NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9884 8.3549 109.7371 45.2647 0.0000 175.1550 2 S 4.5636 8.4501 119.7768 56.0568 66.7378 171.2381 3 S 4.4883 8.3800 115.8107 56.7749 66.0359 173.8564 4 G 3.8234 8.5664 116.3792 45.0154 0.0000 173.4414 5 S 4.2447 8.6801 120.9298 60.3483 62.9303 174.4314 6 S 4.5149 7.7438 113.2426 57.6295 63.1296 172.6282 7 G 4.2091 7.8188 111.1947 45.4939 0.0000 173.1587 8 V 4.7093 8.4060 119.9866 61.0264 32.7866 175.9536 9 R 4.5825 8.2524 121.3364 55.0712 33.7266 174.4427 10 Y 4.9413 7.5993 115.9303 56.6085 41.8347 174.6867 11 F 5.1181 8.9896 123.1395 55.6185 42.8285 174.5579 12 I 4.5576 8.4966 124.1490 60.6881 38.6598 174.6172 13 M 4.9201 8.6061 127.6945 53.5007 33.9656 175.5963 14 K 5.0563 8.8315 123.4465 55.6250 34.1613 176.2640 15 S 4.8885 9.3606 117.8984 56.8657 64.7588 174.3855 16 S 4.1765 9.4794 123.9790 61.4669 62.6906 173.9133 17 N 5.1880 7.8641 113.0347 50.8495 42.3651 174.9715 18 L 4.2093 8.5405 119.1915 58.3505 42.2828 177.9605 19 R 3.8392 8.1059 118.1971 60.0787 29.4270 177.4598 20 N 4.5769 8.5299 115.2875 56.8657 38.4637 176.8827 21 L 4.1709 8.7629 121.8460 58.0454 42.1083 178.4653 22 E 3.7635 8.6581 119.0942 59.7679 29.3280 179.3273 23 I 3.4774 7.3268 119.1206 64.5457 36.9786 178.1807 24 S 5.1109 8.4503 114.7972 60.3555 62.0587 175.8127 25 Q 3.4344 7.9197 120.2496 57.5006 28.5864 177.2147 26 Q 4.2399 7.5678 117.2012 58.0523 29.8373 177.8072 27 K 4.1058 8.0196 118.7207 57.2415 32.3642 177.8790 28 G 4.1110 8.6783 106.6345 46.8240 0.0000 172.2350 29 I 5.2739 7.4580 111.4350 59.1766 42.1287 173.1033 30 W 5.6716 8.9487 130.6800 56.3256 34.4685 172.9214 31 S 4.4800 6.7680 120.8838 56.6821 63.6568 172.9254 32 T 4.3641 8.3318 120.8773 59.5937 70.0880 173.2018 33 T 3.8638 8.1345 117.9797 61.5892 67.5911 172.5116 34 P 4.7426 0.0000 0.0000 63.5903 31.2845 176.8645 35 S 4.5311 7.7703 114.2681 59.4134 63.5283 174.2383 36 N 4.9749 7.9248 115.7536 52.3620 40.2647 175.8547 37 E 3.8490 8.3382 120.2666 60.1862 29.6993 178.4372 38 R 3.5179 7.7959 116.7716 59.3253 30.2470 177.5384 39 K 3.6218 7.8249 117.0710 60.5110 32.3939 178.1982 40 L 3.3702 7.2389 119.8461 57.4603 41.2743 179.0620 41 N 3.7372 7.4847 115.3670 55.4033 38.6672 176.9095 42 R 3.3279 7.6719 119.6619 59.4705 30.1692 178.2867 43 A 3.9665 8.2499 120.3994 55.5941 18.1770 179.4311 44 F 4.0880 7.5685 116.7371 60.8700 39.3930 176.6071 45 W 4.6726 8.2578 117.5805 57.9108 29.4435 177.3503 46 E 4.5901 7.9533 115.4437 55.4407 29.7763 175.5069 47 S 4.7559 7.6144 114.7831 56.4005 67.0824 174.2608 48 S 4.1230 8.6620 117.0540 61.1203 62.5660 173.9262 49 I 4.6796 7.1540 118.3406 59.7554 42.3918 174.6235 50 V 4.3511 8.0001 121.7844 61.4284 34.2025 173.4107 51 Y 4.7381 8.1885 126.9456 57.3979 39.2867 174.8396 52 L 5.0040 8.9029 124.5467 52.7512 44.7385 176.3075 53 V 4.3380 8.2949 125.9801 62.3179 32.2495 175.1389 54 F 5.0322 8.8936 127.7511 57.2775 40.7110 175.1219 55 S 4.8863 8.9941 115.9138 57.2061 66.3371 172.9429 56 V 4.5441 8.5096 127.0023 62.2674 31.6787 174.8466 57 Q 3.6981 9.2017 131.0420 60.2720 28.5715 178.4498 58 G 3.6175 8.6764 106.1566 46.6694 0.0000 173.2249 59 S 4.0083 8.2922 111.1827 58.5217 63.9522 175.2484 60 G 4.2366 8.5943 113.1941 46.2668 0.0000 172.6092 61 H 3.9729 7.3897 115.7875 53.0933 32.6591 173.4622 62 F 4.7188 8.1042 119.0162 56.4035 38.3215 177.1941 63 Q 4.1962 8.3502 126.2780 57.7705 29.6572 177.1778 64 G 3.8520 7.2728 104.0947 44.3067 0.0000 172.2670 65 F 5.2885 7.3244 115.3870 56.0511 41.9342 174.0216 66 S 5.1119 9.1959 115.7502 56.4680 67.6017 173.2251 67 R 4.4754 8.5970 121.0360 55.2654 30.9347 175.3501 68 M 4.2510 8.9814 124.3778 56.7273 32.0312 175.6360 69 S 4.8433 8.4203 117.9646 58.7283 64.7317 173.5629 70 S 4.8525 7.6807 111.9378 56.0035 65.8096 173.1695 71 E 4.2832 8.7895 122.1586 56.1125 31.0628 175.4634 72 I 4.1194 8.5915 120.4725 61.6012 38.1036 172.8642 73 G 3.8782 9.1167 117.3226 44.4302 0.0000 174.9669 74 R 3.9515 8.8086 121.6513 58.9677 31.3995 176.3702 75 E 4.3684 8.1520 117.5341 55.7778 30.2828 175.7148 76 K 4.8274 8.3902 121.7028 54.8387 36.1628 175.0705 77 S 4.7335 8.5650 115.1010 56.9568 65.6225 171.7262 78 Q 4.4712 8.0881 118.7445 57.2432 31.0357 174.8851 79 D 4.2555 7.6469 116.3150 55.0005 41.2361 176.2691 80 W 4.7749 8.1568 121.2595 56.5357 32.8427 174.4568 81 G 3.8315 9.3223 109.0236 47.0258 0.0000 174.1986 82 S 4.5786 7.7526 117.2078 56.1084 63.7514 174.5903 83 A 4.2682 8.7566 129.7789 55.0706 18.5581 178.6097 84 G 3.9570 7.1303 103.9944 45.7840 0.0000 172.0288 85 L 4.6673 7.1183 121.6187 53.6622 46.2608 177.4845 86 G 3.8592 8.1439 103.5609 45.1024 0.0000 171.6245 87 G 4.0711 8.4723 113.5514 45.6632 0.0000 170.7351 88 V 4.7323 8.2760 125.3403 61.1938 34.0370 174.4338 89 F 5.0845 8.4779 120.0065 55.1887 41.9871 173.9780 90 K 4.8439 8.7024 118.9569 56.6264 33.9109 176.3381 91 V 4.4236 8.0090 112.9702 60.4415 36.3393 173.5636 92 E 4.3758 9.1969 127.5602 54.8618 30.6333 175.0477 93 W 4.3395 8.6976 127.8356 56.0657 29.4092 175.8073 94 I 4.0430 7.6524 125.6205 62.4524 36.9301 176.0485 95 R 4.5607 6.7543 118.1378 54.3943 32.3421 176.3596 96 K 4.4075 8.6159 119.9504 55.9932 32.9979 175.6167 97 E 4.3210 8.0553 119.9783 55.3959 30.4926 175.5613 98 S 4.7034 8.5744 120.2517 57.8997 63.3317 172.6683 99 L 4.2260 8.4536 130.1075 52.5160 43.7276 173.5571 100 P 3.7430 0.0000 0.0000 62.4451 32.1185 176.9481 101 F 4.3439 8.6351 123.0357 61.3306 38.7408 177.6098 102 Q 4.0348 8.3749 118.2068 59.5440 28.5630 179.2993 103 F 4.0435 8.7776 118.0784 60.1781 39.2327 176.1717 104 A 4.6230 8.2558 120.2197 52.3077 18.7606 178.5244 105 H 4.4516 7.9518 121.2557 60.1671 30.0968 176.4842 106 H 4.4973 8.2529 114.0444 57.5494 28.7857 175.9695 107 L 4.0259 6.9974 118.8823 54.4849 41.9077 175.9520 108 L 4.6946 7.9691 120.6647 53.3755 46.0553 175.4508 109 N 4.7449 8.6066 117.5002 51.2167 39.2592 172.5760 110 P 4.5673 0.0000 0.0000 63.4965 31.4732 177.4572 111 W 4.5536 8.1428 119.3969 58.4265 29.7632 176.2266 112 N 4.9072 7.5470 115.2678 51.7977 36.6428 173.6375 113 D 4.5686 8.4939 129.8772 59.1983 39.1675 173.8079 114 N 4.7381 7.9085 109.4117 53.4051 36.5686 175.0193 115 K 4.3956 7.7054 118.8332 54.6659 34.0654 176.8127 116 K 4.1922 8.4356 122.8691 56.2466 32.4510 176.3164 117 V 3.5081 7.6130 124.3421 66.2931 31.8115 177.2421 118 Q 4.4141 8.3194 117.8256 59.7131 28.7792 178.9703 119 I 4.1426 7.2541 119.5510 60.6830 34.4992 174.8890 120 S 4.6358 7.5282 116.0194 56.6735 67.0835 174.8828 121 R 4.3052 8.5283 124.1808 55.1673 30.7815 175.9190 122 D 4.5404 8.5275 119.4125 54.8014 39.6519 176.4499 123 G 3.8408 8.6441 112.2334 46.9387 0.0000 173.0737 124 Q 4.7640 7.9123 117.7415 53.4951 31.3109 175.3669 125 E 4.3734 9.1250 125.4113 56.2430 30.5394 175.3217 126 L 4.4317 8.4099 129.3954 52.5885 44.1129 175.6059 127 E 2.5400 7.6603 127.0465 55.8415 28.9371 175.9106 128 P 3.8925 0.0000 0.0000 64.5419 29.9128 178.1612 129 Q 4.0976 7.5058 119.7328 58.5512 29.1787 177.1730 130 V 4.0358 7.2365 112.1028 62.6820 32.0044 178.2010 131 G 3.0351 7.4893 104.9763 46.2631 0.0000 175.3416 132 E 4.0532 6.9702 122.0022 58.3296 29.9271 178.5019 133 Q 4.2538 7.0430 115.6012 57.3865 28.6889 177.2077 134 L 4.1308 7.3171 121.5829 57.4303 42.1955 178.5582 135 L 4.0668 7.5187 118.8896 57.8724 41.6740 179.0811 136 Q 4.2953 8.1949 117.0714 59.5174 28.0152 179.0212 137 L 4.0851 7.5960 120.6397 57.8635 41.8674 179.3771 138 W 4.4004 9.1523 118.5667 59.3174 28.7289 177.8371 139 E 4.3676 8.5697 117.8152 58.1468 29.1952 177.7077 140 R 4.2912 8.3333 117.1010 57.4307 30.8132 176.5098 141 L 4.1995 7.4287 121.7238 54.9608 41.5142 176.6695 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 G 8.35 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 2 S 8.45 4.56 0.00 3.89 3.71 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 3 S 8.38 4.49 0.00 3.78 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 4 G 8.57 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 S 8.68 4.24 0.00 3.85 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 6 S 7.74 4.51 0.00 3.87 3.73 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 7 G 7.82 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 8 V 8.41 4.71 1.84 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 0.70 0.00 0.00 0.34 0.00 0.00 9 R 8.25 4.58 0.00 1.59 1.40 0.00 3.21 0.00 0.00 3.34 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 10 Y 7.60 4.94 0.00 2.75 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 11 F 8.99 5.12 0.00 2.87 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 I 8.50 4.56 1.96 0.00 0.00 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 1.27 1.15 1.06 0.00 0.00 13 M 8.61 4.92 0.00 1.96 1.28 0.00 0.00 0.00 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.09 0.00 14 K 8.83 5.06 0.00 1.76 1.85 0.00 1.84 0.00 0.00 1.88 0.00 0.00 2.97 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.51 1.46 7.81 15 S 9.36 4.89 0.00 4.11 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 16 S 9.48 4.18 0.00 3.99 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 17 N 7.86 5.19 0.00 2.76 2.78 0.00 0.00 6.91 7.91 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 18 L 8.54 4.21 0.00 1.72 1.67 0.96 0.77 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 19 R 8.11 3.84 0.00 1.98 2.01 0.00 3.32 0.00 0.00 3.33 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.88 0.00 20 N 8.53 4.58 0.00 3.13 3.22 0.00 0.00 6.83 6.85 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 21 L 8.76 4.17 0.00 1.85 1.88 0.68 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 22 E 8.66 3.76 0.00 2.08 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 2.53 2.47 0.00 23 I 7.33 3.48 1.67 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 0.85 0.30 -0.15 0.00 0.00 24 S 8.45 5.11 0.00 4.42 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 25 Q 7.92 3.43 0.00 1.82 1.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.19 6.14 0.00 0.00 0.00 0.00 0.00 1.16 1.91 0.00 26 Q 7.57 4.24 0.00 1.89 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.99 0.00 0.00 0.00 0.00 0.00 2.28 2.25 0.00 27 K 8.02 4.11 0.00 1.65 1.76 0.00 1.63 0.00 0.00 1.58 0.00 0.00 2.96 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.42 1.29 7.81 28 G 8.68 4.11 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 0.00 0.00 0.00 29 I 7.46 5.27 2.02 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 1.25 0.70 0.99 0.00 0.00 30 W 8.95 5.67 0.00 3.27 2.40 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 31 S 6.77 4.48 0.00 3.22 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 32 T 8.33 4.36 4.56 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 1.26 0.00 0.00 33 T 8.13 3.86 4.22 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 1.27 0.00 0.00 34 P 0.00 4.74 0.00 2.18 2.10 0.00 3.36 0.00 0.00 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.90 0.00 35 S 7.77 4.53 0.00 3.86 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 36 N 7.92 4.97 0.00 2.62 2.71 0.00 0.00 7.02 7.98 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 37 E 8.34 3.85 0.00 1.90 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 2.27 2.52 0.00 38 R 7.80 3.52 0.00 1.75 1.75 0.00 3.28 0.00 0.00 3.22 7.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.63 0.00 39 K 7.82 3.62 0.00 1.74 1.99 0.00 1.54 0.00 0.00 1.77 0.00 0.00 3.06 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.23 0.93 7.81 40 L 7.24 3.37 0.00 1.24 1.16 0.54 -0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 41 N 7.48 3.74 0.00 2.07 1.81 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 42 R 7.67 3.33 0.00 1.58 1.74 0.00 3.31 0.00 0.00 3.18 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.72 0.00 43 A 8.25 3.97 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 44 F 7.57 4.09 0.00 2.97 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 45 W 8.26 4.67 0.00 3.47 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 7.95 4.59 0.00 1.96 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 0.00 2.36 2.38 0.00 47 S 7.61 4.76 0.00 3.89 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 48 S 8.66 4.12 0.00 3.78 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 49 I 7.15 4.68 1.44 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.48 0.55 0.00 0.00 50 V 8.00 4.35 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 1.14 0.00 0.00 51 Y 8.19 4.74 0.00 2.13 2.35 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 52 L 8.90 5.00 0.00 1.35 1.12 1.14 0.62 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 53 V 8.29 4.34 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 0.95 0.00 0.00 0.86 0.00 0.00 54 F 8.89 5.03 0.00 3.05 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 S 8.99 4.89 0.00 4.26 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 56 V 8.51 4.54 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 0.91 0.00 0.00 1.08 0.00 0.00 57 Q 9.20 3.70 0.00 2.17 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.80 6.82 0.00 0.00 0.00 0.00 0.00 2.44 2.42 0.00 58 G 8.68 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 59 S 8.29 4.01 0.00 3.91 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 60 G 8.59 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 0.00 0.00 0.00 0.00 61 H 7.39 3.97 0.00 2.85 3.04 0.00 5.84 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 F 8.10 4.72 0.00 3.26 3.56 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 63 Q 8.35 4.20 0.00 2.54 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.57 0.00 0.00 0.00 0.00 0.00 2.66 2.62 0.00 64 G 7.27 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 F 7.32 5.29 0.00 3.09 2.67 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 66 S 9.20 5.11 0.00 3.33 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 67 R 8.60 4.48 0.00 1.73 2.06 0.00 2.97 0.00 0.00 3.39 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.65 0.00 68 M 8.98 4.25 0.00 1.87 2.03 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.89 2.07 0.00 69 S 8.42 4.84 0.00 3.99 3.87 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 70 S 7.68 4.85 0.00 3.90 3.70 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 71 E 8.79 4.28 0.00 2.42 2.49 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 2.41 2.50 0.00 72 I 8.59 4.12 1.86 0.00 0.00 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.17 1.04 0.00 0.00 73 G 9.12 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 74 R 8.81 3.95 0.00 1.82 2.07 0.00 3.25 0.00 0.00 3.25 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.73 0.00 75 E 8.15 4.37 0.00 2.29 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 2.46 2.35 0.00 76 K 8.39 4.83 0.00 1.71 1.69 0.00 1.74 0.00 0.00 1.69 0.00 0.00 2.97 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.53 1.38 7.81 77 S 8.56 4.73 0.00 3.87 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 78 Q 8.09 4.47 0.00 1.98 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.63 0.00 0.00 0.00 0.00 0.00 2.21 2.39 0.00 79 D 7.65 4.26 0.00 2.33 2.35 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 80 W 8.16 4.77 0.00 3.31 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 G 9.32 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 82 S 7.75 4.58 0.00 3.74 3.73 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 83 A 8.76 4.27 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 84 G 7.13 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 0.00 0.00 0.00 85 L 7.12 4.67 0.00 1.37 1.25 0.10 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 86 G 8.14 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 G 8.47 4.07 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 0.00 88 V 8.28 4.73 2.37 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 1.26 0.00 0.00 1.06 0.00 0.00 89 F 8.48 5.08 0.00 3.31 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 90 K 8.70 4.84 0.00 1.79 1.82 0.00 1.74 0.00 0.00 1.86 0.00 0.00 2.87 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.73 1.52 7.81 91 V 8.01 4.42 1.87 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 0.71 0.00 0.00 0.88 0.00 0.00 92 E 9.20 4.38 0.00 2.05 1.87 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 2.29 2.46 0.00 93 W 8.70 4.34 0.00 3.08 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 I 7.65 4.04 0.61 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.36 0.92 0.00 0.00 95 R 6.75 4.56 0.00 1.09 1.70 0.00 3.19 0.00 0.00 3.42 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.63 0.00 96 K 8.62 4.41 0.00 1.64 1.66 0.00 1.55 0.00 0.00 1.27 0.00 0.00 2.27 0.00 0.00 2.69 0.00 0.00 0.00 0.00 0.87 1.27 7.81 97 E 8.06 4.32 0.00 2.03 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 0.00 2.31 2.39 0.00 98 S 8.57 4.70 0.00 3.94 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 99 L 8.45 4.23 0.00 0.54 0.72 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 100 P 0.00 3.74 0.00 2.14 2.11 0.00 2.93 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 1.53 1.70 0.00 101 F 8.64 4.34 0.00 3.03 3.01 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 0.00 102 Q 8.37 4.03 0.00 2.24 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.97 0.00 0.00 0.00 0.00 0.00 2.54 2.58 0.00 103 F 8.78 4.04 0.00 3.03 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 0.00 104 A 8.26 4.62 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 0.00 105 H 7.95 4.45 0.00 3.30 3.42 0.00 5.75 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 H 8.25 4.50 0.00 3.29 3.37 0.00 5.58 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 L 7.00 4.03 0.00 1.81 1.50 0.89 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 108 L 7.97 4.69 0.00 1.55 1.53 0.92 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 109 N 8.61 4.74 0.00 2.73 2.92 0.00 0.00 7.71 7.51 0.00 0.00 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 P 0.00 4.57 0.00 2.34 2.20 0.00 3.81 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 1.99 0.00 111 W 8.14 4.55 0.00 3.37 3.32 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 0.00 112 N 7.55 4.91 0.00 2.86 2.99 0.00 0.00 6.41 8.22 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 0.00 113 D 8.49 4.57 0.00 2.84 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 0.00 114 N 7.91 4.74 0.00 2.78 2.97 0.00 0.00 7.29 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 K 7.71 4.40 0.00 1.91 1.72 0.00 1.72 0.00 0.00 1.58 0.00 0.00 3.06 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.69 1.52 7.81 116 K 8.44 4.19 0.00 1.77 1.66 0.00 1.61 0.00 0.00 1.64 0.00 0.00 2.60 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.58 1.63 7.81 117 V 7.61 3.51 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 0.78 0.00 0.00 0.94 0.00 0.00 118 Q 8.32 4.41 0.00 1.92 2.23 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 2.10 2.13 0.00 119 I 7.25 4.14 2.04 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 1.21 0.45 0.91 0.00 0.00 120 S 7.53 4.64 0.00 3.96 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 0.00 121 R 8.53 4.31 0.00 1.85 1.93 0.00 3.24 0.00 0.00 3.31 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.65 0.00 122 D 8.53 4.54 0.00 2.86 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 0.00 123 G 8.64 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 0.00 124 Q 7.91 4.76 0.00 2.18 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 7.13 0.00 0.00 0.00 0.00 0.00 2.47 2.39 0.00 125 E 9.13 4.37 0.00 2.27 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 0.00 2.40 2.29 0.00 126 L 8.41 4.43 0.00 1.45 1.44 0.83 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 127 E 7.66 2.54 0.00 1.16 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 2.03 1.69 0.00 128 P 0.00 3.89 0.00 2.24 2.26 0.00 3.31 0.00 0.00 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.97 0.00 129 Q 7.51 4.10 0.00 2.02 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.00 6.80 0.00 0.00 0.00 0.00 0.00 2.31 2.38 0.00 130 V 7.24 4.04 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 0.86 0.00 0.00 0.81 0.00 0.00 131 G 7.49 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 0.00 0.00 0.00 132 E 6.97 4.05 0.00 2.31 2.06 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 2.26 2.03 0.00 133 Q 7.04 4.25 0.00 2.24 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.01 6.94 0.00 0.00 0.00 0.00 0.00 2.41 2.25 0.00 134 L 7.32 4.13 0.00 1.77 1.72 0.70 0.34 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 0.00 135 L 7.52 4.07 0.00 1.42 1.06 -0.50 -0.14 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 0.00 136 Q 8.19 4.30 0.00 2.30 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.85 0.00 0.00 0.00 0.00 0.00 2.54 2.56 0.00 137 L 7.60 4.09 0.00 1.80 1.72 0.99 0.99 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 0.00 138 W 9.15 4.40 0.00 3.67 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 0.00 139 E 8.57 4.37 0.00 2.11 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 2.47 2.51 0.00 140 R 8.33 4.29 0.00 2.10 2.11 0.00 3.16 0.00 0.00 3.23 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.79 0.00 141 L 7.43 4.20 0.00 1.77 1.53 0.67 0.18 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