NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5114 8.3049 120.6250 55.3030 34.4189 174.6997 2 T 4.3990 8.1499 114.8110 61.6634 70.8569 172.1190 3 Q 4.8897 8.6520 125.7489 55.6800 30.8598 174.2613 4 C 4.8324 9.2023 127.7321 58.2677 32.3181 172.5901 5 P 4.3698 0.0000 0.0000 64.6745 31.5645 177.2137 6 R 4.2715 8.0929 119.0039 58.5213 30.5587 176.7888 7 C 4.2561 7.9987 109.6616 58.3635 30.3717 174.3616 8 Q 3.8817 8.4501 118.0197 56.0545 26.6965 173.6132 9 R 4.2306 7.5387 117.6466 56.0897 31.6327 175.2876 10 N 5.1318 8.6555 120.4131 52.8678 39.4438 174.5834 11 L 4.9233 9.3709 123.1836 52.6969 46.7661 176.3411 12 A 4.5745 8.6197 123.9140 51.6418 19.4760 178.3772 13 A 4.1784 8.8444 122.7291 55.6098 18.3418 179.5224 14 D 4.5320 8.0554 112.3563 54.8353 39.8814 176.2645 15 E 4.1078 8.3896 120.9041 56.1665 29.9291 174.9823 16 F 4.9450 7.6208 115.7211 56.2887 41.7970 174.7674 17 Y 4.6116 8.3237 119.4272 57.7240 38.5190 176.0544 18 A 4.3106 9.6538 124.9924 53.8228 19.4594 178.7632 19 G 3.9916 7.7438 106.0913 45.1836 0.0000 174.2188 20 S 4.4751 8.4424 117.9605 58.5207 63.4341 174.4662 21 S 4.2828 7.7768 117.6009 58.9917 63.0782 174.1800 22 K 4.4080 8.5150 122.9137 57.3375 33.0403 177.1799 23 M 4.3845 7.9712 116.3225 54.7353 32.1174 176.4268 24 C 4.1695 8.4645 116.7328 57.6436 32.0582 174.8930 25 K 3.8119 8.5322 121.1808 59.3839 31.3808 180.0158 26 G 3.6456 7.9793 105.5412 48.0296 0.0000 175.4630 27 C 4.2906 8.0040 118.8797 62.7410 28.2904 175.7354 28 M 4.0714 8.3112 119.8492 58.9994 31.7934 178.4381 29 T 3.8049 8.4143 116.4117 66.1678 68.5132 176.4851 30 W 3.4427 8.4009 130.6351 60.2171 30.6888 177.6747 31 Q 3.6195 8.1488 119.5058 59.2231 28.4507 178.2097 32 N 4.2095 8.0042 117.3172 56.0518 38.5051 177.0227 33 L 3.3117 7.5468 121.9451 58.0136 41.9740 179.1638 34 S 3.5476 7.0299 114.7592 61.5275 62.6332 175.9540 35 Y 3.9338 7.7504 121.9367 60.8535 38.5172 177.9692 36 N 4.2456 8.7330 117.3092 56.2042 38.5958 177.1609 37 A 4.1270 8.0451 122.1945 55.3862 18.6845 179.2859 38 N 4.1795 7.9694 115.5339 56.5747 38.7744 177.0380 39 K 3.8163 7.9114 120.6117 58.8689 32.3561 177.7787 40 E 4.3380 8.1010 116.1306 55.4338 29.9424 176.3702 41 G 3.7484 7.4377 105.9162 46.7078 0.0000 172.9930 42 H 5.0400 8.1166 116.0318 53.6069 30.5295 175.5168 43 A 4.2669 8.5366 123.4002 52.2417 20.0165 176.3630 44 N 5.4715 8.5622 117.6776 52.6852 40.6698 173.9751 45 T 4.4627 8.9291 116.5205 61.7527 69.8528 175.6346 46 F 4.2927 8.0949 121.9745 58.1267 39.7087 175.4057 47 T 4.5609 8.2369 114.5229 59.8777 71.9929 175.7615 48 K 2.0000 7.7539 121.6163 59.0210 32.0575 178.4880 49 A 3.8935 7.6738 120.5119 55.3520 18.2580 179.5225 50 T 3.8909 7.6589 107.9850 64.9706 68.8491 176.4186 51 F 3.9423 8.5432 124.1294 60.9138 39.2255 177.1111 52 L 3.8972 8.1850 118.6615 57.6210 41.1340 179.4162 53 A 3.9783 7.7451 119.8592 54.7727 18.3911 179.1729 54 W 4.1756 8.3274 126.3930 60.8214 30.9191 177.4158 55 Y 3.8916 8.3351 118.8254 59.2962 38.6257 177.7180 56 G 3.4861 7.8797 108.8614 46.5012 0.0000 172.7674 57 L 4.7970 7.6829 120.8352 52.3334 45.4780 177.0211 58 S 3.8924 9.2654 116.4047 61.6299 62.2448 176.7024 59 A 4.0674 7.7489 120.4436 54.1528 18.3536 177.8249 60 Q 4.2466 7.8235 113.5506 56.6306 29.6911 176.1069 61 R 4.0667 7.3020 118.7130 56.0642 30.9686 175.4882 62 H 5.2345 8.4152 119.9568 53.6859 33.2548 172.8305 63 C 4.2089 9.1673 123.2054 59.5696 32.0975 174.6608 64 G 3.6325 9.1113 115.0088 47.1372 0.0000 173.5795 65 Y 4.6014 7.8984 117.2046 59.6409 39.1848 177.1328 66 C 4.6691 8.3322 111.0374 57.7985 30.7570 174.6585 67 G 3.9901 8.2876 108.5807 45.2246 0.0000 173.7215 68 I 4.0348 7.6050 120.5902 60.7672 38.8499 175.4391 69 S 4.5869 8.4708 122.1332 57.6502 65.1520 175.0114 70 E 3.9106 8.3981 123.3580 59.6132 29.3742 179.2176 71 A 4.0593 7.9625 120.3430 54.8959 18.2758 179.6200 72 G 3.4763 8.0331 103.5319 47.9800 0.0000 175.3466 73 F 4.0330 8.5443 124.0285 61.1262 38.8876 177.0982 74 T 4.0449 8.2308 115.7841 66.7572 68.0654 176.2426 75 S 4.1221 7.5736 113.9083 60.2342 63.2372 175.8586 76 L 3.8736 7.3341 122.0475 55.2993 42.0543 176.1106 77 H 3.8457 7.4357 115.1635 56.6488 26.8636 175.2553 78 R 4.2144 7.3392 117.1674 56.1158 31.1773 176.2722 79 T 5.1057 8.2169 110.6415 59.7968 71.1521 174.0447 80 N 4.8849 8.9860 122.1118 51.2925 38.7438 174.2608 81 P 4.4573 0.0000 0.0000 65.1417 31.3500 177.8290 82 R 4.0130 7.9952 115.1443 56.3708 30.3392 177.0349 83 G 3.7408 8.4483 107.1895 45.0507 0.0000 172.9074 84 Y 4.8973 7.5838 117.2287 56.1694 40.4778 174.6537 85 H 4.8088 8.9479 122.2274 56.7971 30.4739 174.7694 86 I 4.2232 8.8303 128.1291 61.3203 37.4648 176.0674 87 Q 4.6071 9.3122 122.5470 54.1675 30.7147 174.3431 88 C 5.0833 7.8978 111.4837 56.4371 32.9300 173.2755 89 L 4.3785 8.7883 120.7004 54.1223 42.6692 177.2694 90 G 4.5725 8.5952 109.5319 44.7819 0.0000 171.3212 91 V 5.2935 8.5916 119.7761 61.2961 33.8895 175.5102 92 D 4.9652 9.7794 128.6292 53.2947 42.8912 175.7015 93 R 4.3969 8.6717 125.2786 55.7880 29.2244 176.5046 94 S 4.5416 9.1383 120.3399 61.1390 63.1794 175.0655 95 D 4.6347 9.0633 124.0407 53.0491 40.6934 177.0752 96 S 4.0878 8.5269 121.9175 60.2904 62.6862 174.9957 97 F 4.3251 8.1620 117.8227 59.7237 38.9506 175.5034 98 E 4.5485 8.0027 119.7143 54.7772 31.0530 176.4902 99 G 3.9388 8.0593 107.3274 45.9143 0.0000 171.8050 100 Y 4.7510 8.5640 118.7107 57.6378 39.0772 175.3371 101 S 4.2859 8.6034 117.1953 56.5173 65.9140 173.5664 102 P 3.7536 0.0000 0.0000 65.7962 31.2389 177.8836 103 Q 4.0669 7.8860 117.4230 58.6566 29.2826 176.0387 104 N 4.5945 8.2999 114.5495 53.9310 39.5334 173.9352 105 A 5.0477 7.7944 119.9562 52.1239 19.7838 176.9621 106 R 4.9458 9.1698 121.0401 54.3642 34.1326 174.0607 107 L 4.9503 8.7648 127.7221 55.3002 43.5798 175.2724 108 A 5.1874 9.3908 127.3029 50.4168 23.0318 175.7301 109 C 4.1496 8.7158 116.0362 57.4063 30.7981 174.6418 110 F 4.5736 7.9707 122.2237 61.2938 38.9095 177.6080 111 I 3.7710 7.9967 119.3672 64.7917 37.0559 177.9997 112 C 4.2310 8.1971 117.0685 62.5823 28.0487 175.4294 113 N 4.3786 8.5980 119.0750 56.9843 38.3701 177.2164 114 R 3.8924 7.6684 118.0422 59.0168 30.1513 178.7602 115 I 3.8639 7.5888 118.7743 64.3587 37.4951 177.9228 116 K 4.0927 8.3514 120.5827 58.7581 32.2095 177.1781 117 S 3.3464 8.2202 113.7373 59.8654 62.6878 172.1262 118 N 4.8497 8.5950 113.5645 52.4373 37.3513 175.9564 119 I 3.6844 7.7624 120.6732 64.1252 37.5129 176.2492 120 F 5.0129 7.4920 117.2570 55.5676 40.8736 176.5367 121 S 4.4755 9.0234 119.4178 57.8235 65.0166 175.4254 122 A 4.1363 8.5902 123.8706 55.4330 18.1991 179.7705 123 S 4.0738 8.1633 110.9966 61.7755 62.6639 176.0655 124 E 4.0805 8.4303 121.2921 59.7776 29.1727 179.1669 125 M 3.8000 8.6083 118.4015 58.1994 32.0807 177.6917 126 D 4.5934 8.7511 119.8430 57.6407 40.5306 179.2780 127 V 3.5456 7.4069 116.8945 65.9709 31.5067 177.9417 128 L 3.9183 7.6341 118.5350 57.7044 41.4011 179.5454 129 G 4.2141 8.6337 107.3233 47.2971 0.0000 175.1373 130 E 3.9358 8.0445 121.1397 58.9683 29.5000 178.8237 131 A 3.9302 7.6335 120.0014 55.0603 18.3770 179.7583 132 I 3.1651 7.8253 118.6078 64.3436 37.0640 178.3193 133 S 4.0274 8.4211 114.2550 61.5872 61.9561 176.5868 134 K 3.9819 7.9205 120.5594 59.1105 31.8207 179.0706 135 A 3.8999 7.4078 121.2392 54.9275 18.2029 179.7357 136 W 4.6001 7.6222 117.2101 60.6342 29.0678 178.5510 137 H 4.4759 8.7108 116.5484 58.9452 27.8607 178.1601 138 G 3.6873 8.4199 107.2224 47.3854 0.0000 175.1775 139 R 4.4230 7.9080 117.7086 56.0765 30.4262 177.1644 140 G 3.9234 7.8471 106.9985 45.8757 0.0000 173.0367 141 I 4.4003 7.9584 119.6905 59.0326 39.3430 175.8681 142 A 4.4567 8.5249 126.4979 52.3105 19.1600 176.0816 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 4.51 0.00 2.03 2.15 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.65 0.00 2 T 8.15 4.40 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 0.99 0.00 0.00 3 Q 8.65 4.89 0.00 2.22 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.92 0.00 0.00 0.00 0.00 0.00 2.36 2.59 0.00 4 C 9.20 4.83 0.00 3.21 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 5 P 0.00 4.37 0.00 2.25 2.19 0.00 4.05 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.00 0.00 6 R 8.09 4.27 0.00 1.82 2.04 0.00 3.33 0.00 0.00 3.32 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.72 0.00 7 C 8.00 4.26 0.00 3.11 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 8 Q 8.45 3.88 0.00 2.25 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.91 0.00 0.00 0.00 0.00 0.00 2.29 2.47 0.00 9 R 7.54 4.23 0.00 1.76 1.83 0.00 3.08 0.00 0.00 3.31 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.65 0.00 10 N 8.66 5.13 0.00 2.62 2.79 0.00 0.00 6.74 7.85 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 11 L 9.37 4.92 0.00 1.59 1.41 0.61 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 12 A 8.62 4.57 1.35 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 13 A 8.84 4.18 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 14 D 8.06 4.53 0.00 2.76 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 15 E 8.39 4.11 0.00 1.87 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 2.02 1.99 0.00 16 F 7.62 4.94 0.00 3.17 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 17 Y 8.32 4.61 0.00 3.03 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 18 A 9.65 4.31 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 19 G 7.74 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 0.00 0.00 0.00 20 S 8.44 4.48 0.00 3.95 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 21 S 7.78 4.28 0.00 3.95 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 22 K 8.51 4.41 0.00 1.78 1.89 0.00 1.75 0.00 0.00 1.76 0.00 0.00 3.01 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.37 1.41 7.81 23 M 7.97 4.38 0.00 2.21 2.18 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.61 0.00 24 C 8.46 4.17 0.00 2.61 2.62 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 25 K 8.53 3.81 0.00 1.68 1.93 0.00 1.54 0.00 0.00 1.62 0.00 0.00 2.85 0.00 0.00 3.03 0.00 0.00 0.00 0.00 0.61 0.90 7.81 26 G 7.98 3.65 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 0.00 0.00 0.00 27 C 8.00 4.29 0.00 3.19 3.07 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 28 M 8.31 4.07 0.00 2.46 2.29 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.72 0.00 29 T 8.41 3.80 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 1.08 0.00 0.00 30 W 8.40 3.44 0.00 3.23 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 31 Q 8.15 3.62 0.00 2.21 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.58 0.00 0.00 0.00 0.00 0.00 2.21 2.31 0.00 32 N 8.00 4.21 0.00 2.79 2.74 0.00 0.00 6.69 6.34 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 33 L 7.55 3.31 0.00 1.07 0.89 0.06 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 34 S 7.03 3.55 0.00 3.47 3.47 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 35 Y 7.75 3.93 0.00 2.96 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 36 N 8.73 4.25 0.00 2.88 2.94 0.00 0.00 6.96 7.02 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 37 A 8.05 4.13 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 38 N 7.97 4.18 0.00 2.68 2.64 0.00 0.00 6.92 6.87 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 39 K 7.91 3.82 0.00 1.21 1.67 0.00 1.78 0.00 0.00 1.45 0.00 0.00 3.09 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.32 1.29 7.81 40 E 8.10 4.34 0.00 1.93 1.81 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 2.38 2.49 0.00 41 G 7.44 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 42 H 8.12 5.04 0.00 3.09 3.18 0.00 5.66 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 A 8.54 4.27 1.27 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 0.00 0.00 0.00 44 N 8.56 5.47 0.00 2.71 2.73 0.00 0.00 6.97 7.70 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 45 T 8.93 4.46 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 1.21 0.00 0.00 46 F 8.09 4.29 0.00 3.60 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 47 T 8.24 4.56 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 1.25 0.00 0.00 48 K 7.75 2.00 0.00 0.94 1.44 0.00 1.64 0.00 0.00 1.72 0.00 0.00 2.91 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.17 0.72 7.81 49 A 7.67 3.89 1.27 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 0.00 0.00 0.00 50 T 7.66 3.89 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 1.25 0.00 0.00 51 F 8.54 3.94 0.00 2.70 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 52 L 8.18 3.90 0.00 1.65 1.65 0.87 0.95 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 53 A 7.75 3.98 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 54 W 8.33 4.18 0.00 3.53 3.42 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 55 Y 8.34 3.89 0.00 2.02 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 56 G 7.88 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.68 4.80 0.00 1.54 1.40 0.85 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 58 S 9.27 3.89 0.00 3.86 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 59 A 7.75 4.07 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 60 Q 7.82 4.25 0.00 1.99 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.79 0.00 0.00 0.00 0.00 0.00 2.24 2.37 0.00 61 R 7.30 4.07 0.00 1.61 1.58 0.00 2.34 0.00 0.00 2.25 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.33 0.00 62 H 8.42 5.23 0.00 2.87 3.13 0.00 5.90 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 C 9.17 4.21 0.00 2.98 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 64 G 9.11 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 65 Y 7.90 4.60 0.00 3.21 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 66 C 8.33 4.67 0.00 3.22 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 67 G 8.29 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 0.00 0.00 0.00 68 I 7.61 4.03 1.96 0.00 0.00 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.40 0.99 0.00 0.00 69 S 8.47 4.59 0.00 3.94 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 70 E 8.40 3.91 0.00 1.95 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 2.28 2.35 0.00 71 A 7.96 4.06 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 72 G 8.03 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.54 4.03 0.00 3.02 3.19 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 74 T 8.23 4.04 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 75 S 7.57 4.12 0.00 4.00 4.03 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 76 L 7.33 3.87 0.00 1.18 1.41 -0.03 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 77 H 7.44 3.85 0.00 3.22 3.23 0.00 5.65 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 R 7.34 4.21 0.00 1.76 1.94 0.00 3.16 0.00 0.00 3.30 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 1.22 0.00 79 T 8.22 5.11 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 1.29 0.00 0.00 80 N 8.99 4.88 0.00 2.85 2.98 0.00 0.00 6.99 7.80 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 81 P 0.00 4.46 0.00 2.10 2.22 0.00 3.67 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.32 0.00 82 R 8.00 4.01 0.00 1.64 1.79 0.00 3.32 0.00 0.00 3.22 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.60 0.00 83 G 8.45 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 84 Y 7.58 4.90 0.00 2.95 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 85 H 8.95 4.81 0.00 3.21 3.31 0.00 5.74 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 I 8.83 4.22 2.09 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.93 1.26 0.00 0.00 87 Q 9.31 4.61 0.00 2.26 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.81 0.00 0.00 0.00 0.00 0.00 2.10 2.30 0.00 88 C 7.90 5.08 0.00 3.28 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 89 L 8.79 4.38 0.00 1.64 1.61 0.88 0.50 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 90 G 8.60 4.57 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 0.00 0.00 0.00 91 V 8.59 5.29 2.39 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 1.15 0.00 0.00 1.35 0.00 0.00 92 D 9.78 4.97 0.00 3.09 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 R 8.67 4.40 0.00 1.51 1.80 0.00 2.83 0.00 0.00 2.25 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.87 0.00 94 S 9.14 4.54 0.00 4.11 4.05 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 95 D 9.06 4.63 0.00 2.72 2.72 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 96 S 8.53 4.09 0.00 3.72 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 97 F 8.16 4.33 0.00 3.27 3.06 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 0.00 0.00 0.00 0.00 98 E 8.00 4.55 0.00 2.09 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 2.33 2.41 0.00 99 G 8.06 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 0.00 0.00 0.00 100 Y 8.56 4.75 0.00 3.00 3.07 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 0.00 101 S 8.60 4.29 0.00 3.66 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 0.00 102 P 0.00 3.75 0.00 1.87 2.06 0.00 3.20 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.35 0.00 103 Q 7.89 4.07 0.00 1.97 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.93 0.00 0.00 0.00 0.00 0.00 2.34 2.42 0.00 104 N 8.30 4.59 0.00 2.84 2.85 0.00 0.00 7.07 7.94 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 0.00 105 A 7.79 5.05 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 0.00 106 R 9.17 4.95 0.00 2.00 1.87 0.00 3.09 0.00 0.00 3.07 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.49 0.00 107 L 8.76 4.95 0.00 1.69 1.46 1.02 0.95 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 0.00 108 A 9.39 5.19 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 0.00 109 C 8.72 4.15 0.00 1.51 2.68 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 0.00 0.00 0.00 0.00 110 F 7.97 4.57 0.00 3.16 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 0.00 111 I 8.00 3.77 2.36 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.16 1.19 0.00 0.00 112 C 8.20 4.23 0.00 3.16 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 0.00 113 N 8.60 4.38 0.00 3.14 3.03 0.00 0.00 7.20 8.42 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 0.00 114 R 7.67 3.89 0.00 1.70 1.82 0.00 2.66 0.00 0.00 2.98 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.75 0.00 115 I 7.59 3.86 1.97 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 1.41 0.60 0.86 0.00 0.00 116 K 8.35 4.09 0.00 1.66 1.95 0.00 1.38 0.00 0.00 1.64 0.00 0.00 3.09 0.00 0.00 3.29 0.00 0.00 0.00 0.00 1.43 1.52 7.81 117 S 8.22 3.35 0.00 4.18 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 N 8.59 4.85 0.00 2.56 2.68 0.00 0.00 5.88 7.81 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 0.00 119 I 7.76 3.68 1.41 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.38 -0.31 0.00 0.00 120 F 7.49 5.01 0.00 2.95 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 0.00 121 S 9.02 4.48 0.00 4.13 4.08 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 0.00 122 A 8.59 4.14 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.16 4.07 0.00 3.96 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 0.00 124 E 8.43 4.08 0.00 2.42 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 0.00 2.42 2.40 0.00 125 M 8.61 3.80 0.00 1.58 1.84 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.49 0.00 126 D 8.75 4.59 0.00 2.98 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 0.00 127 V 7.41 3.55 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 0.99 0.00 0.00 1.00 0.00 0.00 128 L 7.63 3.92 0.00 1.65 1.46 0.39 -0.19 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 0.00 129 G 8.63 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 0.00 130 E 8.04 3.94 0.00 2.03 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 0.00 2.30 2.34 0.00 131 A 7.63 3.93 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 0.00 132 I 7.83 3.17 1.83 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.45 0.32 0.00 0.00 133 S 8.42 4.03 0.00 4.06 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 0.00 134 K 7.92 3.98 0.00 1.96 1.81 0.00 1.69 0.00 0.00 1.62 0.00 0.00 2.97 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.46 1.59 7.81 135 A 7.41 3.90 0.93 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 0.00 136 W 7.62 4.60 0.00 3.39 3.19 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 0.00 137 H 8.71 4.48 0.00 3.22 3.38 0.00 5.64 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 0.00 138 G 8.42 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 0.00 0.00 0.00 139 R 7.91 4.42 0.00 2.15 2.09 0.00 3.51 0.00 0.00 3.37 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 2.01 0.00 140 G 7.85 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 0.00 0.00 0.00 141 I 7.96 4.40 1.93 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 1.20 0.72 0.77 0.00 0.00 142 A 8.52 4.46 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