NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3444 8.3049 118.1931 54.7897 32.9362 175.3393 2 L 3.4177 8.1564 117.3511 54.3105 38.4867 172.4627 3 T 3.9450 8.2821 112.1244 63.7838 70.2673 174.8053 4 D 4.7424 7.7494 120.9013 50.9071 43.8077 173.5535 5 P 4.3093 0.0000 0.0000 66.4745 31.5288 178.2165 6 I 3.3377 7.9054 115.5726 64.6504 37.0969 177.3374 7 A 3.9414 9.7405 122.2375 55.6772 17.6526 179.1738 8 D 4.1755 7.7154 114.6708 57.8957 41.2298 177.8223 9 M 3.9011 8.2423 118.8291 58.6518 32.0985 177.7030 10 L 3.8569 8.3031 119.1283 58.3680 41.9027 179.9060 11 T 3.7479 8.3001 115.3186 66.8210 68.1787 176.5385 12 R 3.8394 9.3386 120.5441 59.7748 29.7294 178.2256 13 I 3.8012 7.9654 120.0242 63.9248 37.2827 177.8197 14 R 3.7378 8.1948 119.5156 60.0213 29.5809 178.3306 15 N 4.2975 8.1399 114.9946 56.1349 38.7502 177.0478 16 A 4.1556 7.7076 121.2233 55.0207 18.3251 179.7947 17 T 4.4769 8.1233 110.0333 64.8760 68.6731 176.8499 18 R 3.0780 7.5587 119.8360 58.1513 30.1321 178.2584 19 V 3.8415 7.1570 109.5842 59.8152 33.6165 174.7042 20 Y 3.6318 8.2441 117.2979 58.4125 34.7994 168.7825 21 K 4.4466 7.6151 120.2392 53.9949 34.1339 174.7310 22 E 3.5000 7.9879 122.5734 59.3869 30.1589 178.0344 23 S 5.1493 7.5012 113.7664 57.4484 67.6856 173.1987 24 T 4.5015 8.2325 115.2361 62.7870 72.6550 174.0132 25 D 5.1132 8.7186 126.3915 54.0082 42.5436 176.0676 26 V 4.3558 8.3576 111.1417 59.4227 36.0365 171.6964 27 P 4.0133 0.0000 0.0000 62.8730 32.1136 175.3052 28 A 4.4791 8.1727 124.1152 51.0951 20.1450 177.4363 29 S 4.3708 8.4541 116.1210 55.9979 65.6771 174.1462 30 R 3.8890 9.1597 128.4562 60.0331 29.6882 177.9424 31 F 4.4494 8.3312 119.3659 61.2379 39.2034 177.0290 32 K 3.7750 8.3865 118.7503 59.1437 31.7775 179.2478 33 E 3.4388 7.8334 118.2846 59.5324 29.4020 178.9478 34 E 4.0594 8.1884 117.4086 59.3934 29.6713 179.5948 35 I 3.8503 6.9768 119.0152 63.9447 37.5128 177.7990 36 L 3.8654 7.2492 119.5952 58.0817 41.4488 179.4579 37 R 4.2233 8.4170 118.5826 59.8707 29.5114 177.8614 38 I 4.1772 8.1338 117.4348 62.3293 37.3635 177.3199 39 L 4.2379 8.4571 120.5361 56.0218 41.8093 178.2137 40 A 4.7861 7.8085 121.5016 53.3200 19.5237 178.9623 41 R 4.0162 7.9444 115.8951 58.4994 30.2402 176.7768 42 E 4.3542 7.6586 114.8932 55.9539 30.0513 176.5400 43 G 3.7894 8.3465 107.2080 45.9354 0.0000 174.9802 44 F 4.6196 8.6518 121.5406 58.7505 39.6697 175.9241 45 I 4.8911 7.3446 112.2584 58.4656 40.1867 176.5101 46 K 3.9786 8.7810 122.2901 57.9217 32.2071 177.2782 47 G 4.4754 7.2276 106.1597 44.0244 0.0000 170.1576 48 Y 6.0448 7.5750 117.9978 54.3636 41.5324 174.2912 49 E 5.1276 8.7121 113.9747 55.7882 31.6981 176.4359 50 R 4.2188 9.1025 122.3536 57.1826 31.1472 176.0085 51 V 4.5884 8.4188 114.4046 60.3288 37.0451 173.6938 52 D 4.5550 8.5831 120.4814 53.6971 43.0701 175.3148 53 V 3.9177 8.2864 127.2953 61.7045 31.0229 174.5751 54 D 4.1958 8.6939 129.1223 55.3846 37.2162 174.8525 55 G 3.9995 8.3249 101.6689 45.9367 0.0000 172.6876 56 K 4.4292 7.4550 118.6420 53.1980 32.9814 172.8871 57 P 4.8902 0.0000 0.0000 63.4857 30.8547 175.3943 58 Y 4.8107 8.3448 126.5192 57.7693 41.2679 174.4295 59 L 4.8603 8.5306 119.9159 54.1312 45.2139 174.9543 60 R 3.8167 8.7069 123.5116 56.5706 31.2053 175.9611 61 V 4.3947 8.2635 125.8345 61.7150 33.2390 174.4882 62 Y 4.5840 9.4494 127.9739 57.0261 38.7720 175.0258 63 L 4.5332 8.4678 125.6683 54.3354 42.6675 176.5654 64 K 4.6208 8.1100 125.0731 55.4787 34.4195 175.2081 65 Y 4.8543 8.6409 124.4375 56.3462 41.2182 173.8137 66 G 4.6316 8.1389 108.6864 44.5564 0.0000 171.4048 67 P 4.7302 0.0000 0.0000 61.5779 32.3546 176.0656 68 R 3.8392 8.5279 122.7162 57.2032 30.6499 175.6454 69 R 4.6886 8.0206 123.2523 54.2844 33.6276 179.4803 70 Q 4.5525 8.1446 118.8532 55.5106 28.8166 182.1916 71 G 4.2698 8.8524 114.8128 44.6593 0.0000 171.3630 72 P 4.1879 0.0000 0.0000 63.4914 32.7531 175.0705 73 D 4.3374 8.6832 117.2719 55.1601 39.3815 172.6557 74 P 4.4891 0.0000 0.0000 63.5117 31.8038 176.7293 75 R 4.2610 7.7649 118.9261 56.2626 30.2685 174.9616 76 P 4.3652 0.0000 0.0000 62.3039 32.5115 175.6799 77 E 4.2942 8.7940 122.8661 56.8066 31.1598 174.8943 78 Q 4.8910 8.2373 119.9752 53.8977 31.1491 176.5436 79 V 3.7868 7.7787 122.0549 65.0394 32.4218 176.1229 80 I 4.2289 7.5004 120.9595 59.8756 37.9787 174.7158 81 H 4.3262 8.3480 122.9473 57.4119 29.6418 175.3120 82 H 4.2270 7.3048 115.9056 55.0099 33.7728 172.8130 83 I 4.6448 7.9622 125.2153 59.3575 40.7658 173.8487 84 R 4.5502 8.4328 130.0463 54.1412 33.1991 174.2884 85 R 4.0879 8.5780 126.9183 57.9638 30.4950 174.3081 86 I 3.6950 8.6524 129.9987 62.7568 36.8867 177.7081 87 S 3.9660 5.8100 125.0766 59.8589 63.5280 173.6991 88 K 4.7449 8.5876 126.5570 53.6120 34.6480 175.8376 89 P 4.2694 0.0000 0.0000 66.0102 31.1283 178.1901 90 G 3.5117 8.0692 107.0740 47.6311 0.0000 173.4203 91 R 4.3846 7.5355 125.3728 53.4773 31.0714 175.4992 92 R 4.1509 8.2430 124.5141 55.8273 31.1058 176.2832 93 V 4.1372 8.3137 120.5386 61.3003 34.3813 173.9483 94 Y 5.2980 8.4348 124.8986 56.4864 40.2294 175.3000 95 V 4.1057 8.7713 118.5867 60.2763 33.9388 178.1383 96 G 4.0530 8.3564 113.2851 45.4407 0.0000 174.0777 97 V 3.8885 8.4156 118.0861 64.1969 32.2846 177.6632 98 K 4.0850 8.0474 118.9632 58.7437 32.0789 177.5554 99 E 4.3890 7.8168 118.8701 55.0174 27.8781 175.2682 100 I 4.7423 7.3179 120.8798 58.5219 41.6488 173.6603 101 P 4.5445 0.0000 0.0000 62.5991 32.0731 177.1159 102 R 4.4739 8.0044 120.3565 53.2214 30.0998 174.1223 103 V 3.2837 7.9925 118.7636 64.5015 31.9665 175.2591 104 R 3.3156 9.5368 124.0191 56.8448 29.1544 175.2326 105 R 3.6818 7.7940 111.0051 57.0953 26.7138 176.5596 106 G 4.1371 8.0777 107.2144 45.9118 0.0000 174.7622 107 L 4.4040 7.7544 116.1565 55.6748 41.5916 176.4432 108 G 4.5157 7.7322 105.4128 44.8642 0.0000 172.3318 109 I 4.6184 8.6718 121.5860 59.9201 40.7959 175.2262 110 A 4.9224 8.4607 124.1619 49.9130 18.9932 175.4933 111 I 3.7925 7.7995 122.7537 61.0251 39.3186 174.9488 112 L 4.4403 7.9695 119.1235 54.3920 46.2166 173.3856 113 S 4.6143 8.6445 123.3983 58.8079 63.4150 172.8544 114 T 5.0428 8.6271 117.5632 59.1909 72.1610 175.1980 115 S 4.3326 8.7283 113.5046 59.6550 62.6582 174.4257 116 K 4.5295 8.1296 120.4654 56.3947 33.3354 176.3501 117 G 3.8574 8.4998 104.4483 44.7794 0.0000 174.1009 118 V 4.4329 7.8481 118.5339 61.8284 30.1034 175.7272 119 L 4.7037 8.3052 127.2602 53.1692 43.6574 175.7594 120 T 4.6859 8.3832 108.6829 61.7403 71.1227 173.8043 121 D 3.9878 7.7774 117.2791 55.9686 40.0387 179.3295 122 R 3.9233 7.7893 118.7030 57.8691 30.5027 178.6565 123 E 4.0078 8.1223 117.2209 59.9030 29.7011 179.8032 124 A 4.1362 9.7705 120.3354 54.9466 18.1726 179.6784 125 R 3.8147 8.1236 117.0378 59.9558 30.2689 177.9842 126 K 3.8808 9.0238 118.8462 59.5077 32.1410 177.9369 127 L 4.0711 8.6866 121.6209 55.7610 42.9807 177.5772 128 G 3.7260 9.8237 104.9379 45.0758 0.0000 172.4372 129 V 4.3912 7.0967 108.8452 60.4163 36.0829 173.8617 130 G 4.2115 7.3793 109.6496 43.0534 0.0000 172.3047 131 G 3.9510 7.6256 102.6824 46.6586 0.0000 172.8786 132 E 5.7545 8.8382 119.3618 53.8808 28.2191 174.4580 133 L 3.7780 8.4738 125.1241 54.9684 43.0101 177.0597 134 I 4.0365 8.4487 128.2511 62.8684 37.6965 176.0398 135 C 5.1245 7.5875 113.8567 57.7184 32.7534 171.4504 136 E 5.0647 8.5380 117.0635 54.8271 32.6137 175.1139 137 V 4.8952 8.3956 119.6173 61.3362 35.7643 174.6734 138 W 4.8467 8.8989 124.1079 57.1560 28.1781 174.1752 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 4.34 0.00 2.14 2.22 0.00 0.00 0.00 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.51 0.00 2 L 8.16 3.42 0.00 1.84 1.69 0.89 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 3 T 8.28 3.94 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 4 D 7.75 4.74 0.00 2.63 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 5 P 0.00 4.31 0.00 2.21 2.05 0.00 3.71 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.16 0.00 6 I 7.91 3.34 2.17 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.38 0.87 0.00 0.00 7 A 9.74 3.94 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 8 D 7.72 4.18 0.00 2.93 2.84 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 9 M 8.24 3.90 0.00 2.14 1.95 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.50 0.00 10 L 8.30 3.86 0.00 1.60 1.63 0.84 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 11 T 8.30 3.75 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 1.17 0.00 0.00 12 R 9.34 3.84 0.00 1.98 2.04 0.00 3.14 0.00 0.00 3.23 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.69 0.00 13 I 7.97 3.80 2.05 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.61 0.83 0.00 0.00 14 R 8.19 3.74 0.00 1.75 2.02 0.00 3.03 0.00 0.00 3.09 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.60 0.00 15 N 8.14 4.30 0.00 2.70 2.82 0.00 0.00 7.02 6.89 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 16 A 7.71 4.16 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 8.12 4.48 4.32 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 1.22 0.00 0.00 18 R 7.56 3.08 0.00 1.94 1.91 0.00 3.08 0.00 0.00 3.44 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.62 0.00 19 V 7.16 3.84 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 0.74 0.00 0.00 1.01 0.00 0.00 20 Y 8.24 3.63 0.00 2.94 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 K 7.62 4.45 0.00 1.70 1.84 0.00 1.83 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.40 7.81 22 E 7.99 3.50 0.00 2.11 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.58 0.00 23 S 7.50 5.15 0.00 3.41 3.50 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 24 T 8.23 4.50 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 1.21 0.00 0.00 25 D 8.72 5.11 0.00 2.75 2.94 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 26 V 8.36 4.36 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 0.80 0.00 0.00 0.81 0.00 0.00 27 P 0.00 4.01 0.00 1.72 1.77 0.00 3.42 0.00 0.00 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.50 0.00 28 A 8.17 4.48 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 29 S 8.45 4.37 0.00 3.81 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 30 R 9.16 3.89 0.00 1.95 2.01 0.00 3.29 0.00 0.00 3.30 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.77 0.00 31 F 8.33 4.45 0.00 3.11 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 32 K 8.39 3.78 0.00 1.97 1.70 0.00 1.74 0.00 0.00 1.54 0.00 0.00 2.84 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.37 1.46 7.81 33 E 7.83 3.44 0.00 2.02 1.66 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 2.21 2.59 0.00 34 E 8.19 4.06 0.00 1.96 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 2.54 2.65 0.00 35 I 6.98 3.85 1.77 0.00 0.00 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.20 0.77 0.00 0.00 36 L 7.25 3.87 0.00 1.16 1.47 0.55 1.06 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 37 R 8.42 4.22 0.00 2.01 2.19 0.00 3.14 0.00 0.00 3.34 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.84 0.00 38 I 8.13 4.18 1.98 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 1.55 0.87 0.97 0.00 0.00 39 L 8.46 4.24 0.00 1.86 1.85 0.97 0.76 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 40 A 7.81 4.79 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 41 R 7.94 4.02 0.00 1.89 2.13 0.00 3.25 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.62 0.00 42 E 7.66 4.35 0.00 1.82 1.64 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 2.38 2.44 0.00 43 G 8.35 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 0.00 0.00 0.00 44 F 8.65 4.62 0.00 3.25 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.34 4.89 2.18 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.90 0.98 0.00 0.00 46 K 8.78 3.98 0.00 2.05 1.96 0.00 1.87 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.53 1.49 7.81 47 G 7.23 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 Y 7.58 6.04 0.00 2.93 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.71 5.13 0.00 2.10 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 0.00 2.45 2.32 0.00 50 R 9.10 4.22 0.00 1.79 1.99 0.00 3.21 0.00 0.00 3.29 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.79 0.00 51 V 8.42 4.59 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 1.12 0.00 0.00 1.02 0.00 0.00 52 D 8.58 4.55 0.00 2.64 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 V 8.29 3.92 1.59 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 0.63 0.00 0.00 0.66 0.00 0.00 54 D 8.69 4.20 0.00 2.90 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 8.32 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 K 7.45 4.43 0.00 2.15 1.96 0.00 1.75 0.00 0.00 1.79 0.00 0.00 3.04 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.40 1.64 7.81 57 P 0.00 4.89 0.00 2.16 2.30 0.00 3.92 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 2.11 1.89 0.00 58 Y 8.34 4.81 0.00 2.90 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 59 L 8.53 4.86 0.00 1.58 1.61 0.76 0.93 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 60 R 8.71 3.82 0.00 1.73 1.38 0.00 3.19 0.00 0.00 3.04 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.70 0.00 61 V 8.26 4.39 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.96 0.00 0.00 62 Y 9.45 4.58 0.00 3.11 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 63 L 8.47 4.53 0.00 1.95 1.40 0.96 1.34 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 64 K 8.11 4.62 0.00 2.16 1.84 0.00 1.68 0.00 0.00 1.66 0.00 0.00 2.83 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.40 1.46 7.81 65 Y 8.64 4.85 0.00 3.06 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 66 G 8.14 4.63 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 67 P 0.00 4.73 0.00 2.08 2.06 0.00 3.82 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.96 0.00 68 R 8.53 3.84 0.00 1.79 1.89 0.00 3.17 0.00 0.00 3.20 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.81 0.00 69 R 8.02 4.69 0.00 1.86 1.85 0.00 3.31 0.00 0.00 3.52 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.70 0.00 70 Q 8.14 4.55 0.00 2.04 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.88 0.00 0.00 0.00 0.00 0.00 2.37 2.31 0.00 71 G 8.85 4.27 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 0.00 72 P 0.00 4.19 0.00 2.06 2.03 0.00 3.84 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.10 0.00 73 D 8.68 4.34 0.00 2.84 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 74 P 0.00 4.49 0.00 2.24 2.25 0.00 3.77 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 2.07 1.98 0.00 75 R 7.76 4.26 0.00 2.01 2.18 0.00 3.27 0.00 0.00 3.65 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.68 0.00 76 P 0.00 4.37 0.00 1.98 1.96 0.00 3.02 0.00 0.00 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 1.58 0.00 77 E 8.79 4.29 0.00 2.11 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 2.37 2.40 0.00 78 Q 8.24 4.89 0.00 1.87 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.93 6.88 0.00 0.00 0.00 0.00 0.00 2.49 2.65 0.00 79 V 7.78 3.79 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.97 0.00 0.00 80 I 7.50 4.23 1.68 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.69 0.61 0.00 0.00 81 H 8.35 4.33 0.00 2.60 2.90 0.00 5.93 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 82 H 7.30 4.23 0.00 2.48 1.43 0.00 5.72 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 I 7.96 4.64 1.58 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.88 0.71 0.00 0.00 84 R 8.43 4.55 0.00 1.85 1.75 0.00 3.19 0.00 0.00 3.20 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.54 0.00 85 R 8.58 4.09 0.00 1.83 1.81 0.00 3.48 0.00 0.00 3.37 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.59 0.00 86 I 8.65 3.70 2.01 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 1.13 0.94 0.89 0.00 0.00 87 S 5.81 3.97 0.00 3.84 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 88 K 8.59 4.74 0.00 1.72 1.65 0.00 1.72 0.00 0.00 1.68 0.00 0.00 2.90 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.34 1.65 7.81 89 P 0.00 4.27 0.00 2.16 2.19 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 1.98 1.97 0.00 90 G 8.07 3.51 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 R 7.54 4.38 0.00 1.89 1.75 0.00 3.04 0.00 0.00 3.11 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.52 0.00 92 R 8.24 4.15 0.00 1.46 1.29 0.00 3.50 0.00 0.00 3.24 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.57 0.00 93 V 8.31 4.14 1.96 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 0.94 0.00 0.00 0.86 0.00 0.00 94 Y 8.43 5.30 0.00 2.90 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 95 V 8.77 4.11 2.43 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 0.72 0.00 0.00 1.01 0.00 0.00 96 G 8.36 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 97 V 8.42 3.89 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 0.78 0.00 0.00 0.97 0.00 0.00 98 K 8.05 4.09 0.00 1.77 1.92 0.00 1.75 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.45 1.47 7.81 99 E 7.82 4.39 0.00 2.06 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 2.31 2.34 0.00 100 I 7.32 4.74 1.88 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 1.44 0.75 0.93 0.00 0.00 101 P 0.00 4.54 0.00 2.05 1.97 0.00 3.64 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.11 0.00 102 R 8.00 4.47 0.00 1.71 1.82 0.00 3.27 0.00 0.00 3.15 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.62 0.00 103 V 7.99 3.28 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 0.98 0.00 0.00 104 R 9.54 3.32 0.00 1.65 1.81 0.00 2.67 0.00 0.00 2.25 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 1.35 0.00 105 R 7.79 3.68 0.00 1.99 2.08 0.00 3.19 0.00 0.00 3.19 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.48 0.00 106 G 8.08 4.14 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 L 7.75 4.40 0.00 1.70 1.80 0.94 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 108 G 7.73 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 I 8.67 4.62 2.12 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 1.27 1.62 1.21 0.00 0.00 110 A 8.46 4.92 1.25 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 0.00 0.00 111 I 7.80 3.79 1.87 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 1.13 0.83 0.89 0.00 0.00 112 L 7.97 4.44 0.00 1.76 1.53 1.06 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 113 S 8.64 4.61 0.00 4.23 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 T 8.63 5.04 4.27 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 1.31 0.00 0.00 115 S 8.73 4.33 0.00 3.99 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 K 8.13 4.53 0.00 1.74 1.79 0.00 1.67 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.37 1.37 7.81 117 G 8.50 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 0.00 118 V 7.85 4.43 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 0.83 0.00 0.00 1.08 0.00 0.00 119 L 8.31 4.70 0.00 1.82 1.62 0.95 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 120 T 8.38 4.69 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 1.36 0.00 0.00 121 D 7.78 3.99 0.00 2.85 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 0.00 122 R 7.79 3.92 0.00 1.89 1.97 0.00 3.18 0.00 0.00 3.35 7.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.75 0.00 123 E 8.12 4.01 0.00 2.27 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.45 0.00 124 A 9.77 4.14 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 0.00 125 R 8.12 3.81 0.00 2.04 2.16 0.00 3.29 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.65 0.00 126 K 9.02 3.88 0.00 1.87 1.96 0.00 1.89 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.47 1.50 7.81 127 L 8.69 4.07 0.00 1.62 1.76 0.93 1.27 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 0.00 128 G 9.82 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 0.00 0.00 0.00 129 V 7.10 4.39 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 0.66 0.00 0.00 0.95 0.00 0.00 130 G 7.38 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 0.00 131 G 7.63 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 E 8.84 5.75 0.00 2.40 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 2.34 2.13 0.00 133 L 8.47 3.78 0.00 1.79 1.62 0.93 1.02 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 0.00 134 I 8.45 4.04 1.91 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 1.60 1.30 0.91 0.00 0.00 135 C 7.59 5.12 0.00 3.10 2.96 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 0.00 136 E 8.54 5.06 0.00 2.19 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 2.25 2.34 0.00 137 V 8.40 4.90 1.78 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 0.20 0.00 0.00 0.77 0.00 0.00 138 W 8.90 4.85 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