NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 E 4.1366 8.4449 121.4408 55.9000 31.5785 175.9306 3 Q 4.5389 7.5917 116.7049 54.9255 30.8681 173.4164 4 Y 4.5939 9.2501 118.6786 56.8149 40.7376 174.0148 5 Y 5.4936 8.8513 126.4456 55.4925 41.6600 174.5858 6 G 4.1651 6.4907 108.4999 45.5332 0.0000 171.9262 7 T 4.3956 8.4059 119.4511 61.9368 69.9940 174.4387 8 G 4.2040 8.1704 113.3509 44.6621 0.0000 172.2164 9 R 5.0818 7.6839 118.4908 56.1843 33.2411 173.9317 10 R 4.2186 8.5991 121.1090 56.9389 32.9801 174.2294 11 K 3.7204 9.4569 125.0679 58.2092 29.4078 175.0416 12 E 3.7577 8.3947 111.4861 57.3939 27.3456 175.5316 13 A 4.8926 7.4266 122.6254 49.4368 19.1912 177.5712 14 V 4.0980 8.0375 121.1243 63.3022 34.0194 174.7870 15 A 4.6721 8.5596 122.0336 51.1611 21.7526 176.2204 16 R 4.0403 8.5739 121.3297 57.2572 31.8284 176.7757 17 V 4.3167 6.8144 120.2702 61.1162 33.6344 173.6421 18 F 5.1012 9.4235 127.0680 56.0128 39.7094 174.2229 19 L 5.1219 8.7467 126.4898 53.6104 44.6066 175.5833 20 R 5.0322 9.1168 123.8891 53.9139 34.2167 172.8404 21 P 4.0000 0.0000 0.0000 63.8201 32.2346 173.1114 22 G 3.4100 8.2976 116.8908 48.2050 0.0000 174.2076 23 N 4.7401 10.1650 119.5900 52.1620 40.0959 174.2964 24 G 4.4679 7.3292 116.9839 45.0946 0.0000 172.8689 25 K 3.9647 7.7588 122.8152 56.9923 33.5146 175.4724 26 V 4.7042 8.6142 128.2289 61.6685 33.8340 174.0242 27 T 5.1727 8.9197 125.2557 61.8867 71.2115 174.0047 28 V 4.6496 7.8608 124.1742 61.3183 34.3841 174.7076 29 N 4.0006 9.6192 127.7551 54.2727 36.9923 175.6744 30 G 4.0914 8.1744 106.8992 45.6021 0.0000 173.9054 31 Q 3.4413 8.4242 117.8376 55.6082 27.8568 172.7347 32 D 5.3027 8.0608 114.8594 52.4204 45.2857 176.6083 33 F 4.5111 8.7478 125.8581 61.8906 39.3611 177.4302 34 N 4.4099 8.4230 113.4530 55.1877 38.3966 176.4497 35 E 4.1825 7.8849 120.1756 58.9536 30.2202 177.1482 36 Y 4.3476 8.4736 118.4361 59.5530 39.0667 175.9007 37 F 4.1266 7.5757 121.3983 56.0872 38.4562 174.9941 38 Q 4.3564 8.1747 126.8778 55.2599 30.7937 175.1142 39 G 3.8475 9.1222 114.2967 46.4253 0.0000 172.5852 40 L 4.7329 7.6160 118.2512 51.9817 44.8540 178.0231 41 V 3.8082 8.3726 122.3940 65.3987 31.5282 178.0091 42 R 3.9981 7.9802 116.7264 58.0857 29.9726 178.1620 43 A 3.7889 7.5605 120.4696 55.4246 18.5302 180.0612 44 V 3.8318 7.5294 110.0723 63.8143 31.6056 178.5720 45 A 4.1133 7.7943 120.8676 54.6617 18.0364 179.4026 46 A 4.0511 7.7096 118.5537 54.7527 18.7155 178.8234 47 L 4.1723 7.3300 115.2252 54.9935 41.6946 178.1411 48 E 4.0038 8.0336 122.3461 59.0680 29.3916 177.1214 49 P 3.8998 0.0000 0.0000 65.7567 31.2472 178.3279 50 L 3.8764 7.8629 118.7827 57.4262 41.5211 179.2901 51 R 4.0757 7.8247 117.0559 58.4558 29.9523 178.5166 52 A 4.0427 7.7078 120.3374 54.7243 18.5305 179.3329 53 V 3.9686 7.3928 108.7915 61.4844 32.1022 175.8577 54 D 4.4751 8.0037 116.6347 55.1890 38.7028 174.4593 55 A 4.7230 7.8147 116.5777 50.8448 18.8663 176.6160 56 L 3.9101 7.5558 125.8314 57.1944 43.1529 178.0223 57 G 3.9260 7.4559 113.2073 43.6185 0.0000 172.8029 58 R 4.4964 7.6936 119.2354 57.8859 34.0565 173.1050 59 F 5.0545 7.8567 116.0812 56.2644 44.0559 172.9201 60 D 5.3948 9.7625 123.5605 52.3686 42.1558 175.8125 61 A 4.7843 8.5493 125.6040 51.3504 21.6967 175.7801 62 Y 5.9109 8.7396 121.0887 57.2559 41.2959 173.2669 63 I 4.7527 8.2155 127.1397 59.9010 40.5285 175.1527 64 T 5.6988 8.6719 123.1747 60.9800 68.3992 172.1181 65 V 4.6954 7.9279 123.4089 60.4155 33.1815 175.7977 66 R 4.5351 8.6025 123.5022 55.4784 34.3376 175.9221 67 G 3.7714 9.2601 112.8710 45.2230 0.0000 173.8448 68 G 3.8557 8.4674 108.7516 44.7859 0.0000 173.5009 69 G 3.9729 8.0511 105.3218 43.1926 0.0000 174.5020 70 K 4.0157 8.4048 119.7667 59.7551 32.1567 178.6060 71 S 4.2866 8.1475 113.0456 61.1805 62.4239 175.9591 72 G 3.7664 8.2124 108.0587 47.8760 0.0000 175.5084 73 Q 4.1158 8.0200 120.3737 58.9222 28.7202 178.7315 74 I 3.7308 7.4351 120.3377 64.6588 37.3159 178.3353 75 D 4.3507 8.2668 119.3759 57.0025 40.5662 178.7587 76 A 4.0142 7.9541 121.6679 55.2681 18.3391 179.7986 77 I 3.6895 8.3239 118.8050 63.9782 36.6290 178.5328 78 K 4.0558 8.0831 120.7764 59.7127 32.1330 178.7073 79 L 4.2543 7.9418 120.1224 57.6579 42.0807 179.1158 80 G 3.4311 8.1453 106.0029 47.8831 0.0000 175.8205 81 I 3.6218 8.0671 122.8734 63.6269 36.9933 178.4458 82 A 3.8620 7.6122 120.5151 55.3840 18.1747 180.0387 83 R 3.9170 7.9456 116.0882 58.8800 29.7679 179.3356 84 A 4.6171 7.6825 121.4753 54.7600 18.3634 179.4629 85 L 4.1420 7.9190 118.4730 58.6320 40.5944 179.5186 86 V 4.1445 7.8419 121.1898 63.4907 31.2716 178.0704 87 Q 4.0175 7.6752 120.1362 58.6881 28.8700 176.5209 88 Y 4.2669 7.2068 115.0109 57.2520 38.1526 175.8455 89 N 4.8092 8.0991 119.7467 50.8849 40.6880 173.4430 90 P 4.3356 0.0000 0.0000 65.7121 31.7220 178.0732 91 D 4.4046 8.1932 118.1790 57.0970 40.7492 177.5854 92 Y 4.0737 8.2247 115.9088 59.7210 38.1076 177.3785 93 R 4.0768 7.7983 119.7074 58.4415 30.0339 177.0810 94 A 4.4456 7.5957 118.4468 52.5001 18.5019 177.6674 95 K 4.5106 7.5654 113.3502 55.4558 33.9785 177.1357 96 L 4.1836 7.6691 121.2721 56.5365 42.3829 178.1936 97 K 4.0412 7.8705 119.3732 59.1639 32.0596 177.1779 98 P 4.3879 0.0000 0.0000 65.2196 31.3528 177.6232 99 L 4.5024 7.4796 117.3587 54.3226 42.4154 173.4243 100 G 3.8182 8.7731 113.5253 46.1699 0.0000 172.5905 101 F 4.6133 8.4900 121.2268 58.5019 44.8505 176.2704 102 L 4.4249 7.8539 121.0146 53.2264 39.7566 174.9103 103 T 4.4098 7.4485 115.5028 62.3433 72.6945 174.6985 104 R 3.9356 8.7546 126.3722 56.8678 30.3534 174.9164 105 D 4.2301 7.8702 117.9392 54.6882 39.0119 173.3569 106 A 3.9445 8.1881 124.8596 53.8597 18.8699 178.0155 107 R 3.9499 7.3307 114.6822 56.9667 30.0914 176.5166 108 V 4.5519 7.8907 114.8875 59.3418 35.7706 175.3885 109 V 3.7022 8.3423 116.1345 61.7290 31.9255 175.7744 110 E 4.6306 8.2719 121.1366 53.9263 31.8724 175.6171 111 R 3.8265 8.2763 120.0382 56.0836 30.5079 176.0336 112 K 4.1477 8.5310 126.2052 55.9801 31.6475 176.6266 113 K 4.1230 8.4459 126.6969 56.2051 32.6909 176.6929 114 Y 4.5157 7.9859 119.8607 57.9056 38.8870 175.1771 115 G 4.3308 8.9953 111.2503 45.8326 0.0000 174.1155 116 K 4.4529 6.9231 117.6618 55.6530 34.2203 175.2090 117 H 4.8732 8.2782 113.9926 57.3721 31.3708 175.1807 118 K 4.4713 7.7119 119.1744 54.9394 32.8522 177.8032 119 A 4.0772 8.9568 121.5889 53.0415 17.9721 179.0884 120 R 4.5417 7.9295 111.6485 57.5653 36.4173 175.5777 121 R 3.7863 8.1036 120.0486 56.6761 30.0824 175.0922 122 A 4.7782 8.3014 128.5971 49.8191 20.3703 174.8634 123 P 4.4092 0.0000 0.0000 62.4802 31.8077 176.1714 124 Q 3.9751 8.6437 118.4158 56.4465 28.7898 176.5774 125 Y 4.2716 8.5252 124.4518 58.0161 39.4675 174.8472 126 S 4.3865 6.8138 117.8804 57.6593 65.6417 173.6320 127 K 4.4043 8.0550 117.6216 56.8779 36.3145 175.9219 128 R 4.0770 8.0783 121.5100 56.6186 29.9364 176.1258 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 8.44 4.14 0.00 1.93 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 2.20 2.34 0.00 3 Q 7.59 4.54 0.00 2.15 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.09 6.73 0.00 0.00 0.00 0.00 0.00 2.59 2.53 0.00 4 Y 9.25 4.59 0.00 2.80 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 5 Y 8.85 5.49 0.00 2.97 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 6 G 6.49 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 0.00 0.00 0.00 0.00 7 T 8.41 4.40 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 1.22 0.00 0.00 8 G 8.17 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 0.00 0.00 0.00 9 R 7.68 5.08 0.00 1.77 1.75 0.00 3.12 0.00 0.00 2.25 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.39 0.00 10 R 8.60 4.22 0.00 1.79 1.71 0.00 3.55 0.00 0.00 3.34 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.43 0.00 11 K 9.46 3.72 0.00 1.95 1.88 0.00 1.97 0.00 0.00 1.71 0.00 0.00 2.84 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.35 1.45 7.81 12 E 8.39 3.76 0.00 2.11 2.03 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 2.23 2.29 0.00 13 A 7.43 4.89 1.38 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 14 V 8.04 4.10 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 0.98 0.00 0.00 0.95 0.00 0.00 15 A 8.56 4.67 1.21 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 16 R 8.57 4.04 0.00 1.95 1.78 0.00 3.41 0.00 0.00 3.50 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.68 0.00 17 V 6.81 4.32 1.74 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 0.90 0.00 0.00 0.78 0.00 0.00 18 F 9.42 5.10 0.00 3.64 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 19 L 8.75 5.12 0.00 1.89 1.60 0.52 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 20 R 9.12 5.03 0.00 1.80 1.83 0.00 3.24 0.00 0.00 3.20 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.75 0.00 21 P 0.00 4.00 0.00 1.82 1.58 0.00 3.84 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.34 0.00 22 G 8.30 3.41 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 0.00 23 N 10.17 4.74 0.00 2.83 2.67 0.00 0.00 6.62 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 24 G 7.33 4.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 K 7.76 3.96 0.00 1.88 1.89 0.00 1.70 0.00 0.00 1.77 0.00 0.00 2.99 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.56 1.50 7.81 26 V 8.61 4.70 2.17 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 0.98 0.00 0.00 0.96 0.00 0.00 27 T 8.92 5.17 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 28 V 7.86 4.65 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 0.81 0.00 0.00 1.12 0.00 0.00 29 N 9.62 4.00 0.00 2.77 2.72 0.00 0.00 6.58 7.64 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 30 G 8.17 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 31 Q 8.42 3.44 0.00 2.22 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.92 6.73 0.00 0.00 0.00 0.00 0.00 2.24 2.29 0.00 32 D 8.06 5.30 0.00 2.75 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 33 F 8.75 4.51 0.00 3.33 3.17 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 0.00 34 N 8.42 4.41 0.00 2.81 2.93 0.00 0.00 6.81 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 35 E 7.88 4.18 0.00 1.99 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 2.31 2.46 0.00 36 Y 8.47 4.35 0.00 2.74 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 37 F 7.58 4.13 0.00 2.58 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 38 Q 8.17 4.36 0.00 1.88 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.44 0.00 0.00 0.00 0.00 0.00 2.18 2.28 0.00 39 G 9.12 3.85 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 0.00 0.00 0.00 40 L 7.62 4.73 0.00 1.68 1.54 0.96 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 41 V 8.37 3.81 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 1.08 0.00 0.00 0.93 0.00 0.00 42 R 7.98 4.00 0.00 1.89 1.94 0.00 3.19 0.00 0.00 3.33 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.69 0.00 43 A 7.56 3.79 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 44 V 7.53 3.83 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 0.92 0.00 0.00 1.04 0.00 0.00 45 A 7.79 4.11 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 46 A 7.71 4.05 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 47 L 7.33 4.17 0.00 1.96 1.59 0.09 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 48 E 8.03 4.00 0.00 2.38 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 0.00 2.49 2.75 0.00 49 P 0.00 3.90 0.00 2.11 2.01 0.00 3.74 0.00 0.00 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.27 0.00 50 L 7.86 3.88 0.00 1.81 1.67 0.78 0.40 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 51 R 7.82 4.08 0.00 2.00 1.98 0.00 3.14 0.00 0.00 3.36 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.83 0.00 52 A 7.71 4.04 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 53 V 7.39 3.97 2.21 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 0.83 0.00 0.00 0.92 0.00 0.00 54 D 8.00 4.48 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 55 A 7.81 4.72 1.44 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 0.00 0.00 0.00 56 L 7.56 3.91 0.00 1.62 1.65 0.93 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 57 G 7.46 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 58 R 7.69 4.50 0.00 1.79 1.70 0.00 3.04 0.00 0.00 3.23 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 1.25 0.00 59 F 7.86 5.05 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 60 D 9.76 5.39 0.00 2.72 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 61 A 8.55 4.78 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 62 Y 8.74 5.91 0.00 3.13 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 63 I 8.22 4.75 1.87 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.52 0.98 0.00 0.00 64 T 8.67 5.70 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 65 V 7.93 4.70 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 0.71 0.00 0.00 1.05 0.00 0.00 66 R 8.60 4.54 0.00 1.92 1.75 0.00 3.28 0.00 0.00 3.18 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.63 0.00 67 G 9.26 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 0.00 0.00 0.00 68 G 8.47 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 0.00 0.00 0.00 69 G 8.05 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 70 K 8.40 4.02 0.00 1.85 1.82 0.00 1.03 0.00 0.00 1.56 0.00 0.00 2.83 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.43 1.59 7.81 71 S 8.15 4.29 0.00 3.96 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 72 G 8.21 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 0.00 0.00 0.00 73 Q 8.02 4.12 0.00 2.53 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.75 0.00 0.00 0.00 0.00 0.00 2.47 2.85 0.00 74 I 7.44 3.73 2.02 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.00 0.85 0.00 0.00 75 D 8.27 4.35 0.00 2.71 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 76 A 7.95 4.01 1.44 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 0.00 0.00 0.00 77 I 8.32 3.69 2.01 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.06 0.88 0.00 0.00 78 K 8.08 4.06 0.00 1.91 2.02 0.00 1.55 0.00 0.00 1.48 0.00 0.00 2.40 0.00 0.00 2.63 0.00 0.00 0.00 0.00 1.48 1.51 7.81 79 L 7.94 4.25 0.00 1.77 1.64 0.92 0.97 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 80 G 8.15 3.43 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 0.00 81 I 8.07 3.62 1.80 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.02 0.75 0.00 0.00 82 A 7.61 3.86 1.42 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 0.00 0.00 83 R 7.95 3.92 0.00 1.93 1.95 0.00 3.30 0.00 0.00 3.15 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.76 0.00 84 A 7.68 4.62 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 85 L 7.92 4.14 0.00 1.65 1.57 0.86 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 86 V 7.84 4.14 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 1.13 0.00 0.00 1.00 0.00 0.00 87 Q 7.68 4.02 0.00 2.42 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 7.32 0.00 0.00 0.00 0.00 0.00 2.33 2.42 0.00 88 Y 7.21 4.27 0.00 2.57 2.76 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 89 N 8.10 4.81 0.00 2.86 2.82 0.00 0.00 6.80 7.34 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 90 P 0.00 4.34 0.00 2.28 2.31 0.00 3.78 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 2.12 2.07 0.00 91 D 8.19 4.40 0.00 2.81 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 92 Y 8.22 4.07 0.00 3.14 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 93 R 7.80 4.08 0.00 1.91 2.10 0.00 3.10 0.00 0.00 3.18 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 94 A 7.60 4.45 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 95 K 7.57 4.51 0.00 1.71 1.76 0.00 1.30 0.00 0.00 1.67 0.00 0.00 2.93 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.05 1.49 7.81 96 L 7.67 4.18 0.00 1.80 1.63 -0.09 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 97 K 7.87 4.04 0.00 2.01 1.89 0.00 1.63 0.00 0.00 1.68 0.00 0.00 3.04 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.45 1.55 7.81 98 P 0.00 4.39 0.00 2.08 2.12 0.00 3.70 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 2.15 2.15 0.00 99 L 7.48 4.50 0.00 2.10 2.13 1.13 1.12 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 0.00 100 G 8.77 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 0.00 101 F 8.49 4.61 0.00 3.09 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 0.00 102 L 7.85 4.42 0.00 1.68 1.66 0.95 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 103 T 7.45 4.41 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 1.25 0.00 0.00 104 R 8.75 3.94 0.00 1.77 1.95 0.00 3.63 0.00 0.00 3.21 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.56 0.00 105 D 7.87 4.23 0.00 2.85 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.19 3.94 1.29 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 0.00 107 R 7.33 3.95 0.00 1.79 1.93 0.00 3.13 0.00 0.00 3.38 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.66 0.00 108 V 7.89 4.55 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 0.71 0.00 0.00 0.95 0.00 0.00 109 V 8.34 3.70 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 0.72 0.00 0.00 0.94 0.00 0.00 110 E 8.27 4.63 0.00 2.05 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 2.18 2.26 0.00 111 R 8.28 3.83 0.00 1.80 1.89 0.00 3.27 0.00 0.00 3.18 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 112 K 8.53 4.15 0.00 1.77 1.76 0.00 1.88 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.53 1.49 7.81 113 K 8.45 4.12 0.00 1.69 1.46 0.00 1.64 0.00 0.00 1.82 0.00 0.00 2.91 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.55 1.32 7.81 114 Y 7.99 4.52 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 0.00 115 G 9.00 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 0.00 0.00 0.00 0.00 116 K 6.92 4.45 0.00 1.70 1.93 0.00 1.64 0.00 0.00 1.67 0.00 0.00 2.73 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.48 1.48 7.81 117 H 8.28 4.87 0.00 3.36 3.29 0.00 5.66 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 K 7.71 4.47 0.00 1.78 1.73 0.00 1.75 0.00 0.00 1.83 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.47 7.81 119 A 8.96 4.08 1.45 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 0.00 0.00 120 R 7.93 4.54 0.00 1.77 1.89 0.00 3.17 0.00 0.00 3.14 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.54 0.00 121 R 8.10 3.79 0.00 1.81 1.86 0.00 3.35 0.00 0.00 3.37 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.58 0.00 122 A 8.30 4.78 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 0.00 123 P 0.00 4.41 0.00 2.26 2.24 0.00 3.84 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.04 0.00 124 Q 8.64 3.98 0.00 2.08 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 7.01 0.00 0.00 0.00 0.00 0.00 2.40 2.38 0.00 125 Y 8.53 4.27 0.00 2.90 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 0.00 126 S 6.81 4.39 0.00 3.83 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 0.00 127 K 8.06 4.40 0.00 1.56 1.67 0.00 1.81 0.00 0.00 1.67 0.00 0.00 2.77 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.28 1.40 7.81 128 R 8.08 4.08 0.00 1.80 1.83 0.00 3.44 0.00 0.00 3.25 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.57 0.00