NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5018 8.3049 120.3469 55.1702 34.2951 174.2357 2 L 3.8721 9.2048 120.3231 54.5958 40.4088 174.7649 3 T 4.0765 9.0412 124.0583 62.8526 72.6165 171.5684 4 D 4.5543 7.1125 118.5514 51.7370 42.6900 173.7674 5 P 4.2754 0.0000 0.0000 65.4566 31.6648 177.4381 6 I 3.5084 7.7753 117.5292 64.6881 36.9998 177.9580 7 A 3.9618 8.9048 121.3793 55.2675 18.2682 178.8483 8 D 4.4223 8.3648 118.2169 57.1214 41.2625 178.5835 9 M 3.9965 8.1262 118.3036 58.6908 32.3198 178.2663 10 L 4.0626 8.0078 119.2630 57.4484 41.5110 179.5581 11 T 3.9799 8.3442 110.3821 64.6595 68.9465 177.1379 12 R 3.8836 8.3983 121.5135 58.7799 30.0029 178.6414 13 I 4.1510 7.6178 118.4157 63.0899 37.2733 177.4470 14 R 4.0824 7.5399 116.3120 56.8635 29.6925 176.4015 15 N 4.8849 8.1563 111.5518 51.7086 42.4167 175.2453 16 A 4.5198 7.4705 119.6196 53.9440 20.3425 178.7780 17 T 4.6633 7.6283 108.5988 64.7708 68.6264 176.2825 18 R 3.4616 7.8238 119.4784 58.4345 30.1813 178.4330 19 V 3.9851 6.9059 107.4110 59.9061 32.2839 173.9416 20 Y 3.6417 7.2304 120.8759 58.0073 36.3354 169.6203 21 K 4.1034 8.7567 125.6607 56.2291 31.4534 175.8580 22 E 4.8705 8.2319 130.3127 56.3697 37.4300 175.9721 23 S 5.1287 8.0047 114.3662 56.8568 66.7363 172.5486 24 T 4.5212 8.8200 115.4205 61.0307 70.7406 172.2766 25 D 5.8500 9.1462 129.4012 52.0390 40.9976 174.7198 26 V 4.1033 7.8804 121.7126 59.3995 33.1450 174.3635 27 P 3.8681 0.0000 0.0000 62.6108 32.3793 176.2398 28 A 4.7145 9.4485 125.7078 51.7560 18.3817 178.2052 29 S 4.3361 7.5541 113.8458 59.1763 64.0239 175.6289 30 R 3.8647 8.7256 121.4353 59.5960 29.9154 178.8755 31 F 4.2455 8.3226 117.7426 60.7119 39.5024 175.2228 32 K 4.6350 7.5953 120.0940 54.8823 33.0331 175.6963 33 E 4.4605 7.8408 118.0690 55.6542 34.5753 175.4352 34 E 4.0260 7.7430 120.5283 59.3068 29.4911 178.2225 35 I 3.6473 7.5980 120.2880 64.0097 37.4886 178.0535 36 L 4.2451 7.3530 119.5381 57.6926 41.1076 179.3610 37 R 4.1504 7.9752 119.5606 58.6221 29.9801 177.1114 38 I 4.1218 7.7348 117.2632 61.7023 36.9895 175.9895 39 L 3.7595 7.6378 121.0842 54.6671 41.6246 176.9655 40 A 5.3361 7.3092 114.4010 52.1222 20.2168 175.1357 41 R 4.5477 8.3791 120.0105 56.2584 32.7287 175.4680 42 E 4.4599 9.1070 114.7834 55.4220 31.0650 174.8834 43 G 3.1306 6.1799 110.7959 44.6624 0.0000 172.4790 44 F 4.8606 7.4495 123.6560 57.3292 42.7834 175.5877 45 I 4.6700 7.0700 114.3908 59.9368 41.2869 176.4223 46 K 4.2787 8.5205 118.8136 56.6541 32.7877 177.0471 47 G 3.6081 7.2067 104.3933 44.0036 0.0000 171.9059 48 Y 4.8367 7.2626 120.0866 56.9047 41.0188 172.8315 49 E 4.9054 8.3441 117.5274 54.5031 33.7378 176.1463 50 R 4.4853 8.5952 120.1979 56.3334 31.3613 176.6238 51 V 4.3441 7.8325 119.3837 62.4145 33.9017 174.6136 52 D 4.4676 8.4822 120.1621 54.1455 42.8960 175.4778 53 V 4.1471 7.8716 124.4618 61.9947 31.9812 171.0271 54 D 4.1640 9.1973 124.3097 54.2668 38.7701 175.2257 55 G 3.8116 8.8265 113.8869 46.0573 0.0000 172.8870 56 K 4.3629 8.7791 126.2145 54.4949 33.2608 176.1657 57 P 4.7270 0.0000 0.0000 62.1700 33.0225 175.3324 58 Y 4.7397 8.5662 122.2887 57.6178 39.4257 178.1466 59 L 4.1462 8.3184 126.0561 55.1804 45.6187 175.5388 60 R 4.4799 8.1370 127.3892 55.7991 28.1466 177.6817 61 V 3.5534 7.5190 119.9883 63.4039 33.1610 175.6435 62 Y 5.0740 7.5705 121.6180 56.7688 40.6143 175.6863 63 L 4.4459 8.2251 120.1351 53.0412 42.3080 175.8256 64 K 4.2082 8.0893 124.1529 55.1580 33.4805 173.7174 65 Y 4.5783 9.3414 121.4692 56.6081 40.2267 177.8051 66 G 4.3396 7.6403 110.0613 46.1044 0.0000 168.7580 67 P 4.8135 0.0000 0.0000 63.1791 30.6696 174.8041 68 R 4.9348 8.1253 116.2604 53.5371 34.2443 174.2419 69 R 4.6503 8.1548 117.1016 55.2657 34.0721 175.3904 70 Q 4.0435 8.7885 123.5559 54.6533 29.3211 177.0260 71 G 3.6222 8.4506 111.2622 44.5626 0.0000 169.8730 72 P 4.0304 0.0000 0.0000 63.6304 30.9077 172.0109 73 D 4.3488 8.7405 131.8492 52.6762 40.0164 172.0210 74 P 4.6947 0.0000 0.0000 62.8062 32.0727 175.9189 75 R 4.5306 8.2716 120.8061 53.8543 35.0723 172.4330 76 P 4.4437 0.0000 0.0000 62.7968 31.5534 176.2928 77 E 4.1843 9.0010 126.2186 56.4588 30.6672 176.1760 78 Q 4.6274 8.4290 122.7542 54.1798 30.8026 175.4835 79 V 3.6846 8.2399 124.9699 65.3065 31.7625 176.2655 80 I 4.5501 7.5965 118.4908 59.8041 38.9069 174.7432 81 H 4.7653 8.2909 122.3971 56.0558 31.5309 172.5126 82 H 4.7538 7.4796 113.6609 54.5913 32.7794 171.9160 83 I 3.9788 7.3312 117.3883 60.6910 40.1139 173.5261 84 R 4.4619 8.4565 122.7178 55.5263 31.8583 173.8621 85 R 4.0354 8.8253 126.2237 57.3143 30.2544 175.9460 86 I 4.1479 9.0085 126.3452 62.3719 38.5112 176.6654 87 S 4.5796 7.5327 116.0553 56.3485 60.5925 173.3450 88 K 4.1859 7.6093 123.9379 54.6607 33.0499 174.9480 89 P 4.2153 0.0000 0.0000 64.6156 31.5046 175.1952 90 G 4.3380 9.2258 117.4966 45.9999 0.0000 174.6210 91 R 4.3115 7.0439 120.5674 54.6103 29.0666 176.3416 92 R 4.0741 7.5589 118.8793 56.7115 31.8811 176.5319 93 V 4.4832 8.2596 123.7525 61.5706 34.8910 173.9871 94 Y 5.7613 8.5467 124.1489 55.3130 41.4285 175.2185 95 V 4.2181 8.4325 115.9585 60.8360 33.6334 173.5742 96 G 4.2589 8.5637 113.0772 45.3132 0.0000 172.9129 97 V 3.6192 8.5065 117.9974 64.8342 31.1805 177.8346 98 K 4.1557 7.9419 119.7628 57.8949 32.0056 178.1193 99 E 4.4580 7.6950 116.9029 56.4760 29.2960 176.3672 100 I 4.0535 7.1892 120.4731 60.1736 37.5491 174.3669 101 P 4.3771 0.0000 0.0000 63.5419 31.6596 176.1475 102 R 4.7826 8.3245 118.3882 55.6754 31.8161 174.9831 103 V 3.6492 7.8522 116.8977 64.5793 32.0453 176.7435 104 R 3.7886 8.9611 121.2779 55.9163 28.7576 175.3653 105 R 3.8108 8.6907 116.4218 56.9776 28.1842 176.0367 106 G 4.1827 8.1201 105.6907 45.4861 0.0000 171.7814 107 L 4.4935 7.4174 121.9139 55.1189 40.1458 180.5480 108 G 4.2575 9.2315 113.3748 44.1183 0.0000 173.0146 109 I 3.8913 7.4984 113.7079 61.4748 38.3862 176.9225 110 A 4.6049 8.1484 124.2731 50.2897 18.8970 175.9295 111 I 4.1213 7.9916 121.3685 61.6392 38.2168 175.8948 112 L 4.8022 7.9785 122.3423 52.5381 45.5288 176.3887 113 S 4.2529 8.7442 116.8500 58.6176 62.1961 173.7073 114 T 4.1050 8.5605 117.6828 61.8685 68.1759 174.6213 115 S 4.2295 9.0480 117.5941 60.5857 63.2345 173.4313 116 K 4.5204 7.8588 120.4519 54.7014 32.1809 177.8231 117 G 3.9148 8.6205 115.6246 45.6619 0.0000 172.3534 118 V 4.3862 8.1730 123.3024 61.1376 34.1595 174.4459 119 L 4.6635 8.1463 125.5644 53.4573 45.8608 175.4651 120 T 4.3759 8.2012 111.4308 60.8372 70.3915 175.3565 121 D 4.4276 8.5450 120.3476 56.1583 39.8211 178.7747 122 R 4.0339 8.0641 117.3585 57.9389 30.0991 176.4330 123 E 4.4994 7.5610 115.0528 55.6076 31.4349 176.1920 124 A 4.3524 7.7770 122.3335 50.8964 16.8896 177.9639 125 R 4.5848 6.9239 118.3579 54.0026 31.9667 174.0175 126 K 4.3765 7.2314 110.1548 55.4800 33.5996 173.7197 127 L 4.2944 8.4703 121.6583 53.9038 44.9244 170.8190 128 G 3.6654 8.5161 110.0368 46.0851 0.0000 172.5399 129 V 4.7983 7.3727 118.4032 57.7165 35.3635 174.3000 130 G 3.9006 8.7899 106.8215 46.6970 0.0000 175.6555 131 G 4.4192 7.8376 122.2854 44.7493 0.0000 177.1496 132 E 4.4512 8.5672 128.6373 54.0888 30.8999 174.3528 133 L 4.8280 7.7793 119.0903 53.2077 45.5397 174.7254 134 I 4.2519 7.5734 119.7469 60.5813 39.7734 175.4309 135 C 4.7982 7.9726 112.5153 57.8014 32.6003 174.6797 136 E 4.3044 8.7925 123.5794 56.0988 30.2205 176.2788 137 V 4.6260 8.2390 119.3756 61.0314 34.3619 175.4580 138 W 4.7431 8.7958 122.9128 56.7276 28.2267 174.8268 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 4.50 0.00 1.98 1.87 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 2.44 2.54 0.00 2 L 9.20 3.87 0.00 1.77 1.39 0.91 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 3 T 9.04 4.08 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 1.22 0.00 0.00 4 D 7.11 4.55 0.00 2.66 2.47 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 5 P 0.00 4.28 0.00 2.47 2.28 0.00 3.86 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.29 0.00 6 I 7.78 3.51 1.76 0.00 0.00 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.74 0.79 0.00 0.00 7 A 8.90 3.96 1.31 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 0.00 0.00 0.00 8 D 8.36 4.42 0.00 2.97 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 9 M 8.13 4.00 0.00 2.15 1.98 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.52 0.00 10 L 8.01 4.06 0.00 1.73 1.69 0.91 0.51 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 11 T 8.34 3.98 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 12 R 8.40 3.88 0.00 1.97 2.03 0.00 3.11 0.00 0.00 3.16 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.94 0.00 13 I 7.62 4.15 1.86 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.72 0.91 0.00 0.00 14 R 7.54 4.08 0.00 2.12 1.96 0.00 3.20 0.00 0.00 3.19 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.60 0.00 15 N 8.16 4.88 0.00 2.69 2.74 0.00 0.00 6.71 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 16 A 7.47 4.52 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 17 T 7.63 4.66 4.54 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 1.21 0.00 0.00 18 R 7.82 3.46 0.00 1.60 1.82 0.00 3.16 0.00 0.00 3.12 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.60 0.00 19 V 6.91 3.99 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 0.67 0.00 0.00 0.98 0.00 0.00 20 Y 7.23 3.64 0.00 3.05 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 21 K 8.76 4.10 0.00 1.82 1.63 0.00 1.84 0.00 0.00 1.65 0.00 0.00 2.98 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.52 1.38 7.81 22 E 8.23 4.87 0.00 2.07 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 2.32 2.32 0.00 23 S 8.00 5.13 0.00 4.02 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 24 T 8.82 4.52 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 1.23 0.00 0.00 25 D 9.15 5.85 0.00 2.62 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 26 V 7.88 4.10 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 0.56 0.00 0.00 0.90 0.00 0.00 27 P 0.00 3.87 0.00 1.89 1.73 0.00 3.42 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.49 0.00 28 A 9.45 4.71 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.55 4.34 0.00 3.94 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 30 R 8.73 3.86 0.00 1.95 2.08 0.00 3.32 0.00 0.00 3.27 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.59 0.00 31 F 8.32 4.25 0.00 2.80 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 32 K 7.60 4.64 0.00 1.70 1.64 0.00 1.76 0.00 0.00 1.65 0.00 0.00 3.12 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.32 1.35 7.81 33 E 7.84 4.46 0.00 1.80 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 2.13 1.91 0.00 34 E 7.74 4.03 0.00 2.16 1.82 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 2.29 2.36 0.00 35 I 7.60 3.65 1.77 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.35 0.80 0.00 0.00 36 L 7.35 4.25 0.00 1.89 1.79 0.51 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 37 R 7.98 4.15 0.00 1.91 1.97 0.00 3.12 0.00 0.00 3.08 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.54 0.00 38 I 7.73 4.12 1.67 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 1.25 0.75 0.86 0.00 0.00 39 L 7.64 3.76 0.00 1.94 1.71 0.97 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 40 A 7.31 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 41 R 8.38 4.55 0.00 2.13 2.07 0.00 3.30 0.00 0.00 3.28 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.76 0.00 42 E 9.11 4.46 0.00 1.80 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 2.21 2.21 0.00 43 G 6.18 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 0.00 0.00 0.00 44 F 7.45 4.86 0.00 3.16 2.77 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 45 I 7.07 4.67 2.01 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.96 1.04 0.00 0.00 46 K 8.52 4.28 0.00 1.79 1.89 0.00 1.65 0.00 0.00 1.67 0.00 0.00 2.74 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.44 1.43 7.81 47 G 7.21 3.61 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 Y 7.26 4.84 0.00 2.87 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 49 E 8.34 4.91 0.00 1.97 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 2.54 2.38 0.00 50 R 8.60 4.49 0.00 1.74 1.89 0.00 3.19 0.00 0.00 3.18 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.70 0.00 51 V 7.83 4.34 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 0.84 0.00 0.00 0.96 0.00 0.00 52 D 8.48 4.47 0.00 2.65 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 53 V 7.87 4.15 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 0.90 0.00 0.00 0.90 0.00 0.00 54 D 9.20 4.16 0.00 2.86 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 55 G 8.83 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 56 K 8.78 4.36 0.00 1.60 1.75 0.00 1.62 0.00 0.00 1.73 0.00 0.00 3.08 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.38 1.47 7.81 57 P 0.00 4.73 0.00 2.14 2.37 0.00 3.68 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.11 0.00 58 Y 8.57 4.74 0.00 2.80 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 59 L 8.32 4.15 0.00 1.74 1.26 0.70 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 60 R 8.14 4.48 0.00 1.59 1.79 0.00 3.38 0.00 0.00 3.30 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.77 0.00 61 V 7.52 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 1.02 0.00 0.00 0.71 0.00 0.00 62 Y 7.57 5.07 0.00 3.05 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 63 L 8.23 4.45 0.00 1.96 1.65 1.04 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 64 K 8.09 4.21 0.00 1.74 1.95 0.00 1.73 0.00 0.00 1.73 0.00 0.00 2.90 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.33 1.39 7.81 65 Y 9.34 4.58 0.00 3.04 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 66 G 7.64 4.34 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 0.00 67 P 0.00 4.81 0.00 2.22 1.98 0.00 3.66 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 1.98 0.00 68 R 8.13 4.93 0.00 1.62 1.81 0.00 3.21 0.00 0.00 2.25 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.42 0.00 69 R 8.15 4.65 0.00 1.62 1.77 0.00 3.20 0.00 0.00 3.22 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.65 0.00 70 Q 8.79 4.04 0.00 1.93 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 7.13 0.00 0.00 0.00 0.00 0.00 2.35 2.35 0.00 71 G 8.45 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 72 P 0.00 4.03 0.00 2.19 2.12 0.00 3.89 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.99 0.00 73 D 8.74 4.35 0.00 2.85 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 74 P 0.00 4.69 0.00 2.02 2.02 0.00 3.75 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.96 0.00 75 R 8.27 4.53 0.00 1.68 1.73 0.00 3.17 0.00 0.00 3.12 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.63 0.00 76 P 0.00 4.44 0.00 1.33 1.68 0.00 2.76 0.00 0.00 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.53 0.00 77 E 9.00 4.18 0.00 1.95 1.95 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 2.34 2.31 0.00 78 Q 8.43 4.63 0.00 2.06 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.62 6.79 0.00 0.00 0.00 0.00 0.00 2.53 2.40 0.00 79 V 8.24 3.68 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 0.65 0.00 0.00 0.93 0.00 0.00 80 I 7.60 4.55 1.92 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 1.35 0.75 1.01 0.00 0.00 81 H 8.29 4.77 0.00 2.97 3.30 0.00 5.92 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 H 7.48 4.75 0.00 2.93 3.12 0.00 5.99 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 83 I 7.33 3.98 1.91 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 1.31 0.54 0.91 0.00 0.00 84 R 8.46 4.46 0.00 1.84 1.87 0.00 3.35 0.00 0.00 3.18 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.45 0.00 85 R 8.83 4.04 0.00 1.76 1.83 0.00 3.20 0.00 0.00 3.18 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.61 0.00 86 I 9.01 4.15 1.85 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 1.19 1.02 0.90 0.00 0.00 87 S 7.53 4.58 0.00 3.70 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 88 K 7.61 4.19 0.00 1.90 1.71 0.00 1.81 0.00 0.00 1.86 0.00 0.00 3.02 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.52 1.48 7.81 89 P 0.00 4.22 0.00 2.21 2.13 0.00 3.75 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.06 0.00 90 G 9.23 4.34 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 0.00 91 R 7.04 4.31 0.00 1.76 1.88 0.00 3.44 0.00 0.00 3.16 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.70 0.00 92 R 7.56 4.07 0.00 1.92 1.94 0.00 3.24 0.00 0.00 3.18 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.63 0.00 93 V 8.26 4.48 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 0.91 0.00 0.00 0.95 0.00 0.00 94 Y 8.55 5.76 0.00 2.81 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 95 V 8.43 4.22 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 0.74 0.00 0.00 1.01 0.00 0.00 96 G 8.56 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 0.00 0.00 0.00 0.00 97 V 8.51 3.62 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 0.76 0.00 0.00 0.94 0.00 0.00 98 K 7.94 4.16 0.00 1.85 1.90 0.00 1.66 0.00 0.00 1.82 0.00 0.00 2.90 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.52 1.46 7.81 99 E 7.69 4.46 0.00 2.32 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 2.33 2.29 0.00 100 I 7.19 4.05 1.88 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 1.37 0.79 0.92 0.00 0.00 101 P 0.00 4.38 0.00 2.18 2.07 0.00 3.71 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 0.00 102 R 8.32 4.78 0.00 1.84 1.89 0.00 3.17 0.00 0.00 3.27 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.76 0.00 103 V 7.85 3.65 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 0.86 0.00 0.00 0.93 0.00 0.00 104 R 8.96 3.79 0.00 2.08 2.10 0.00 3.57 0.00 0.00 3.31 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.87 0.00 105 R 8.69 3.81 0.00 1.89 1.90 0.00 3.36 0.00 0.00 3.23 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.60 0.00 106 G 8.12 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 0.00 0.00 0.00 0.00 107 L 7.42 4.49 0.00 1.79 0.95 0.95 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 108 G 9.23 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 0.00 0.00 0.00 0.00 109 I 7.50 3.89 2.03 0.00 0.00 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 1.39 0.71 1.04 0.00 0.00 110 A 8.15 4.60 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 0.00 111 I 7.99 4.12 1.90 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.65 0.94 0.00 0.00 112 L 7.98 4.80 0.00 1.45 1.62 1.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 113 S 8.74 4.25 0.00 3.83 3.79 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 0.00 114 T 8.56 4.10 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 1.32 0.00 0.00 115 S 9.05 4.23 0.00 4.07 4.30 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 0.00 116 K 7.86 4.52 0.00 1.75 1.80 0.00 2.12 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 3.28 0.00 0.00 0.00 0.00 1.36 1.55 7.81 117 G 8.62 3.91 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 0.00 0.00 0.00 118 V 8.17 4.39 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 0.86 0.00 0.00 0.93 0.00 0.00 119 L 8.15 4.66 0.00 1.63 1.50 0.93 0.99 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 0.00 120 T 8.20 4.38 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 1.26 0.00 0.00 121 D 8.55 4.43 0.00 2.98 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 0.00 122 R 8.06 4.03 0.00 1.84 2.06 0.00 3.16 0.00 0.00 3.16 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.64 0.00 123 E 7.56 4.50 0.00 2.03 1.91 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 2.21 2.22 0.00 124 A 7.78 4.35 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 0.00 125 R 6.92 4.58 0.00 1.72 1.82 0.00 3.28 0.00 0.00 3.16 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.51 0.00 126 K 7.23 4.38 0.00 1.69 1.70 0.00 1.89 0.00 0.00 1.64 0.00 0.00 2.78 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.23 1.32 7.81 127 L 8.47 4.29 0.00 1.59 1.59 0.93 1.13 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 0.00 128 G 8.52 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 V 7.37 4.80 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 0.00 130 G 8.79 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 0.00 131 G 7.84 4.42 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 0.00 132 E 8.57 4.45 0.00 1.68 1.71 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 1.95 1.49 0.00 133 L 7.78 4.83 0.00 1.60 1.36 0.89 0.87 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 0.00 134 I 7.57 4.25 1.97 0.00 0.00 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 1.39 0.80 0.86 0.00 0.00 135 C 7.97 4.80 0.00 3.12 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 0.00 136 E 8.79 4.30 0.00 2.04 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 2.33 2.31 0.00 137 V 8.24 4.63 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 1.18 0.00 0.00 1.04 0.00 0.00 138 W 8.80 4.74 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