NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.5144 8.3344 116.7949 58.2892 64.0226 174.4607 3 T 4.3069 8.7895 117.7254 62.4565 68.3581 171.9265 4 K 3.6202 8.6765 115.1352 55.7987 29.7343 171.9223 5 A 4.3401 7.6487 115.9569 52.1214 20.6117 175.1312 6 Q 4.6375 8.3486 122.3102 57.1701 36.5233 175.7881 7 N 4.7623 7.7848 114.0338 51.7739 40.9288 174.2829 8 P 4.3652 0.0000 0.0000 65.3980 30.7653 178.8607 9 M 4.0632 7.9289 117.2242 58.5056 32.1931 177.1796 10 R 4.3965 7.6069 114.8964 57.0062 30.4947 176.5634 11 D 4.5442 8.2425 116.9665 53.4653 40.9208 175.4016 12 L 4.5130 6.3652 121.0941 54.6723 46.1744 173.4889 13 K 4.3507 8.7173 128.5178 55.1276 33.1816 176.3296 14 I 4.2158 8.0850 119.3694 60.2644 40.3127 175.3471 15 E 3.9301 9.1678 124.6701 57.1408 27.6461 177.2976 16 K 4.9534 9.0819 110.7692 55.1720 36.1513 177.9561 17 L 4.7550 8.4834 121.9992 53.0136 43.2574 175.9468 18 V 4.2581 8.5459 124.1218 62.1850 33.4050 174.3913 19 L 5.1505 8.6926 125.8934 53.1065 44.7472 175.0125 20 N 5.4334 8.5549 119.8995 52.2164 43.3184 172.9560 21 I 5.4321 8.2390 121.3455 58.2091 40.9342 175.6518 22 S 4.2955 9.0567 122.0403 58.3016 63.5879 174.6236 23 V 4.2139 8.2671 124.6694 60.9164 31.2622 175.5189 24 G 4.0580 7.9449 120.2521 43.5959 0.0000 170.3158 25 E 4.5471 7.3427 119.9075 53.7720 37.4300 178.4304 26 S 3.6359 8.4637 114.8301 58.9032 63.9306 172.8194 27 G 3.8756 9.1877 112.9642 46.8912 0.0000 174.8737 28 D 4.4132 9.2232 126.1907 56.5492 41.6767 177.6662 29 R 4.4760 7.6422 116.1729 55.9511 30.4905 177.9057 30 L 3.9439 7.6333 122.0404 57.9841 41.8857 178.2598 31 T 4.0063 7.4290 112.1320 63.7763 67.0671 176.2004 32 R 3.6646 7.4890 120.8827 59.6908 30.0646 178.0267 33 A 4.0250 7.7527 120.2164 55.2321 18.6507 179.5944 34 S 4.0554 7.9494 112.7702 61.4398 62.9885 176.3157 35 K 4.0943 7.6766 122.0590 58.1278 31.7654 178.9618 36 V 3.6876 7.5533 119.0913 65.8087 31.5237 177.7644 37 L 3.9295 7.6232 118.8618 57.9615 41.4207 179.0622 38 E 4.0611 8.0020 118.6585 59.4841 29.2372 178.6049 39 Q 4.0013 7.6028 118.7859 58.4271 29.1575 177.7227 40 L 4.2244 7.4405 119.7306 58.1004 42.0280 178.6833 41 S 4.3485 7.9369 113.4402 58.0679 64.1302 174.9092 42 G 4.2417 8.8027 113.4332 44.6712 0.0000 172.2870 43 Q 4.5105 7.3342 116.7776 54.4104 32.6581 173.3008 44 T 4.2025 8.2403 112.3741 60.5297 69.5270 172.9661 45 P 4.5345 0.0000 0.0000 62.0565 32.9823 175.6309 46 V 4.1674 8.2680 122.0587 61.7002 33.0584 174.7765 47 Q 4.6575 8.6195 127.6207 55.3779 29.0434 176.2816 48 S 4.5387 8.4777 121.2280 57.8685 64.9932 173.9437 49 K 4.6833 8.2285 119.3308 56.6724 33.8704 176.1092 50 A 4.5498 7.9875 119.8521 51.9664 21.7698 176.8956 51 R 4.3157 8.3996 121.2984 56.1144 30.9865 175.9645 52 Y 4.3643 8.4395 118.8495 57.9428 38.8335 175.1256 53 T 4.2006 7.5870 109.1971 61.2251 69.7251 173.9585 54 V 3.5928 8.0588 120.8142 62.1265 31.4339 176.9077 55 R 4.1635 8.1503 123.1657 55.8560 28.4210 175.3424 56 T 3.9589 7.7653 118.9158 63.5583 68.9797 172.9452 57 F 4.2000 8.5264 125.6011 56.1158 37.7079 174.8218 58 G 4.1358 7.4015 116.1594 45.8118 0.0000 173.2743 59 I 4.6337 7.8311 117.7891 58.9592 40.4492 172.9390 60 R 4.4645 7.7754 123.9763 57.4541 32.5456 176.0179 61 R 4.1836 7.5026 115.6323 56.7940 31.0900 175.7057 62 N 4.9696 8.9834 119.1683 53.4830 36.4418 175.1030 63 E 4.1022 7.6939 116.7249 55.7112 30.2848 176.9414 64 K 4.4837 8.6245 125.2843 55.1363 30.8530 176.8976 65 I 3.9628 8.1193 116.1566 62.7124 39.1513 176.5787 66 A 5.0317 7.4158 127.0259 50.5053 21.9695 174.8057 67 V 4.7489 8.0455 111.6521 61.8552 35.0164 173.3154 68 H 5.3140 8.9358 119.0542 54.9094 32.7690 171.9268 69 V 4.4400 8.4502 116.6718 61.6351 34.3424 173.1104 70 T 4.9977 8.4535 122.8085 62.3748 70.3977 174.7266 71 V 4.5321 8.1313 123.0461 60.7256 34.9253 173.8539 72 R 5.1663 8.0708 121.6630 54.1705 33.5848 175.6498 73 G 3.8375 8.3796 105.6598 45.0753 0.0000 172.0566 74 P 4.4537 0.0000 0.0000 64.2740 30.9151 178.2457 75 K 4.0927 7.9973 118.7909 59.1605 32.2410 178.3094 76 A 3.9453 7.9218 120.9951 54.8713 18.1303 179.3767 77 E 4.0294 7.6121 114.9650 58.9197 29.6081 178.9339 78 E 4.0620 7.6995 119.6466 59.3418 29.8915 178.6361 79 I 3.7597 7.7297 117.9365 63.4818 38.1752 177.3938 80 L 4.0167 7.8676 121.6034 58.2057 41.8982 178.5780 81 E 3.9165 7.9226 119.2989 59.3122 29.2977 178.9909 82 R 3.9543 7.9509 117.0971 58.6389 30.1047 178.3556 83 G 2.8472 7.4202 103.6272 45.7038 0.0000 175.7183 84 L 3.8672 7.1872 122.1354 57.6117 42.2411 178.5007 85 K 4.2481 7.8981 117.5040 58.0804 32.2970 177.4152 86 V 4.3300 7.0567 116.3929 63.2349 33.6993 177.5456 87 K 4.0302 7.6126 119.4897 57.7505 32.3686 177.2412 88 E 4.1830 7.1029 117.8335 58.6755 29.5832 176.2328 89 Y 5.0403 6.8379 116.0061 58.1194 40.0324 176.6768 90 Q 4.0668 8.6229 119.1919 56.0757 27.7635 177.7777 91 L 4.5785 8.5770 132.6497 53.8622 43.3691 173.7366 92 R 4.3763 7.9312 121.0923 55.4141 32.8633 173.4804 93 D 5.0716 8.4097 124.2339 51.7193 44.1095 175.6174 94 R 4.0282 8.4143 116.9296 56.2392 29.7536 175.7028 95 N 4.8574 6.8748 118.4271 51.3892 41.3381 173.5744 96 F 5.2098 8.4030 118.3144 57.3109 43.4075 175.0605 97 S 4.5760 8.6443 120.5918 57.9175 65.3148 173.1680 98 A 4.2836 8.6243 120.6362 55.3758 19.4330 180.2195 99 T 3.8757 7.9060 106.1024 64.8868 69.6269 175.0273 100 G 4.6862 7.7838 110.4413 46.3884 0.0000 173.9717 101 N 4.7302 8.3709 116.7728 52.4451 40.7562 175.5771 102 F 4.2968 8.3894 127.0276 56.0145 40.6420 175.1281 103 G 4.3014 7.9442 113.3612 44.8215 0.0000 171.6301 104 F 4.8707 7.9955 116.1445 55.9905 43.6771 175.2400 105 G 4.1296 8.5440 104.4983 45.9053 0.0000 171.7409 106 I 4.5784 7.9965 127.3731 59.1082 39.3750 176.3526 107 D 4.2771 8.9283 127.5162 56.6929 41.4007 176.4616 108 E 4.1885 7.9183 118.2312 56.5967 27.4332 175.8209 109 H 4.4168 8.1446 118.9101 56.3928 29.5546 177.7974 110 I 3.8556 7.6242 119.2899 62.6371 38.0831 176.3972 111 D 4.4032 7.9351 119.4862 55.0846 39.8331 175.5005 112 L 4.5393 7.9147 121.6562 53.2083 44.5197 174.2105 113 G 3.8983 9.1886 120.0250 45.0158 0.0000 174.6073 114 I 4.2837 5.4200 118.9567 60.1184 39.4768 174.9216 115 K 5.2267 8.0856 120.1615 55.4771 35.1611 175.1983 116 Y 4.3581 8.5457 118.1965 59.7864 39.4493 178.3128 117 D 4.4100 8.2610 118.8783 57.3938 40.9833 175.7261 118 P 4.3826 0.0000 0.0000 63.5284 31.6814 176.4172 119 S 4.3787 7.0984 112.7618 57.2434 64.6330 174.3049 120 I 4.0304 7.8240 120.4122 62.9196 38.1108 175.8125 121 G 3.8499 7.0579 109.1129 44.8206 0.0000 172.2160 122 I 4.3969 8.5067 115.9884 60.4188 38.7237 175.0827 123 F 4.6959 7.1547 117.6261 57.1172 40.6837 173.3634 124 G 4.2581 8.2385 110.3005 43.5353 0.0000 171.6633 125 M 4.7600 8.0642 114.5580 54.3678 34.4378 173.8822 126 D 5.4698 8.5860 120.3887 52.8519 44.0000 176.1420 127 F 4.7308 8.3798 118.9988 56.7682 42.7736 173.3374 128 Y 4.5637 9.0564 123.9688 56.6335 37.1282 175.4959 129 V 4.5522 8.2251 120.7671 60.0374 29.8794 174.9138 130 V 4.3964 7.5521 115.8283 60.4625 34.5354 176.1915 131 M 4.8206 8.2977 119.5471 54.5299 35.7923 176.3450 132 N 4.7248 8.5834 122.7945 50.7639 37.3594 173.7985 133 R 4.4832 7.3128 116.4658 54.4514 33.6287 172.6885 134 P 4.3193 0.0000 0.0000 63.6157 32.2760 176.3565 135 G 3.9707 8.4417 108.5901 46.3791 0.0000 174.2224 136 A 4.2131 8.5112 123.2400 53.4761 18.2001 180.0893 137 R 3.6882 7.8195 116.1258 58.0960 30.1448 177.8927 138 V 4.0727 7.7315 117.6860 64.6518 31.7797 177.9845 139 T 4.0509 7.7317 109.3286 64.6348 68.9787 176.2264 140 R 4.0667 7.4413 120.3891 58.0293 29.9731 178.3885 141 R 3.8700 7.5962 117.8688 59.5994 30.2830 178.1796 142 K 3.9812 7.7511 118.3329 59.6209 32.3636 178.9819 143 R 4.1157 8.0279 117.9884 58.6957 30.0568 178.0850 144 C 4.3938 8.1281 113.9234 60.1168 29.7564 175.8688 145 K 4.1389 7.8893 120.7316 59.2026 32.4650 178.5168 146 G 3.9701 7.6443 103.4702 43.4586 0.0000 172.4297 147 T 3.2103 7.1785 115.4153 62.6388 65.4939 171.3533 148 V 4.3227 7.7168 119.8467 59.0719 33.8421 176.4768 149 G 4.0007 8.9299 110.4220 45.3993 0.0000 172.9585 150 N 5.0371 8.5162 123.5690 51.2484 41.1757 176.2771 151 S 4.3889 8.4091 117.3732 57.6298 62.5096 173.9439 152 H 4.4848 7.7974 120.7813 57.1007 28.2275 175.5259 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 S 8.33 4.51 0.00 3.88 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 3 T 8.79 4.31 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 4 K 8.68 3.62 0.00 1.86 1.80 0.00 1.84 0.00 0.00 1.71 0.00 0.00 2.79 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.37 1.42 7.81 5 A 7.65 4.34 1.20 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 0.00 0.00 0.00 0.00 0.00 0.00 6 Q 8.35 4.64 0.00 1.95 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.75 6.98 0.00 0.00 0.00 0.00 0.00 2.25 2.44 0.00 7 N 7.78 4.76 0.00 2.85 2.74 0.00 0.00 6.96 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 8 P 0.00 4.37 0.00 2.16 2.10 0.00 3.60 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.14 0.00 9 M 7.93 4.06 0.00 2.09 2.05 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.60 0.00 10 R 7.61 4.40 0.00 1.83 1.91 0.00 3.34 0.00 0.00 3.16 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.85 0.00 11 D 8.24 4.54 0.00 2.84 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 12 L 6.37 4.51 0.00 1.60 1.53 0.99 0.54 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 13 K 8.72 4.35 0.00 1.76 1.70 0.00 1.83 0.00 0.00 1.76 0.00 0.00 2.90 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.39 1.43 7.81 14 I 8.08 4.22 1.90 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 1.32 0.74 0.94 0.00 0.00 15 E 9.17 3.93 0.00 2.05 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.25 0.00 16 K 9.08 4.95 0.00 1.81 1.78 0.00 1.61 0.00 0.00 1.73 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.33 1.48 7.81 17 L 8.48 4.75 0.00 1.60 1.72 0.96 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 18 V 8.55 4.26 2.25 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 1.12 0.00 0.00 1.01 0.00 0.00 19 L 8.69 5.15 0.00 1.57 1.26 1.00 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 20 N 8.55 5.43 0.00 2.94 2.81 0.00 0.00 6.89 7.82 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 21 I 8.24 5.43 1.92 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 1.66 1.07 0.00 0.00 22 S 9.06 4.30 0.00 4.03 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 23 V 8.27 4.21 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 0.82 0.00 0.00 1.00 0.00 0.00 24 G 7.94 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 0.00 0.00 0.00 25 E 7.34 4.55 0.00 1.84 1.73 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 2.13 2.23 0.00 26 S 8.46 3.64 0.00 4.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 G 9.19 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 28 D 9.22 4.41 0.00 2.67 2.68 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.64 4.48 0.00 1.96 1.85 0.00 3.27 0.00 0.00 3.14 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.51 0.00 30 L 7.63 3.94 0.00 1.71 1.62 0.98 0.68 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 31 T 7.43 4.01 4.20 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 0.00 0.00 0.00 1.20 0.00 0.00 32 R 7.49 3.66 0.00 1.63 1.80 0.00 2.21 0.00 0.00 2.58 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 1.17 0.00 33 A 7.75 4.02 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 S 7.95 4.06 0.00 4.07 4.12 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 0.00 0.00 0.00 35 K 7.68 4.09 0.00 2.09 1.83 0.00 1.50 0.00 0.00 1.63 0.00 0.00 2.96 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.41 1.47 7.81 36 V 7.55 3.69 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 1.07 0.00 0.00 1.20 0.00 0.00 37 L 7.62 3.93 0.00 1.82 1.65 0.90 0.68 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 38 E 8.00 4.06 0.00 2.16 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 2.30 2.47 0.00 39 Q 7.60 4.00 0.00 2.22 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.73 0.00 0.00 0.00 0.00 0.00 2.38 2.40 0.00 40 L 7.44 4.22 0.00 1.60 1.74 1.01 0.98 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 41 S 7.94 4.35 0.00 4.04 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 42 G 8.80 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 43 Q 7.33 4.51 0.00 1.96 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.88 0.00 0.00 0.00 0.00 0.00 2.23 2.34 0.00 44 T 8.24 4.20 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 45 P 0.00 4.53 0.00 1.94 1.99 0.00 3.64 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 2.11 2.05 0.00 46 V 8.27 4.17 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 1.00 0.00 0.00 0.85 0.00 0.00 47 Q 8.62 4.66 0.00 1.96 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.86 6.81 0.00 0.00 0.00 0.00 0.00 2.33 2.45 0.00 48 S 8.48 4.54 0.00 3.75 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 49 K 8.23 4.68 0.00 1.76 1.81 0.00 1.83 0.00 0.00 1.73 0.00 0.00 3.00 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.46 1.39 7.81 50 A 7.99 4.55 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 51 R 8.40 4.32 0.00 1.84 1.94 0.00 3.21 0.00 0.00 3.15 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.63 0.00 52 Y 8.44 4.36 0.00 2.82 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 53 T 7.59 4.20 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 1.24 0.00 0.00 54 V 8.06 3.59 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 0.66 0.00 0.00 0.89 0.00 0.00 55 R 8.15 4.16 0.00 1.72 1.87 0.00 3.25 0.00 0.00 3.19 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.70 0.00 56 T 7.77 3.96 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 0.42 0.00 0.00 57 F 8.53 4.20 0.00 3.26 3.06 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 58 G 7.40 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 59 I 7.83 4.63 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 1.31 0.99 0.98 0.00 0.00 60 R 7.78 4.46 0.00 1.77 1.71 0.00 3.43 0.00 0.00 3.27 7.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.64 0.00 61 R 7.50 4.18 0.00 1.95 2.06 0.00 2.35 0.00 0.00 2.87 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.48 0.00 62 N 8.98 4.97 0.00 2.86 3.17 0.00 0.00 6.87 7.66 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 63 E 7.69 4.10 0.00 1.93 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 0.00 2.28 2.32 0.00 64 K 8.62 4.48 0.00 1.79 1.87 0.00 1.97 0.00 0.00 1.52 0.00 0.00 3.04 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.33 7.81 65 I 8.12 3.96 1.88 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.57 0.92 0.00 0.00 66 A 7.42 5.03 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 67 V 8.05 4.75 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 0.96 0.00 0.00 68 H 8.94 5.31 0.00 3.42 3.56 0.00 5.32 0.00 0.00 0.00 0.00 6.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 V 8.45 4.44 2.03 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 0.63 0.00 0.00 0.93 0.00 0.00 70 T 8.45 5.00 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 71 V 8.13 4.53 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.95 0.00 0.00 72 R 8.07 5.17 0.00 1.80 1.90 0.00 3.32 0.00 0.00 2.25 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.56 0.00 73 G 8.38 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 74 P 0.00 4.45 0.00 2.18 2.11 0.00 3.61 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.14 0.00 75 K 8.00 4.09 0.00 1.83 2.01 0.00 1.72 0.00 0.00 1.83 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.51 1.51 7.81 76 A 7.92 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 77 E 7.61 4.03 0.00 2.18 2.03 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 0.00 2.36 2.46 0.00 78 E 7.70 4.06 0.00 1.83 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 0.00 2.31 2.46 0.00 79 I 7.73 3.76 1.91 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.21 1.03 0.00 0.00 80 L 7.87 4.02 0.00 1.96 1.86 0.91 0.85 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 81 E 7.92 3.92 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 2.28 2.33 0.00 82 R 7.95 3.95 0.00 1.96 1.96 0.00 3.27 0.00 0.00 3.24 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.89 0.00 83 G 7.42 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 0.00 0.00 0.00 84 L 7.19 3.87 0.00 1.80 1.54 0.85 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 85 K 7.90 4.25 0.00 1.87 1.85 0.00 1.80 0.00 0.00 1.76 0.00 0.00 3.11 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.49 1.50 7.81 86 V 7.06 4.33 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 0.78 0.00 0.00 0.97 0.00 0.00 87 K 7.61 4.03 0.00 1.43 1.47 0.00 1.69 0.00 0.00 1.37 0.00 0.00 2.93 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.22 1.61 7.81 88 E 7.10 4.18 0.00 1.82 1.12 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 2.48 0.00 89 Y 6.84 5.04 0.00 3.01 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 90 Q 8.62 4.07 0.00 2.02 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 7.00 0.00 0.00 0.00 0.00 0.00 2.37 2.23 0.00 91 L 8.58 4.58 0.00 1.54 1.57 0.93 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 92 R 7.93 4.38 0.00 1.82 2.02 0.00 3.33 0.00 0.00 3.05 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.59 0.00 93 D 8.41 5.07 0.00 2.65 2.57 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.41 4.03 0.00 2.25 2.36 0.00 3.29 0.00 0.00 3.56 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.81 0.00 95 N 6.87 4.86 0.00 1.96 2.32 0.00 0.00 6.94 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 96 F 8.40 5.21 0.00 2.97 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 97 S 8.64 4.58 0.00 4.02 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 98 A 8.62 4.28 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 99 T 7.91 3.88 4.28 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 1.23 0.00 0.00 100 G 7.78 4.69 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 0.00 0.00 0.00 101 N 8.37 4.73 0.00 2.73 2.88 0.00 0.00 6.54 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 0.00 102 F 8.39 4.30 0.00 2.68 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 0.00 103 G 7.94 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 F 8.00 4.87 0.00 3.36 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 0.00 105 G 8.54 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 I 8.00 4.58 1.87 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 1.20 1.33 0.95 0.00 0.00 107 D 8.93 4.28 0.00 2.63 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 0.00 108 E 7.92 4.19 0.00 1.95 1.88 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 2.30 2.33 0.00 109 H 8.14 4.42 0.00 3.06 2.96 0.00 5.65 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 I 7.62 3.86 1.79 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 1.11 1.43 0.87 0.00 0.00 111 D 7.94 4.40 0.00 2.81 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 0.00 112 L 7.91 4.54 0.00 1.55 1.54 0.93 1.07 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 0.00 113 G 9.19 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 I 5.42 4.28 2.14 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 1.35 1.48 1.03 0.00 0.00 115 K 8.09 5.23 0.00 1.76 1.80 0.00 1.78 0.00 0.00 1.80 0.00 0.00 3.14 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.36 1.36 7.81 116 Y 8.55 4.36 0.00 3.01 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 0.00 117 D 8.26 4.41 0.00 2.74 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 0.00 118 P 0.00 4.38 0.00 2.05 2.09 0.00 3.81 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 2.05 2.08 0.00 119 S 7.10 4.38 0.00 3.92 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 0.00 120 I 7.82 4.03 1.65 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 1.21 0.37 0.81 0.00 0.00 121 G 7.06 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 0.00 122 I 8.51 4.40 2.04 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.76 1.17 0.00 0.00 123 F 7.15 4.70 0.00 3.36 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 0.00 124 G 8.24 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 M 8.06 4.76 0.00 1.91 1.89 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.48 0.00 126 D 8.59 5.47 0.00 2.65 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 0.00 0.00 0.00 0.00 127 F 8.38 4.73 0.00 2.95 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 0.00 128 Y 9.06 4.56 0.00 3.09 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 0.00 129 V 8.23 4.55 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 1.25 0.00 0.00 130 V 7.55 4.40 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 1.02 0.00 0.00 131 M 8.30 4.82 0.00 1.98 2.01 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.67 0.00 132 N 8.58 4.72 0.00 2.71 2.80 0.00 0.00 6.81 7.66 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 0.00 133 R 7.31 4.48 0.00 1.72 1.78 0.00 3.30 0.00 0.00 3.24 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.69 0.00 134 P 0.00 4.32 0.00 2.09 1.97 0.00 3.74 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 2.03 2.09 0.00 135 G 8.44 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 0.00 0.00 0.00 136 A 8.51 4.21 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 0.00 137 R 7.82 3.69 0.00 1.74 1.95 0.00 3.22 0.00 0.00 3.13 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.68 0.00 138 V 7.73 4.07 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.97 0.00 0.00 139 T 7.73 4.05 4.45 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 1.50 0.00 0.00 140 R 7.44 4.07 0.00 1.12 1.67 0.00 2.82 0.00 0.00 2.88 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.18 0.00 141 R 7.60 3.87 0.00 1.94 2.12 0.00 3.15 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.63 0.00 142 K 7.75 3.98 0.00 1.98 2.02 0.00 1.58 0.00 0.00 1.66 0.00 0.00 3.04 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.46 1.54 7.81 143 R 8.03 4.12 0.00 2.05 1.90 0.00 2.84 0.00 0.00 3.21 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.74 0.00 144 C 8.13 4.39 0.00 3.21 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 0.00 145 K 7.89 4.14 0.00 1.94 1.99 0.00 1.60 0.00 0.00 1.72 0.00 0.00 3.05 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.64 1.46 7.81 146 G 7.64 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 0.00 0.00 0.00 147 T 7.18 3.21 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 148 V 7.72 4.32 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.00 0.00 0.97 0.00 0.00 149 G 8.93 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 0.00 150 N 8.52 5.04 0.00 2.77 2.81 0.00 0.00 7.13 7.57 0.00 0.00 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 S 8.41 4.39 0.00 3.98 4.10 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 0.00 152 H 7.80 4.48 0.00 3.38 3.37 0.00 5.73 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00