NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3280 8.2649 123.5827 51.7007 18.8791 176.4017 3 S 4.2973 8.1982 117.6539 57.4248 63.6487 172.0595 4 N 5.3975 9.2421 120.4215 50.2826 41.2485 174.7140 5 Q 3.9707 8.7062 117.5551 59.6867 28.8407 178.1452 6 Q 4.0108 8.1756 118.3646 59.2216 28.7545 178.5335 7 D 4.3906 8.6310 119.9448 57.3024 40.7456 179.0644 8 V 3.7060 7.6012 118.8352 65.9437 31.5167 178.1996 9 V 3.6322 8.0652 118.2130 65.8652 31.2858 177.8725 10 K 3.9647 8.0767 119.3103 59.6405 31.8791 178.6980 11 E 4.0013 8.0678 118.4410 59.2435 29.3699 179.3586 12 L 4.3206 8.4928 119.5372 58.1242 41.6831 179.3823 13 N 4.4455 8.7052 116.8243 56.1367 38.3476 177.1872 14 Q 3.9801 8.1621 121.2512 59.4451 29.0209 178.5532 15 Q 4.1679 8.0577 119.0183 58.7340 28.8444 178.5758 16 V 3.7013 8.0374 119.2651 65.8644 31.5355 178.0050 17 A 3.9551 8.4241 120.7758 55.2503 18.2207 179.0894 18 N 4.0689 8.2324 115.0649 56.5748 38.6227 177.6994 19 W 4.1789 8.5009 119.6587 59.3495 29.1521 178.9964 20 T 3.9935 8.0164 116.4213 66.4919 67.9346 177.0002 21 V 3.6544 7.8892 120.0212 65.9555 31.5999 177.9468 22 A 3.8597 8.2250 120.8499 55.0367 17.7936 178.7375 23 Y 4.1530 8.3470 118.3398 61.5774 38.8069 178.8538 24 T 3.6325 7.6218 114.9225 66.1406 68.5492 176.9493 25 K 3.5308 7.9312 121.6514 59.2352 32.0463 178.9169 26 L 3.6008 8.1024 119.6201 57.5796 41.3815 179.1933 27 H 3.3887 7.2067 116.1990 58.1710 28.3879 177.1013 28 N 4.4151 7.6401 118.8608 56.9993 38.8061 176.9590 29 F 4.4857 7.9056 119.0870 60.7872 38.5930 177.0896 30 H 4.4390 8.0355 117.2657 59.0826 29.6611 176.9461 31 W 4.6500 7.9968 119.8032 59.3648 29.3140 177.5567 32 Y 4.6706 8.4866 114.2199 57.3249 38.1885 176.4717 33 V 3.9277 7.5733 120.7120 61.8765 31.9965 175.5419 34 K 4.6684 8.6199 120.7311 55.0674 36.4030 174.8977 35 G 3.8832 8.7477 105.7276 43.7609 0.0000 172.8671 36 P 4.3788 0.0000 0.0000 65.0936 31.3326 176.7940 37 N 4.9029 8.0705 115.7697 53.2376 39.0974 176.1103 38 F 3.8928 8.3123 122.9287 61.6182 38.9965 177.2349 39 F 4.1500 7.9174 116.4258 60.6847 38.7044 177.7703 40 S 4.0999 8.0168 114.0406 61.7146 62.7113 176.6854 41 L 3.2429 7.6377 121.5960 57.4889 41.3636 178.8505 42 H 3.8920 7.9440 118.7057 59.2386 29.6358 177.5306 43 V 3.5050 7.2350 119.6049 65.7797 31.4393 177.7550 44 K 3.8978 7.8790 119.5955 59.7342 31.9416 178.7142 45 F 4.5360 7.9727 118.2213 60.3925 38.7103 177.3461 46 E 2.0000 7.3805 118.0606 58.5079 29.3328 178.5780 47 E 3.8120 7.9350 118.6228 59.3075 29.3830 179.4369 48 L 4.0896 7.9417 119.2448 57.9698 41.7834 179.1279 49 Y 4.3667 7.8315 117.4997 59.9271 37.8154 177.7961 50 N 4.6070 8.2570 118.8913 56.2221 38.6408 176.9283 51 E 3.8760 8.2878 120.6871 58.9348 29.6828 178.6365 52 A 4.0908 8.4015 121.4883 55.2532 18.6448 179.7431 53 S 4.0192 8.4924 112.7912 61.6884 62.9456 176.7980 54 Q 3.9137 7.6677 121.6311 58.7983 28.2968 178.3454 55 Y 4.1834 7.4407 117.6583 61.0349 37.8692 178.4939 56 V 3.6454 7.9277 119.1968 66.2408 31.5319 177.6353 57 D 4.2603 8.0058 117.3286 57.1172 40.9544 177.6496 58 E 3.8779 8.2679 119.8591 59.5175 29.7092 178.9319 59 L 3.9296 8.2780 119.0341 57.5583 41.7034 179.3951 60 A 4.0109 8.0541 120.8969 55.2111 18.3761 179.3343 61 E 4.0870 8.4129 116.3044 58.4669 29.6462 179.3714 62 R 3.8903 7.6193 119.5852 59.2511 30.2138 178.1878 63 I 3.7210 7.7455 119.6601 64.4785 37.0726 178.4239 64 L 4.0282 7.7842 119.0702 57.6758 41.2674 179.3346 65 A 4.1246 7.8453 119.4304 54.0796 18.2563 179.0001 66 V 4.2907 7.2527 108.7668 60.7297 32.0708 176.5252 67 G 3.8102 8.0240 106.3348 45.8777 0.0000 174.2021 68 G 3.9263 8.2588 109.5270 43.8847 0.0000 173.0540 69 N 4.8419 8.2836 116.5004 50.5617 39.5431 173.2842 70 P 4.5136 0.0000 0.0000 61.8674 32.0738 176.9646 71 V 3.6136 8.8501 116.8882 62.2744 31.4540 176.2854 72 G 4.1531 8.6919 113.6998 45.2209 0.0000 173.0028 73 T 4.7371 7.3500 109.8441 58.8182 73.1794 174.5971 74 L 4.0531 8.3990 122.0915 58.0934 41.5308 179.8322 75 T 3.8550 7.8756 115.3748 66.7653 68.5823 176.3071 76 E 4.2761 8.0322 121.5622 59.0211 29.3801 179.1464 77 C 4.1430 7.9664 116.3380 62.9650 28.0203 176.2596 78 L 3.9633 7.9812 119.3363 57.6515 41.0094 179.2164 79 E 4.1129 7.8614 118.7442 59.2479 29.2285 178.9465 80 Q 4.0914 7.7487 116.2353 56.8424 29.5636 176.8624 81 S 4.2973 7.7287 114.4640 58.8811 62.6759 174.0298 82 I 4.0317 8.8575 120.1824 61.2280 38.1655 175.7535 83 V 3.8830 7.4959 122.3684 61.8195 31.8461 175.4587 84 K 4.4330 8.2050 126.4386 54.8242 33.6081 176.3819 85 E 4.0124 8.3028 120.0450 55.8080 30.0918 177.0697 86 A 3.7707 8.1153 123.5995 52.3023 18.9271 177.3574 87 A 4.4783 7.5129 124.0309 50.4092 21.3245 176.5656 88 K 4.2186 8.2351 118.2339 56.6924 33.2500 176.8206 89 G 3.8846 8.4541 107.0377 47.0430 0.0000 173.2567 90 Y 4.5110 8.1124 116.9927 56.7774 39.1487 176.6672 91 S 4.5341 8.8767 119.8588 57.2511 65.8042 175.3050 92 A 3.9909 8.4641 123.5827 55.4083 17.9609 179.4653 93 E 4.0254 8.1698 117.1588 59.7330 29.8000 178.9926 94 Q 4.1218 7.8806 119.2256 58.3714 28.5664 178.7306 95 M 3.5240 7.8642 119.9792 58.2272 31.8387 178.9564 96 V 3.2932 7.7230 118.3363 65.7430 31.3115 177.8845 97 E 3.9335 8.3855 118.7042 59.4176 29.2572 178.9867 98 E 4.0206 8.3239 119.3033 59.2793 29.7571 178.8047 99 L 3.9885 8.0634 119.1908 57.6733 41.4663 179.4180 100 S 4.4918 8.0253 114.6309 61.0036 62.3261 176.0323 101 Q 4.0287 8.2731 122.2350 59.2200 28.7458 177.9255 102 D 4.3842 8.5404 120.3410 57.6042 40.8542 178.8648 103 F 4.2645 9.2573 118.6394 60.7570 38.9782 177.9835 104 T 4.0030 8.5087 115.8343 66.7113 68.2681 176.5229 105 N 4.3717 8.4477 118.5053 56.3918 38.5519 177.6126 106 I 3.6536 8.1820 121.6407 64.3954 37.1751 178.3883 107 S 4.1587 8.3870 114.2485 61.2606 61.8349 176.1927 108 K 3.9550 8.0386 122.0994 59.5627 31.8702 178.8735 109 Q 3.9522 8.0785 118.4009 58.9780 28.5419 178.8037 110 L 3.6989 8.3320 120.4378 57.3998 41.4283 179.1068 111 E 3.8807 8.0888 119.5275 59.3082 29.5524 178.4972 112 N 4.2445 7.8468 116.4945 56.5540 38.9482 176.7073 113 A 3.7343 7.9208 122.4468 55.0192 18.2740 179.6876 114 I 3.7513 7.9075 118.7174 64.4707 37.1347 178.2729 115 E 3.9428 7.9171 120.2029 59.2756 29.4813 178.8804 116 I 3.6676 7.9037 119.6268 64.3046 37.1416 178.2111 117 A 4.1594 8.3810 121.8670 55.2067 18.2638 179.8912 118 G 3.5790 8.2105 104.1467 48.2013 0.0000 175.7101 119 N 4.4137 8.2481 117.7507 55.5700 38.6251 176.6437 120 A 4.7185 7.3128 121.4778 51.6234 18.9130 178.2542 121 G 3.8273 7.8089 105.3513 46.1433 0.0000 174.9870 122 D 4.6480 7.9634 121.4391 53.0723 39.3842 176.2349 123 D 4.6381 8.0731 124.2573 55.9898 41.3049 178.0896 124 V 3.5211 7.6969 118.9525 66.1713 31.6948 178.0524 125 S 3.8444 8.5114 115.1404 61.2272 62.5821 176.2437 126 E 4.1075 8.0964 122.0420 59.5030 29.3709 178.4279 127 D 4.3504 8.1010 117.9603 57.6259 41.2499 178.1506 128 M 3.9831 7.8764 119.2380 58.3495 31.8282 178.7601 129 F 4.4510 8.0569 118.0616 60.5189 38.9884 177.8200 130 I 3.8485 8.0985 119.6783 64.3468 36.8085 178.6090 131 G 3.6566 8.2441 106.6415 48.0318 0.0000 175.3764 132 M 3.7435 8.0324 120.6376 58.3501 32.1512 178.0930 133 Q 3.9821 8.4500 120.0813 59.3021 29.1958 178.3033 134 T 3.8781 8.1097 116.9923 66.8414 68.4848 176.4928 135 S 4.1359 7.9249 114.9104 61.2143 62.3940 176.1402 136 V 3.9378 8.2401 121.3886 66.4528 31.3175 177.8045 137 D 4.5025 8.5589 118.8311 57.1160 40.7556 178.7272 138 K 4.1512 8.1550 120.0455 60.0441 32.2311 178.6002 139 H 3.8687 8.5267 116.8067 58.7462 28.1671 177.3041 140 N 4.3018 8.5106 118.9745 56.3286 38.7867 176.6770 141 W 4.3363 8.3379 129.8088 60.7877 30.7192 177.8658 142 M 3.0766 7.3920 118.0705 57.9470 31.2702 178.7052 143 F 4.4394 7.8317 118.1986 60.8049 38.9265 177.9529 144 K 4.1165 8.2850 116.8885 59.5256 32.0857 179.3981 145 S 4.3035 8.1019 115.6660 61.6727 62.5325 175.9300 146 Y 4.0126 8.0369 121.4142 60.6546 38.6338 177.7641 147 L 4.1434 8.1062 117.9503 55.3575 42.2919 177.4819 148 S 4.1727 7.1159 113.7748 58.1567 62.8501 173.9370 149 L 4.1226 8.0930 126.7277 55.5713 42.2946 176.9120 150 E 4.2674 8.7487 119.3475 56.7386 28.8185 175.3445 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 A 8.26 4.33 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 3 S 8.20 4.30 0.00 4.09 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 4 N 9.24 5.40 0.00 2.88 2.92 0.00 0.00 6.74 6.97 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 5 Q 8.71 3.97 0.00 2.19 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.88 6.92 0.00 0.00 0.00 0.00 0.00 2.44 2.53 0.00 6 Q 8.18 4.01 0.00 2.41 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.68 0.00 0.00 0.00 0.00 0.00 2.46 2.53 0.00 7 D 8.63 4.39 0.00 2.88 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 8 V 7.60 3.71 2.27 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 1.27 0.00 0.00 1.03 0.00 0.00 9 V 8.07 3.63 2.26 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 1.01 0.00 0.00 0.99 0.00 0.00 10 K 8.08 3.96 0.00 1.99 2.03 0.00 1.70 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.45 1.64 7.81 11 E 8.07 4.00 0.00 2.34 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.41 0.00 12 L 8.49 4.32 0.00 1.91 1.76 0.89 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 13 N 8.71 4.45 0.00 2.85 2.90 0.00 0.00 6.70 7.31 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 14 Q 8.16 3.98 0.00 2.28 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.82 0.00 0.00 0.00 0.00 0.00 2.33 2.44 0.00 15 Q 8.06 4.17 0.00 2.45 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.57 0.00 0.00 0.00 0.00 0.00 2.72 2.76 0.00 16 V 8.04 3.70 2.27 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 1.05 0.00 0.00 1.04 0.00 0.00 17 A 8.42 3.96 1.47 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 18 N 8.23 4.07 0.00 2.67 2.38 0.00 0.00 7.13 7.29 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 19 W 8.50 4.18 0.00 3.59 3.44 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 20 T 8.02 3.99 4.41 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 1.23 0.00 0.00 21 V 7.89 3.65 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 0.95 0.00 0.00 0.93 0.00 0.00 22 A 8.23 3.86 1.18 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 23 Y 8.35 4.15 0.00 3.33 3.25 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 24 T 7.62 3.63 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 25 K 7.93 3.53 0.00 1.51 1.54 0.00 1.34 0.00 0.00 1.51 0.00 0.00 2.70 0.00 0.00 2.79 0.00 0.00 0.00 0.00 0.30 0.42 7.81 26 L 8.10 3.60 0.00 1.86 1.76 1.20 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 27 H 7.21 3.39 0.00 2.54 1.32 0.00 5.82 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 N 7.64 4.42 0.00 2.69 2.79 0.00 0.00 7.25 7.22 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 29 F 7.91 4.49 0.00 2.17 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 0.00 0.00 0.00 30 H 8.04 4.44 0.00 3.21 3.24 0.00 5.94 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 31 W 8.00 4.65 0.00 3.31 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 32 Y 8.49 4.67 0.00 3.22 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 33 V 7.57 3.93 2.58 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 0.75 0.00 0.00 1.05 0.00 0.00 34 K 8.62 4.67 0.00 1.77 1.73 0.00 1.78 0.00 0.00 1.74 0.00 0.00 3.15 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.40 1.80 7.81 35 G 8.75 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 P 0.00 4.38 0.00 2.24 2.24 0.00 3.79 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.02 0.00 37 N 8.07 4.90 0.00 2.88 2.94 0.00 0.00 6.76 8.13 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 38 F 8.31 3.89 0.00 3.12 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 F 7.92 4.15 0.00 3.20 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 S 8.02 4.10 0.00 3.82 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 41 L 7.64 3.24 0.00 1.39 0.81 0.74 0.04 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 42 H 7.94 3.89 0.00 1.92 2.92 0.00 5.58 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 V 7.23 3.50 2.11 0.00 0.00 0.00 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 0.96 0.00 0.00 44 K 7.88 3.90 0.00 1.73 1.41 0.00 1.65 0.00 0.00 1.56 0.00 0.00 3.03 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.31 1.48 7.81 45 F 7.97 4.54 0.00 3.01 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 46 E 7.38 2.00 0.00 1.58 1.70 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 1.84 1.49 0.00 47 E 7.94 3.81 0.00 2.11 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 2.22 2.50 0.00 48 L 7.94 4.09 0.00 2.02 1.98 1.27 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 49 Y 7.83 4.37 0.00 2.90 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 50 N 8.26 4.61 0.00 2.87 2.92 0.00 0.00 6.50 7.24 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 51 E 8.29 3.88 0.00 1.95 2.07 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 1.76 1.63 0.00 52 A 8.40 4.09 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 0.00 0.00 0.00 0.00 0.00 53 S 8.49 4.02 0.00 3.97 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 Q 7.67 3.91 0.00 1.85 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.85 0.00 0.00 0.00 0.00 0.00 2.29 2.55 0.00 55 Y 7.44 4.18 0.00 2.83 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 56 V 7.93 3.65 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 0.99 0.00 0.00 1.14 0.00 0.00 57 D 8.01 4.26 0.00 2.83 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 58 E 8.27 3.88 0.00 2.12 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 2.26 2.32 0.00 59 L 8.28 3.93 0.00 1.73 1.69 0.98 0.73 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 60 A 8.05 4.01 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 E 8.41 4.09 0.00 2.00 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 2.31 2.58 0.00 62 R 7.62 3.89 0.00 1.79 2.01 0.00 3.10 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.63 0.00 63 I 7.75 3.72 2.06 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.59 0.93 0.00 0.00 64 L 7.78 4.03 0.00 1.88 1.70 0.91 0.78 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 65 A 7.85 4.12 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 66 V 7.25 4.29 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 0.81 0.00 0.00 0.99 0.00 0.00 67 G 8.02 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 68 G 8.26 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 69 N 8.28 4.84 0.00 2.70 2.76 0.00 0.00 6.85 8.02 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 70 P 0.00 4.51 0.00 2.04 1.98 0.00 3.69 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.19 0.00 71 V 8.85 3.61 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 0.68 0.00 0.00 0.95 0.00 0.00 72 G 8.69 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 T 7.35 4.74 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 1.27 0.00 0.00 74 L 8.40 4.05 0.00 1.71 1.76 0.93 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 75 T 7.88 3.86 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 1.21 0.00 0.00 76 E 8.03 4.28 0.00 2.19 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 2.33 2.21 0.00 77 C 7.97 4.14 0.00 3.18 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 78 L 7.98 3.96 0.00 1.75 1.72 0.91 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 79 E 7.86 4.11 0.00 2.13 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 2.62 0.00 80 Q 7.75 4.09 0.00 2.06 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.75 0.00 0.00 0.00 0.00 0.00 2.36 2.55 0.00 81 S 7.73 4.30 0.00 3.89 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 82 I 8.86 4.03 1.83 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 1.32 0.65 0.87 0.00 0.00 83 V 7.50 3.88 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 0.69 0.00 0.00 0.64 0.00 0.00 84 K 8.21 4.43 0.00 1.75 1.67 0.00 1.79 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.36 1.37 7.81 85 E 8.30 4.01 0.00 1.89 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.26 0.00 86 A 8.12 3.77 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 A 7.51 4.48 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 K 8.24 4.22 0.00 1.73 1.68 0.00 1.81 0.00 0.00 1.66 0.00 0.00 3.01 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.27 1.36 7.81 89 G 8.45 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 Y 8.11 4.51 0.00 2.72 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 91 S 8.88 4.53 0.00 4.02 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 92 A 8.46 3.99 1.48 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 93 E 8.17 4.03 0.00 2.05 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 2.41 2.35 0.00 94 Q 7.88 4.12 0.00 2.03 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.59 0.00 0.00 0.00 0.00 0.00 2.14 2.08 0.00 95 M 7.86 3.52 0.00 0.87 1.95 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 1.11 0.00 96 V 7.72 3.29 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 1.02 0.00 0.00 0.68 0.00 0.00 97 E 8.39 3.93 0.00 2.16 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 2.34 2.61 0.00 98 E 8.32 4.02 0.00 2.28 2.28 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 2.43 2.46 0.00 99 L 8.06 3.99 0.00 1.17 0.96 0.71 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 100 S 8.03 4.49 0.00 4.04 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 0.00 101 Q 8.27 4.03 0.00 2.27 2.28 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 2.39 2.49 0.00 102 D 8.54 4.38 0.00 3.09 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 F 9.26 4.26 0.00 3.44 3.35 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 0.00 104 T 8.51 4.00 4.50 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 1.28 0.00 0.00 105 N 8.45 4.37 0.00 2.89 2.85 0.00 0.00 7.07 7.06 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 0.00 106 I 8.18 3.65 1.76 0.00 0.00 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.54 0.98 0.00 0.00 107 S 8.39 4.16 0.00 4.07 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 0.00 108 K 8.04 3.96 0.00 1.92 1.96 0.00 1.70 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.42 1.48 7.81 109 Q 8.08 3.95 0.00 2.29 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.57 0.00 0.00 0.00 0.00 0.00 2.33 2.53 0.00 110 L 8.33 3.70 0.00 1.79 1.67 0.96 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 111 E 8.09 3.88 0.00 2.08 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 0.00 2.30 2.35 0.00 112 N 7.85 4.24 0.00 2.82 2.87 0.00 0.00 7.14 7.36 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 0.00 113 A 7.92 3.73 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 I 7.91 3.75 2.04 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.02 0.95 0.00 0.00 115 E 7.92 3.94 0.00 1.97 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 0.00 2.30 2.35 0.00 116 I 7.90 3.67 2.00 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 1.71 0.65 0.93 0.00 0.00 117 A 8.38 4.16 1.62 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 0.00 118 G 8.21 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 0.00 0.00 0.00 119 N 8.25 4.41 0.00 2.85 2.91 0.00 0.00 7.05 6.95 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 0.00 120 A 7.31 4.72 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 G 7.81 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 0.00 122 D 7.96 4.65 0.00 2.73 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 0.00 123 D 8.07 4.64 0.00 2.72 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 0.00 124 V 7.70 3.52 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 1.01 0.00 0.00 0.90 0.00 0.00 125 S 8.51 3.84 0.00 3.94 3.59 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 0.00 126 E 8.10 4.11 0.00 2.23 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.54 0.00 127 D 8.10 4.35 0.00 2.94 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 0.00 128 M 7.88 3.98 0.00 1.88 1.86 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.64 0.00 129 F 8.06 4.45 0.00 3.25 2.93 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 0.00 130 I 8.10 3.85 2.06 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.88 0.93 0.00 0.00 131 G 8.24 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 0.00 0.00 0.00 132 M 8.03 3.74 0.00 2.09 1.54 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 2.22 0.00 133 Q 8.45 3.98 0.00 2.26 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.56 0.00 0.00 0.00 0.00 0.00 2.54 2.44 0.00 134 T 8.11 3.88 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 1.24 0.00 0.00 135 S 7.92 4.14 0.00 3.96 4.06 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 0.00 136 V 8.24 3.94 2.34 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 1.18 0.00 0.00 1.05 0.00 0.00 137 D 8.56 4.50 0.00 2.86 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 0.00 138 K 8.16 4.15 0.00 2.05 1.99 0.00 1.69 0.00 0.00 1.66 0.00 0.00 3.05 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.56 1.73 7.81 139 H 8.53 3.87 0.00 3.51 2.58 0.00 5.68 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 N 8.51 4.30 0.00 3.31 3.09 0.00 0.00 6.85 7.62 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 0.00 141 W 8.34 4.34 0.00 3.47 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 0.00 142 M 7.39 3.08 0.00 1.69 1.69 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 2.25 1.40 0.00 143 F 7.83 4.44 0.00 3.14 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 0.00 144 K 8.29 4.12 0.00 1.97 1.98 0.00 1.85 0.00 0.00 1.82 0.00 0.00 3.13 0.00 0.00 3.31 0.00 0.00 0.00 0.00 1.59 1.80 7.81 145 S 8.10 4.30 0.00 3.76 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 0.00 146 Y 8.04 4.01 0.00 2.90 3.21 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 0.00 147 L 8.11 4.14 0.00 1.88 1.75 1.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 148 S 7.12 4.17 0.00 3.96 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 L 8.09 4.12 0.00 1.64 1.56 0.94 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 150 E 8.75 4.27 0.00 1.99 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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