NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3919 8.3044 120.3494 54.8747 33.4164 174.9722 2 I 3.6803 8.3247 126.2084 60.9636 38.8271 173.2961 3 Q 4.8447 8.3420 124.5951 54.1739 33.6598 173.7923 4 S 5.1737 8.6305 116.1128 56.8673 66.4632 173.0292 5 Q 4.8484 8.9553 120.3880 54.5649 30.6076 175.7616 6 I 4.4427 8.3662 111.1310 60.0074 39.1097 174.6648 7 N 4.8543 7.8602 120.1397 51.0632 40.5843 174.5369 8 R 3.9323 8.6708 124.0867 59.5368 29.2385 178.3095 9 N 4.3541 8.7582 117.2849 55.8248 38.3913 177.3851 10 I 3.6673 7.4515 121.6870 64.6433 37.1918 178.7022 11 R 4.0174 7.8950 118.2179 59.0203 30.0647 178.9702 12 L 3.9987 8.1954 119.1911 57.6769 41.6934 179.1434 13 D 4.3709 8.6025 119.4783 57.2245 40.6715 178.5226 14 L 3.9433 8.0191 120.6543 58.0206 42.0315 178.6577 15 A 4.1145 8.2800 121.0059 55.4573 18.2424 179.3066 16 D 4.3009 8.0256 116.4250 57.5131 40.9377 178.9310 17 A 3.9967 7.8997 120.8054 55.1642 18.3961 179.7116 18 I 3.6609 8.1157 118.6490 64.6211 37.1931 178.6705 19 L 4.0558 8.3356 120.1907 57.5720 41.3231 179.3847 20 L 3.9115 8.0990 120.3345 58.1566 42.0193 178.9051 21 S 4.0305 8.1069 113.0388 61.2442 62.3393 175.7552 22 K 3.7127 8.5178 122.3853 59.6721 31.8577 178.5151 23 A 3.9480 8.1062 120.7669 55.1329 18.0953 179.7530 24 K 3.9502 8.1583 116.2775 59.1504 32.2177 178.8274 25 K 4.2016 8.1016 115.9461 55.3361 32.8217 175.8946 26 D 4.2865 7.7327 117.9940 55.0745 40.1114 173.1175 27 L 4.6868 7.7187 116.4640 53.6084 43.8334 177.2544 28 S 4.6611 8.4569 115.6914 56.7527 66.5279 175.4333 29 F 4.2065 8.3313 121.2458 60.5347 38.6350 177.8291 30 A 4.0628 8.0680 120.0388 55.3664 18.0937 179.3815 31 E 3.9595 8.2837 116.0443 59.6170 29.5720 179.4182 32 I 3.8578 7.5187 118.5334 64.2777 37.5175 178.0463 33 A 4.2451 8.2922 121.1116 53.1486 18.2679 177.0103 34 D 4.4704 7.2044 117.6699 55.7319 41.5579 176.4917 35 G 4.0493 9.0989 114.9462 45.6318 0.0000 174.0479 36 T 4.0721 7.5709 114.9296 63.7089 68.9272 176.1695 37 G 3.9375 8.2841 107.4888 45.5879 0.0000 172.9590 38 L 4.7367 7.4760 117.7766 51.9223 44.8576 176.8055 39 A 4.1608 8.3031 122.9019 52.0828 20.2339 178.4366 40 E 3.9127 8.9251 122.8258 59.5951 29.7000 179.4908 41 A 3.9190 7.9363 120.1996 54.9296 18.4941 179.3083 42 F 3.9425 8.1209 118.7655 61.3745 39.6776 177.5776 43 V 3.6231 8.1088 117.9723 66.1599 31.3383 178.1039 44 T 3.7534 8.1930 115.5471 66.6295 68.2781 176.2744 45 A 3.8337 7.8399 122.3127 55.1425 18.2517 179.6283 46 A 4.1177 7.4404 120.3515 54.7798 18.2466 179.7425 47 L 3.9849 7.7246 116.3034 57.8180 41.7705 178.9068 48 L 4.4340 7.6591 115.9267 54.6449 41.6490 177.6482 49 G 3.9234 8.1433 107.3941 45.5369 0.0000 174.2918 50 Q 4.5199 8.1629 116.4136 55.4794 29.8035 175.1000 51 Q 4.4170 7.3864 115.9418 54.4541 32.8734 172.6265 52 A 4.8506 8.2838 121.2199 50.6680 20.6697 176.7209 53 L 4.6109 8.7123 122.5883 53.1455 43.4618 175.0959 54 P 4.4937 0.0000 0.0000 62.6653 32.4347 177.1980 55 A 3.9781 8.8686 123.7719 55.7553 18.2994 180.0620 56 D 4.3117 8.1057 116.5239 57.3654 40.8780 178.6646 57 A 4.0229 8.0331 120.6497 55.0863 18.4374 179.3379 58 A 3.9530 8.2849 119.4384 55.4494 18.3765 180.1488 59 R 3.8822 8.1642 116.6047 59.0712 30.1669 179.0473 60 L 3.9365 8.0169 120.1180 58.4512 42.2163 179.5961 61 V 3.8009 8.1773 112.6784 64.1775 31.3410 178.8673 62 G 3.6118 8.3571 105.5732 47.6225 0.0000 175.6764 63 A 3.9989 8.3360 123.4928 54.9387 18.2228 179.7623 64 K 3.8942 7.7912 115.6481 59.0547 32.2272 178.5313 65 L 4.4225 7.7852 115.7232 53.2902 42.5827 175.8865 66 D 4.3982 7.5965 117.8453 55.2214 38.8091 173.9808 67 L 4.3288 8.0537 118.1723 53.9745 43.0168 177.8936 68 D 4.7032 8.2776 122.1975 52.8732 41.9187 177.2763 69 E 4.0031 8.5417 118.1454 59.5899 29.3504 179.2211 70 D 4.3594 8.0459 118.5659 57.3631 40.9375 178.8485 71 S 4.1307 8.6779 115.9526 61.6950 62.6353 176.8031 72 I 3.7380 7.5004 121.2956 64.0824 37.0877 177.8817 73 L 4.2299 8.1160 121.3018 58.3356 41.9549 178.9400 74 L 4.0004 8.2829 119.1988 58.0099 41.4861 179.6277 75 L 4.0916 8.1174 118.4573 57.2791 41.2995 178.7595 76 Q 4.6324 7.6444 117.4986 55.6595 29.3949 176.0677 77 M 4.4925 7.1801 120.1684 55.0209 33.0787 176.3809 78 I 4.0490 8.7033 124.4384 60.7534 38.1498 174.2354 79 P 4.6996 0.0000 0.0000 62.2008 32.8825 176.2277 80 L 4.3180 8.3112 123.3206 54.1731 41.5234 176.5338 81 R 4.1986 8.3424 125.0366 55.5397 30.8783 175.3471 82 G 3.1643 8.1854 110.8813 45.2133 0.0000 172.9044 83 C 4.2963 7.9587 121.9228 58.6768 30.7309 174.3877 84 I 4.1156 7.4425 122.1236 60.1857 37.6614 174.8334 85 D 4.4668 8.8862 125.6341 57.1346 41.5661 176.5923 86 D 4.6334 7.3951 115.1404 53.1398 41.5600 173.5268 87 R 4.2895 8.1627 126.7904 56.2663 28.9811 176.8878 88 I 3.9747 7.1284 116.0625 58.2586 38.9915 174.0415 89 P 4.4070 0.0000 0.0000 63.0562 31.7563 176.4941 90 T 4.1935 8.3425 111.3629 63.2675 69.8655 175.3436 91 D 4.5294 7.9722 122.3473 53.0542 42.7277 174.4284 92 P 4.3342 0.0000 0.0000 66.2318 31.2317 178.7485 93 T 3.9424 8.0238 112.4024 67.1683 68.6281 176.1488 94 M 4.4866 8.2217 120.6282 58.2973 32.0155 178.4140 95 F 4.0745 9.1781 121.5107 61.5611 39.4123 177.3355 96 R 4.0207 8.1656 117.4706 59.3029 29.2633 179.0659 97 F 4.0536 7.8886 117.6360 60.4638 38.8823 177.0923 98 Y 4.0119 7.8268 118.8399 60.6176 38.6293 177.5660 99 E 3.6204 8.1246 120.6286 59.3190 29.6270 178.4639 100 M 4.1046 8.1159 118.9353 58.5741 31.9431 178.7355 101 L 4.0221 7.3705 117.8205 57.6381 41.6063 179.3634 102 Q 3.7706 7.4461 117.2613 58.4262 28.5805 178.6265 103 V 3.7013 7.5746 118.3110 65.0613 32.1621 176.8429 104 Y 4.7081 8.0548 114.1863 57.5570 38.2917 177.7748 105 G 3.6322 8.2435 109.6357 48.1953 0.0000 176.3210 106 T 3.9984 7.8357 111.9903 64.5740 68.8511 176.7411 107 T 3.9041 7.9077 118.2535 66.4431 68.4875 176.3958 108 L 4.0171 8.4958 121.3659 57.5241 41.6560 179.3342 109 K 3.7704 8.1406 119.2690 59.5131 32.1712 178.5071 110 A 4.0431 8.2119 121.0537 55.4395 18.2716 179.6840 111 L 4.0534 8.4134 117.7550 57.5486 41.6042 179.9025 112 V 3.7992 8.0961 118.7355 66.4884 31.1541 177.9032 113 H 4.8854 8.2173 117.3004 58.2467 28.2736 177.5177 114 E 3.9515 8.0778 120.4969 59.3206 29.6139 178.7600 115 K 3.9330 8.1886 117.5242 58.1676 32.1266 177.4139 116 F 4.0346 8.8204 115.0824 59.8717 41.1324 175.1375 117 G 4.0495 8.0106 104.5068 42.7441 0.0000 171.9815 118 D 4.6511 8.6475 119.1893 54.7686 42.3444 175.0296 119 G 4.3803 7.9358 111.3180 45.3218 0.0000 172.2896 120 I 4.8084 8.4377 115.9528 59.3945 41.9571 174.6315 121 I 4.5994 8.1075 123.4294 59.7845 38.0014 175.9995 122 S 4.1652 9.0719 123.1488 58.4226 62.7674 173.6984 123 A 3.9280 8.4643 128.0838 51.9964 19.0427 176.7911 124 I 4.3297 7.6310 115.9816 63.6526 39.5190 176.7406 125 N 4.7620 8.2256 123.5102 52.1165 37.5857 172.2912 126 F 5.2678 7.9473 121.7326 56.8444 42.7520 172.5222 127 K 4.5224 7.6675 123.3585 54.6453 36.7736 174.8832 128 L 5.5675 8.3348 122.6578 52.5645 45.6539 174.8906 129 D 4.7884 8.3304 121.2424 52.1484 43.1101 173.7403 130 V 4.8797 8.3146 119.2660 61.1344 33.9305 174.7011 131 K 4.7201 9.1471 127.1251 54.4372 35.6200 174.9262 132 K 4.9481 8.6264 125.0239 55.2803 33.8233 175.7368 133 V 4.6016 8.7044 125.7610 60.8488 35.2940 174.2074 134 A 4.5093 8.6728 129.0451 51.9804 19.4167 176.3413 135 D 4.5865 8.9430 122.2673 52.2881 41.9336 175.5220 136 P 4.4067 0.0000 0.0000 65.9380 31.0394 176.8793 137 E 4.1394 8.7553 116.5983 56.0530 29.7569 176.6596 138 G 4.0119 8.6198 108.2379 45.7534 0.0000 175.3169 139 G 3.8387 9.2265 108.3537 43.9430 0.0000 171.6741 140 E 5.1739 8.2978 116.1398 54.6837 33.5319 175.5977 141 R 4.8229 9.2968 120.1000 54.4116 34.5709 174.1100 142 A 5.0435 8.5858 123.0148 50.4811 20.9959 176.3940 143 V 4.2196 9.0030 123.5995 61.3922 33.4386 174.5143 144 I 4.8496 8.4550 129.2488 60.0190 39.2349 175.2033 145 T 4.5044 8.6715 124.7573 61.9385 70.3053 173.6246 146 L 4.7647 8.5213 126.8591 53.1974 43.7451 175.8582 147 D 4.5899 8.4444 123.2192 52.4340 43.5101 174.1012 148 G 4.7299 8.5004 111.8803 43.6528 0.0000 170.6445 149 K 4.2653 8.7219 124.0720 56.2497 33.4775 175.3423 150 Y 4.7361 8.6426 128.9579 57.5250 39.6967 174.3060 151 L 4.4341 8.5027 127.4631 51.9001 44.0315 174.3924 152 P 4.5386 0.0000 0.0000 62.9414 32.8002 176.0396 153 T 4.4766 8.6534 119.1757 62.4334 69.6445 174.2249 154 K 4.8854 8.4958 125.6174 53.5613 35.1385 174.5940 155 P 4.5139 0.0000 0.0000 62.7776 32.0458 176.6917 156 F 4.5222 7.7531 113.9577 57.3636 37.7558 174.3170 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 4.39 0.00 1.98 2.04 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 2.48 2.60 0.00 2 I 8.32 3.68 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 1.42 1.06 0.91 0.00 0.00 3 Q 8.34 4.84 0.00 1.96 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.56 0.00 0.00 0.00 0.00 0.00 2.50 2.27 0.00 4 S 8.63 5.17 0.00 3.81 3.78 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 5 Q 8.96 4.85 0.00 2.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.73 0.00 0.00 0.00 0.00 0.00 2.31 2.42 0.00 6 I 8.37 4.44 1.87 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 1.30 0.66 0.91 0.00 0.00 7 N 7.86 4.85 0.00 2.76 2.68 0.00 0.00 6.92 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 8 R 8.67 3.93 0.00 2.06 2.32 0.00 3.10 0.00 0.00 3.32 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.72 0.00 9 N 8.76 4.35 0.00 2.84 2.91 0.00 0.00 6.86 8.03 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 10 I 7.45 3.67 1.87 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 1.52 0.83 0.91 0.00 0.00 11 R 7.90 4.02 0.00 1.80 1.96 0.00 3.28 0.00 0.00 3.53 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.65 0.00 12 L 8.20 4.00 0.00 1.68 1.71 0.91 0.91 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 13 D 8.60 4.37 0.00 2.89 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 14 L 8.02 3.94 0.00 1.77 1.84 0.92 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 15 A 8.28 4.11 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 16 D 8.03 4.30 0.00 2.93 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 17 A 7.90 4.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 I 8.12 3.66 2.07 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.66 0.95 0.00 0.00 19 L 8.34 4.06 0.00 1.84 1.75 0.99 0.57 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 20 L 8.10 3.91 0.00 1.76 1.81 0.92 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 21 S 8.11 4.03 0.00 3.93 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 22 K 8.52 3.71 0.00 1.77 1.91 0.00 1.09 0.00 0.00 1.14 0.00 0.00 2.18 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.20 1.23 7.81 23 A 8.11 3.95 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 24 K 8.16 3.95 0.00 1.86 1.88 0.00 1.69 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.58 7.81 25 K 8.10 4.20 0.00 1.68 1.81 0.00 1.83 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.42 1.59 7.81 26 D 7.73 4.29 0.00 2.76 2.66 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 27 L 7.72 4.69 0.00 1.54 1.43 0.92 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 28 S 8.46 4.66 0.00 4.03 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 29 F 8.33 4.21 0.00 3.23 3.15 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 30 A 8.07 4.06 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 31 E 8.28 3.96 0.00 2.05 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.35 0.00 32 I 7.52 3.86 1.92 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.51 0.96 0.00 0.00 33 A 8.29 4.25 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 34 D 7.20 4.47 0.00 2.76 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 G 9.10 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 0.00 0.00 0.00 36 T 7.57 4.07 4.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 37 G 8.28 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 38 L 7.48 4.74 0.00 1.70 1.64 1.02 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 39 A 8.30 4.16 1.30 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 0.00 0.00 40 E 8.93 3.91 0.00 2.08 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 2.43 2.47 0.00 41 A 7.94 3.92 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 42 F 8.12 3.94 0.00 3.21 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 43 V 8.11 3.62 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 1.05 0.00 0.00 1.12 0.00 0.00 44 T 8.19 3.75 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 0.29 0.00 0.00 45 A 7.84 3.83 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 46 A 7.44 4.12 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 47 L 7.72 3.98 0.00 1.85 1.85 1.17 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 48 L 7.66 4.43 0.00 1.54 1.64 0.72 0.83 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 49 G 8.14 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 50 Q 8.16 4.52 0.00 1.96 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.59 6.62 0.00 0.00 0.00 0.00 0.00 2.36 2.36 0.00 51 Q 7.39 4.42 0.00 1.47 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.91 0.00 0.00 0.00 0.00 0.00 1.99 1.31 0.00 52 A 8.28 4.85 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 53 L 8.71 4.61 0.00 1.65 1.65 0.95 1.29 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 54 P 0.00 4.49 0.00 2.10 1.99 0.00 3.72 0.00 0.00 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.14 0.00 55 A 8.87 3.98 1.33 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 56 D 8.11 4.31 0.00 2.71 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 57 A 8.03 4.02 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 58 A 8.28 3.95 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 59 R 8.16 3.88 0.00 2.01 2.00 0.00 3.14 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 1.66 1.64 0.00 60 L 8.02 3.94 0.00 1.92 1.83 0.93 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 61 V 8.18 3.80 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 0.96 0.00 0.00 1.05 0.00 0.00 62 G 8.36 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 63 A 8.34 4.00 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 64 K 7.79 3.89 0.00 1.94 1.89 0.00 1.70 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.62 7.81 65 L 7.79 4.42 0.00 1.71 1.68 0.96 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 66 D 7.60 4.40 0.00 2.75 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 67 L 8.05 4.33 0.00 1.61 1.59 0.93 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 68 D 8.28 4.70 0.00 2.95 2.83 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 69 E 8.54 4.00 0.00 2.00 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 0.00 2.40 2.34 0.00 70 D 8.05 4.36 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 71 S 8.68 4.13 0.00 3.98 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 72 I 7.50 3.74 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 1.41 0.58 0.92 0.00 0.00 73 L 8.12 4.23 0.00 1.82 1.86 0.93 0.55 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 74 L 8.28 4.00 0.00 1.85 1.71 0.92 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 75 L 8.12 4.09 0.00 1.88 1.73 0.93 0.87 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 76 Q 7.64 4.63 0.00 2.18 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.87 0.00 0.00 0.00 0.00 0.00 2.53 2.37 0.00 77 M 7.18 4.49 0.00 1.93 2.10 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.88 2.53 0.00 78 I 8.70 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 1.31 0.66 0.92 0.00 0.00 79 P 0.00 4.70 0.00 2.12 2.03 0.00 3.75 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.93 0.00 80 L 8.31 4.32 0.00 1.67 1.65 0.91 0.93 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 81 R 8.34 4.20 0.00 1.82 1.87 0.00 3.26 0.00 0.00 3.20 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.76 0.00 82 G 8.19 3.16 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 0.00 0.00 0.00 0.00 0.00 0.00 83 C 7.96 4.30 0.00 3.06 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 I 7.44 4.12 1.84 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 1.29 0.55 0.92 0.00 0.00 85 D 8.89 4.47 0.00 2.63 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 86 D 7.40 4.63 0.00 2.60 2.48 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 87 R 8.16 4.29 0.00 1.97 2.07 0.00 3.21 0.00 0.00 3.22 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.62 0.00 88 I 7.13 3.97 1.78 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 1.30 0.76 0.84 0.00 0.00 89 P 0.00 4.41 0.00 2.22 2.06 0.00 3.39 0.00 0.00 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.07 0.00 90 T 8.34 4.19 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 1.20 0.00 0.00 91 D 7.97 4.53 0.00 2.85 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 92 P 0.00 4.33 0.00 2.24 2.13 0.00 3.69 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.18 0.00 93 T 8.02 3.94 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 1.35 0.00 0.00 94 M 8.22 4.49 0.00 2.11 2.22 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.60 0.00 95 F 9.18 4.07 0.00 3.27 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 96 R 8.17 4.02 0.00 1.52 1.72 0.00 3.36 0.00 0.00 3.33 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.78 0.00 97 F 7.89 4.05 0.00 3.28 3.11 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 0.00 0.00 0.00 0.00 98 Y 7.83 4.01 0.00 2.93 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 99 E 8.12 3.62 0.00 1.85 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 2.28 2.36 0.00 100 M 8.12 4.10 0.00 2.14 2.30 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.58 0.00 101 L 7.37 4.02 0.00 1.53 1.55 0.90 0.95 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 0.00 102 Q 7.45 3.77 0.00 1.92 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 6.90 0.00 0.00 0.00 0.00 0.00 1.63 2.32 0.00 103 V 7.57 3.70 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.16 0.00 0.00 0.83 0.00 0.00 104 Y 8.05 4.71 0.00 3.22 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 0.00 105 G 8.24 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 0.00 106 T 7.84 4.00 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 1.20 0.00 0.00 107 T 7.91 3.90 4.61 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 1.35 0.00 0.00 108 L 8.50 4.02 0.00 1.84 1.72 0.95 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 109 K 8.14 3.77 0.00 1.83 2.00 0.00 1.68 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.47 1.46 7.81 110 A 8.21 4.04 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 0.00 111 L 8.41 4.05 0.00 1.71 1.76 0.95 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 112 V 8.10 3.80 2.19 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 1.04 0.00 0.00 0.93 0.00 0.00 113 H 8.22 4.89 0.00 3.26 3.35 0.00 5.68 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 E 8.08 3.95 0.00 1.99 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 2.29 2.33 0.00 115 K 8.19 3.93 0.00 1.70 1.15 0.00 1.74 0.00 0.00 1.61 0.00 0.00 3.00 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.32 1.50 7.81 116 F 8.82 4.03 0.00 2.48 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 0.00 117 G 8.01 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 0.00 0.00 0.00 118 D 8.65 4.65 0.00 2.75 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 0.00 119 G 7.94 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 0.00 0.00 0.00 0.00 120 I 8.44 4.81 1.86 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.90 0.92 0.00 0.00 121 I 8.11 4.60 1.82 0.00 0.00 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.68 0.93 0.00 0.00 122 S 9.07 4.17 0.00 3.91 3.98 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 0.00 123 A 8.46 3.93 0.98 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 0.00 0.00 124 I 7.63 4.33 1.88 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 1.27 0.98 0.93 0.00 0.00 125 N 8.23 4.76 0.00 2.79 2.75 0.00 0.00 6.76 8.48 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 0.00 126 F 7.95 5.27 0.00 3.17 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 0.00 127 K 7.67 4.52 0.00 1.42 1.40 0.00 1.58 0.00 0.00 1.49 0.00 0.00 2.74 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.26 1.26 7.81 128 L 8.33 5.57 0.00 1.48 1.44 1.00 1.20 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 0.00 129 D 8.33 4.79 0.00 2.68 2.64 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 0.00 0.00 0.00 0.00 130 V 8.31 4.88 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 0.88 0.00 0.00 0.89 0.00 0.00 131 K 9.15 4.72 0.00 1.70 1.65 0.00 1.70 0.00 0.00 1.58 0.00 0.00 2.81 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.34 1.43 7.81 132 K 8.63 4.95 0.00 1.78 1.71 0.00 1.88 0.00 0.00 1.65 0.00 0.00 2.84 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.37 1.44 7.81 133 V 8.70 4.60 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 0.75 0.00 0.00 0.94 0.00 0.00 134 A 8.67 4.51 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 0.00 135 D 8.94 4.59 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 0.00 136 P 0.00 4.41 0.00 2.21 2.20 0.00 3.81 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.01 0.00 137 E 8.76 4.14 0.00 2.04 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 0.00 2.34 2.25 0.00 138 G 8.62 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 G 9.23 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 E 8.30 5.17 0.00 1.82 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 2.21 2.32 0.00 141 R 9.30 4.82 0.00 1.67 1.78 0.00 3.23 0.00 0.00 3.18 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.55 0.00 142 A 8.59 5.04 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 0.00 143 V 9.00 4.22 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 1.05 0.00 0.00 0.94 0.00 0.00 144 I 8.45 4.85 2.01 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.70 0.96 0.00 0.00 145 T 8.67 4.50 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 146 L 8.52 4.76 0.00 1.65 1.96 1.01 1.19 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 0.00 147 D 8.44 4.59 0.00 2.59 2.38 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 0.00 148 G 8.50 4.73 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 0.00 0.00 0.00 149 K 8.72 4.27 0.00 1.94 1.71 0.00 1.57 0.00 0.00 1.59 0.00 0.00 2.95 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.43 1.45 7.81 150 Y 8.64 4.74 0.00 2.49 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 0.00 151 L 8.50 4.43 0.00 1.44 1.39 0.87 1.03 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 0.00 152 P 0.00 4.54 0.00 2.04 1.94 0.00 3.43 0.00 0.00 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.89 0.00 153 T 8.65 4.48 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 1.32 0.00 0.00 154 K 8.50 4.89 0.00 1.76 1.75 0.00 1.77 0.00 0.00 1.74 0.00 0.00 3.06 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.38 1.44 7.81 155 P 0.00 4.51 0.00 2.02 1.92 0.00 3.69 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.07 0.00 156 F 7.75 4.52 0.00 3.06 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