00 73 T 7.46 4.72 4.33 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 1.24 0.00 0.00 74 P 0.00 4.75 0.00 2.19 1.96 0.00 3.84 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.06 0.00 75 N 8.65 5.20 0.00 2.90 2.77 0.00 0.00 7.23 7.72 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 76 E 8.97 3.61 0.00 2.06 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 2.39 2.39 0.00 77 E 8.26 3.93 0.00 2.11 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 2.49 2.42 0.00 78 C 9.33 5.05 0.00 3.30 3.29 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 0.00 79 L 7.83 4.06 0.00 0.85 1.43 0.29 0.60 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 80 F 8.99 5.12 0.00 2.86 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 81 L 9.36 5.57 0.00 1.46 1.68 0.83 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 82 E 8.82 5.90 0.00 2.44 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 2.24 2.37 0.00 83 R 8.26 4.75 0.00 1.78 1.78 0.00 3.17 0.00 0.00 3.28 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.63 0.00 84 L 8.51 4.67 0.00 1.69 1.63 0.95 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 85 E 8.87 4.78 0.00 2.21 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 2.53 0.00 86 E 8.59 4.12 0.00 2.14 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 0.00 2.43 2.36 0.00 87 N 8.76 4.39 0.00 2.94 3.22 0.00 0.00 6.95 8.06 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 88 H 7.86 3.99 0.00 3.29 3.05 0.00 5.79 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 Y 7.88 5.28 0.00 2.91 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 90 N 9.87 5.57 0.00 2.66 2.60 0.00 0.00 6.76 7.72 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 91 T 7.99 4.94 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 1.29 0.00 0.00 92 Y 8.13 5.65 0.00 2.88 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 93 I 8.85 5.47 1.73 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.24 1.78 0.64 0.00 0.00 94 S 8.40 2.79 0.00 3.44 3.58 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 95 K 8.37 3.86 0.00 1.89 1.55 0.00 1.63 0.00 0.00 1.55 0.00 0.00 2.73 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.30 1.54 7.81 96 K 7.89 3.69 0.00 1.75 1.81 0.00 1.76 0.00 0.00 1.73 0.00 0.00 2.95 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.37 1.45 7.81 97 H 7.38 4.44 0.00 2.64 2.00 0.00 5.66 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 98 A 7.26 4.49 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 99 E 7.70 3.89 0.00 1.79 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 2.22 2.22 0.00 100 K 7.36 3.76 0.00 0.79 0.74 0.00 0.97 0.00 0.00 1.40 0.00 0.00 2.64 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.91 0.56 7.81 101 N 7.44 3.92 0.00 2.91 2.94 0.00 0.00 6.81 8.35 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 0.00 102 W 7.13 5.50 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 0.00 103 F 9.10 5.71 0.00 2.81 2.84 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 0.00 104 V 8.58 4.00 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 0.81 0.00 0.00 0.96 0.00 0.00 105 G 8.30 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 0.00 0.00 0.00 106 L 8.45 5.36 0.00 1.50 1.65 0.98 0.99 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 0.00 107 K 9.47 4.33 0.00 1.79 1.73 0.00 1.63 0.00 0.00 1.55 0.00 0.00 2.85 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.41 1.35 7.81 108 K 8.36 4.05 0.00 1.68 1.79 0.00 1.77 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.38 1.34 7.81 109 N 8.08 4.53 0.00 2.66 2.75 0.00 0.00 7.01 7.96 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 0.00 110 G 7.62 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 0.00 0.00 0.00 111 S 7.62 5.15 0.00 3.73 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 0.00 112 C 8.63 4.43 0.00 3.00 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 0.00 113 K 9.50 4.31 0.00 1.68 1.81 0.00 1.82 0.00 0.00 1.69 0.00 0.00 3.12 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.39 1.39 7.81 114 R 8.67 3.71 0.00 1.86 1.67 0.00 3.18 0.00 0.00 3.28 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.63 0.00 115 G 8.34 3.38 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 0.00 0.00 0.00 0.00 116 P 0.00 4.58 0.00 2.10 2.20 0.00 3.03 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.12 0.00 117 R 7.62 4.64 0.00 1.93 1.86 0.00 3.24 0.00 0.00 3.25 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.60 0.00 118 T 7.64 4.69 4.43 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 1.41 0.00 0.00 119 H 7.71 4.66 0.00 3.19 3.19 0.00 5.61 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 Y 8.46 4.35 0.00 2.81 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 0.00 121 G 8.34 3.74 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 0.00 0.00 0.00 122 Q 7.33 4.29 0.00 1.96 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.92 6.77 0.00 0.00 0.00 0.00 0.00 2.27 2.30 0.00 123 K 8.38 4.16 0.00 1.78 1.93 0.00 1.52 0.00 0.00 1.83 0.00 0.00 3.11 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.43 1.41 7.81 124 A 7.74 4.22 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 0.00 125 I 7.54 3.54 1.48 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.51 0.37 0.00 0.00 126 L 7.08 4.08 0.00 1.22 1.36 1.05 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 127 F 9.94 5.68 0.00 2.83 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 0.00 128 L 8.54 5.14 0.00 2.28 1.79 1.16 0.96 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 0.00 129 P 0.00 5.57 0.00 2.21 2.26 0.00 3.57 0.00 0.00 4.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.08 0.00 130 L 8.44 4.62 0.00 1.56 1.58 0.88 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 131 P 0.00 4.83 0.00 2.06 2.05 0.00 3.68 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.96 0.00 132 V 8.14 4.38 1.90 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 0.61 0.00 0.00 0.81 0.00 0.00 133 S 8.80 3.59 0.00 3.98 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 0.00 134 S 8.57 4.72 0.00 3.84 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 D 8.43 4.73 0.00 2.63 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 0.00 136 L 8.52 4.15 0.00 1.64 1.69 0.93 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 137 E 8.47 3.64 0.00 2.07 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 2.31 0.00 138 H 8.28 4.78 0.00 3.09 3.13 0.00 5.67 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 H 8.72 4.86 0.00 3.06 3.17 0.00 5.89 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 H 8.25 4.96 0.00 3.15 3.20 0.00 5.54 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 H 8.58 4.47 0.00 3.09 3.22 0.00 5.71 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 H 8.33 4.82 0.00 3.07 3.17 0.00 5.99 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 0.00 143 H 8.73 4.24 0.00 3.04 3.21 0.00 5.98 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00