NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 13 N 4.7189 8.4249 118.2186 52.8544 38.1712 174.4745 14 L 4.8297 8.4737 116.7522 52.4319 43.9352 173.9441 15 L 4.7153 8.3223 122.0680 53.3061 44.4337 175.2977 16 Y 4.4885 8.4475 121.8472 57.9261 39.7853 174.7350 17 T 3.8144 6.9743 117.2026 60.8645 70.2242 174.1359 18 R 3.8949 8.1162 126.7584 57.4472 30.1761 176.1081 19 N 4.2771 7.5240 117.7582 53.6782 39.1605 175.4649 20 D 4.6260 8.3855 130.8283 52.0086 38.6198 176.2932 21 V 4.1930 7.0858 116.1370 61.3440 33.5926 175.7436 22 S 4.0362 8.7254 121.3193 59.4461 63.5095 175.1072 23 D 4.4115 9.0902 126.6580 57.3542 40.5207 179.4674 24 S 4.0817 7.9434 114.2977 61.6017 63.3052 176.1187 25 E 3.9973 7.8832 123.4305 58.3018 29.2328 178.6262 26 K 3.9561 8.1456 119.2308 59.1657 32.2851 179.0479 27 K 3.8199 8.3372 118.2855 59.6427 32.0799 179.2596 28 A 3.9637 8.0842 120.6112 55.5337 18.4000 179.8841 29 T 3.7741 7.7985 114.1650 66.8541 68.6896 177.0803 30 V 3.7166 8.4068 120.4606 66.0004 31.4979 177.7152 31 E 3.9522 8.0719 118.5863 58.8963 29.1482 178.3389 32 L 3.9520 7.8316 120.4275 58.0915 42.0483 178.9741 33 L 3.9294 8.4059 119.1083 58.0674 41.8068 179.0267 34 N 4.1990 8.0047 115.9924 56.5097 38.4309 177.4294 35 R 3.8952 7.8611 119.4835 59.5698 30.1481 178.6810 36 Q 4.0891 7.6830 117.3851 58.8327 28.7099 178.5152 37 V 3.5333 7.9651 119.6325 66.2135 31.4791 178.0741 38 I 3.6661 7.6330 118.7498 64.5392 37.0397 177.9726 39 Q 4.0011 7.9420 119.7884 59.4046 28.7314 178.7960 40 F 3.8503 9.2487 118.9083 60.6405 39.1224 177.5346 41 I 3.7177 8.3882 119.8000 64.7394 36.8603 177.9788 42 D 4.2776 8.2333 118.4979 57.2212 41.1016 177.8366 43 L 3.7548 7.8018 121.1425 58.0652 41.9116 179.2340 44 S 4.0566 8.2249 114.3001 61.4123 63.0301 176.3520 45 L 3.8924 7.7584 122.8120 57.5551 41.3964 179.6483 46 I 3.4902 7.8868 119.7335 64.4688 36.9078 178.5434 47 T 3.8184 7.7737 116.5639 66.6952 68.2282 176.8214 48 K 3.3089 7.6499 120.1848 58.9546 31.9411 179.1959 49 Q 4.1299 7.5936 118.1971 59.0607 28.4702 178.8634 50 A 3.8091 7.6502 121.1638 55.5181 18.2520 178.7033 51 H 3.9447 7.8088 115.2137 59.5330 29.8590 176.7974 52 W 4.6324 8.0773 119.2390 59.9070 29.0670 177.6109 53 N 4.9465 7.9826 113.1741 52.7117 38.3219 174.9583 54 M 4.9444 7.0363 116.9416 54.5687 33.3588 175.4132 55 R 4.2335 8.7598 117.3566 55.7991 34.6773 173.7692 56 G 3.6667 8.8447 104.3000 43.8275 0.0000 172.9434 57 A 3.9841 8.4577 121.2009 53.8201 18.6887 176.8539 58 N 4.1565 8.9988 117.5883 54.5862 37.0968 175.6570 59 F 4.1470 7.3907 117.8685 60.6324 39.0390 176.2624 60 I 2.8489 7.6638 116.5490 64.1057 37.8648 177.6254 61 A 3.8087 7.8182 120.5116 55.2808 18.0750 179.6464 62 V 3.2783 7.3145 116.0800 66.1833 31.3899 177.3013 63 H 3.8616 8.0546 117.0819 59.6082 29.7477 176.5979 64 E 3.9033 8.2262 120.3403 59.3777 29.1221 178.8170 65 M 3.5870 7.8876 118.5609 58.6380 32.1683 178.2268 66 L 3.3987 7.7205 119.1413 57.6052 41.7503 179.1824 67 D 4.1565 7.5390 118.5543 57.1126 40.6089 178.7847 68 G 3.6221 7.3068 106.2408 47.9982 0.0000 175.5125 69 F 3.8729 7.2756 119.8669 60.0293 38.9245 177.2377 70 R 3.9078 7.9199 118.2842 59.9859 29.7404 178.3747 71 T 3.8498 7.8210 114.6962 66.7498 68.4630 176.4021 72 A 4.1077 7.9517 122.2909 55.1073 18.3992 179.4760 73 L 4.2457 8.7755 117.8425 58.4229 41.7272 179.9532 74 I 3.8019 8.0504 119.5641 64.3203 36.9500 178.0162 75 C 4.0632 8.0297 119.5247 62.8286 31.3647 175.1688 76 H 4.0805 8.3483 117.6609 59.2123 28.3726 176.9416 77 L 3.5978 8.3538 121.4537 58.8799 41.7531 178.8521 78 A 3.9809 8.6013 120.3277 55.5206 18.4152 179.6492 79 T 3.7872 7.9373 114.1499 67.0695 68.5341 176.7411 80 M 3.9229 8.2348 120.4508 58.2930 32.0248 178.5682 81 A 3.9703 8.0049 120.8982 55.2744 18.4403 179.4687 82 E 3.8934 8.5067 117.3927 59.6014 29.6706 179.5873 83 R 3.8150 7.9735 118.4253 59.1834 30.0922 178.4158 84 A 3.9378 8.0039 120.5714 55.3189 18.4829 179.8666 85 V 3.7430 7.8431 116.6634 66.1987 31.3003 178.2269 86 Q 4.0498 8.0370 117.4509 58.5187 28.5480 177.6808 87 L 4.4054 7.3903 117.2091 54.5996 42.0872 177.7997 88 G 3.9026 8.2951 108.6829 45.1427 0.0000 174.6614 89 G 4.1560 7.4922 108.5431 44.3695 0.0000 172.9284 90 V 4.1702 8.0192 118.9048 60.4588 33.2588 175.8552 91 A 4.1532 8.6766 131.0524 52.2084 18.6877 176.1795 92 L 4.6688 9.4639 124.2087 53.2640 42.7877 176.9933 93 G 4.2242 8.4019 112.1368 44.6453 0.0000 172.5684 94 T 4.2609 7.8416 110.3525 60.9344 71.1706 174.8010 95 T 3.8480 8.4876 116.6957 65.5124 67.4555 176.2743 96 Q 3.9799 8.0434 119.3804 59.0423 28.7186 178.8247 97 V 3.6834 7.3552 117.7331 66.1310 31.5191 177.8287 98 I 3.6658 7.8870 119.4007 64.6031 36.8084 177.6520 99 N 4.2813 8.2248 117.3346 57.4296 38.6614 175.8295 100 S 4.4085 7.5854 113.8508 60.3406 63.5998 175.6239 101 K 4.0052 8.1002 125.4558 57.9005 32.3943 177.8686 102 T 3.8171 8.0281 114.4594 62.2317 67.3372 171.3818 103 P 4.6363 0.0000 0.0000 62.6094 31.6111 175.1484 104 L 4.5637 7.5512 119.7217 52.7581 42.6031 176.4142 105 K 3.9047 8.6764 125.1593 56.2390 32.6531 176.0036 106 S 4.1192 8.6429 118.8765 59.0695 62.4530 173.0753 107 Y 4.3308 8.5425 127.5072 55.6488 39.5530 172.8452 108 P 4.4178 0.0000 0.0000 63.3090 31.6781 175.8684 109 L 4.7359 8.5492 121.6116 54.4637 41.7385 176.5379 110 D 4.8358 7.8761 117.4232 52.8309 40.8678 176.0834 111 I 4.1744 7.3706 113.1890 60.8781 39.2374 174.6306 112 H 5.0263 8.4799 114.6933 57.4123 33.4192 173.5930 113 N 4.6451 8.4596 117.5636 54.4573 39.1694 175.1242 114 V 3.6650 9.1736 125.9355 66.6713 31.6130 178.1184 115 Q 4.0346 8.1318 117.0241 58.9536 28.5439 178.4177 116 D 4.3365 8.4224 120.2882 57.7047 40.9008 178.4210 117 H 4.3520 8.1804 117.5217 58.1555 28.7301 177.1433 118 L 3.9744 8.3125 122.4025 58.2872 42.0041 179.1362 119 K 3.9367 8.1481 118.0201 59.5528 32.0103 178.8173 120 E 3.9684 8.5839 119.7853 59.3420 29.5132 178.8623 121 L 4.2144 8.8639 118.9810 57.9080 41.7298 179.0388 122 A 4.0362 8.4369 121.1139 55.5368 18.2661 179.4323 123 D 4.3283 8.1105 116.5886 57.7038 40.9418 179.1551 124 R 3.9733 7.9293 118.0514 59.6135 29.9554 178.7698 125 Y 3.7885 8.9336 116.5035 60.9984 37.8830 178.4022 126 A 3.9374 8.3345 121.6976 55.3013 18.3134 179.6699 127 I 3.5923 7.7111 117.9612 64.5994 37.1830 178.8270 128 V 3.4617 7.5287 118.2270 65.8158 31.4307 177.5697 129 A 3.9219 8.7788 121.6422 55.5321 18.0826 179.4184 130 N 4.2560 8.5987 114.8418 56.3438 38.6490 177.0902 131 D 4.3863 8.3728 119.9831 57.5060 40.9008 178.7726 132 V 3.8002 8.0302 119.7153 64.9365 31.0793 178.2023 133 R 3.8984 7.7678 118.2369 58.8613 30.0206 178.4993 134 K 4.0905 7.8799 118.3847 59.3428 32.1104 178.9608 135 A 4.0403 8.1045 120.9280 55.1939 18.1368 179.6900 136 I 3.7808 7.4801 117.9844 64.6752 37.1013 178.5696 137 G 3.7615 7.7132 103.7068 46.4540 0.0000 174.3078 138 E 4.3387 7.6216 120.2116 56.2179 29.9746 175.6358 139 A 4.2808 7.1377 122.0532 51.5234 18.8731 177.5039 140 K 4.0591 8.5627 123.1344 58.6218 32.8741 177.4542 141 D 4.4921 7.9788 118.8298 53.4448 41.8268 175.6665 142 D 4.3967 8.8005 127.7307 57.9584 40.9422 178.5589 143 D 4.3366 8.2583 118.1688 58.1172 40.9025 179.0352 144 T 3.8300 8.1086 114.9950 66.6315 68.3849 176.1758 145 A 3.9582 8.1699 122.6757 55.1673 18.3070 178.9948 146 D 4.2108 8.0524 116.3400 57.6354 41.3232 178.1983 147 I 3.6563 7.7032 120.1476 64.8328 37.2175 178.3669 148 L 3.9627 7.9933 119.2513 57.8680 41.3260 179.8237 149 T 3.7895 8.0302 115.6807 66.5710 68.3082 176.5811 150 A 3.9804 8.3076 122.8203 54.9972 18.3706 179.5928 151 A 3.2791 7.8909 119.2271 55.0898 18.4130 179.6849 152 S 3.9473 8.4722 111.9794 61.6112 62.6149 176.0090 153 R 3.7855 8.2030 121.7025 59.8146 29.5584 178.1226 154 D 3.9956 7.6005 118.2477 57.2323 40.7577 178.6621 155 L 3.6237 7.4961 119.3549 57.8880 41.7023 179.4505 156 D 4.3296 8.3257 119.0323 56.8142 40.5737 178.8340 157 K 4.1172 7.3319 119.2601 59.3639 32.2443 178.8273 158 F 3.7841 8.0393 118.4273 60.3728 38.7587 177.1023 159 L 3.8604 8.1648 120.1944 58.1130 41.7352 178.7480 160 W 4.4067 8.1266 127.5172 60.6740 30.3896 177.8943 161 F 4.0139 8.0902 116.4425 60.5852 38.6859 177.3168 162 I 3.8329 8.2376 119.7139 64.6267 36.9443 178.0531 163 E 4.0117 8.6493 119.4912 59.9330 29.2076 179.8086 164 S 4.2997 8.2152 113.3847 60.6954 62.9194 175.4517 165 N 4.6275 7.7885 117.5619 52.7259 38.8551 175.1271 166 I 4.1786 7.0286 122.7817 60.5885 37.8272 175.8717 167 E 4.1475 8.9388 124.3296 56.7325 29.1664 176.7560 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 13 N 8.42 4.72 0.00 2.86 2.54 0.00 0.00 5.93 6.90 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 14 L 8.47 4.83 0.00 1.63 1.61 0.97 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 15 L 8.32 4.72 0.00 1.56 1.62 0.95 0.83 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 16 Y 8.45 4.49 0.00 2.97 2.91 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 17 T 6.97 3.81 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 1.11 0.00 0.00 18 R 8.12 3.89 0.00 1.75 1.93 0.00 3.25 0.00 0.00 3.17 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.49 0.00 19 N 7.52 4.28 0.00 2.57 2.67 0.00 0.00 7.12 9.28 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 20 D 8.39 4.63 0.00 2.82 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 21 V 7.09 4.19 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 0.81 0.00 0.00 0.96 0.00 0.00 22 S 8.73 4.04 0.00 4.08 4.04 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 23 D 9.09 4.41 0.00 2.79 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 S 7.94 4.08 0.00 4.04 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 25 E 7.88 4.00 0.00 2.04 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 2.29 2.38 0.00 26 K 8.15 3.96 0.00 2.02 1.80 0.00 1.73 0.00 0.00 1.89 0.00 0.00 2.90 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.44 1.77 7.81 27 K 8.34 3.82 0.00 1.86 1.88 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.59 7.81 28 A 8.08 3.96 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 29 T 7.80 3.77 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 1.18 0.00 0.00 30 V 8.41 3.72 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.99 0.00 0.00 31 E 8.07 3.95 0.00 2.25 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 2.30 2.45 0.00 32 L 7.83 3.95 0.00 1.80 1.82 0.91 0.62 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 33 L 8.41 3.93 0.00 1.63 1.63 0.92 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 34 N 8.00 4.20 0.00 2.88 2.89 0.00 0.00 6.76 7.08 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 35 R 7.86 3.90 0.00 2.11 2.07 0.00 3.10 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.68 0.00 36 Q 7.68 4.09 0.00 2.11 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.51 0.00 0.00 0.00 0.00 0.00 2.54 2.44 0.00 37 V 7.97 3.53 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.86 0.00 0.00 38 I 7.63 3.67 2.05 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 0.94 0.93 0.00 0.00 39 Q 7.94 4.00 0.00 2.32 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.83 0.00 0.00 0.00 0.00 0.00 2.29 2.40 0.00 40 F 9.25 3.85 0.00 3.24 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 41 I 8.39 3.72 1.91 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 1.45 1.22 0.93 0.00 0.00 42 D 8.23 4.28 0.00 2.89 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 43 L 7.80 3.75 0.00 1.65 1.34 -0.37 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 44 S 8.22 4.06 0.00 4.06 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 45 L 7.76 3.89 0.00 1.87 1.77 0.94 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 46 I 7.89 3.49 1.92 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 1.49 1.05 0.53 0.00 0.00 47 T 7.77 3.82 4.34 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 0.00 0.00 0.00 1.23 0.00 0.00 48 K 7.65 3.31 0.00 1.37 0.74 0.00 0.61 0.00 0.00 0.76 0.00 0.00 2.74 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.01 1.16 7.81 49 Q 7.59 4.13 0.00 1.89 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.79 0.00 0.00 0.00 0.00 0.00 2.49 2.62 0.00 50 A 7.65 3.81 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 H 7.81 3.94 0.00 2.89 3.15 0.00 5.96 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 W 8.08 4.63 0.00 3.50 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 53 N 7.98 4.95 0.00 2.91 2.98 0.00 0.00 7.09 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 M 7.04 4.94 0.00 2.21 2.24 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.97 2.98 0.00 55 R 8.76 4.23 0.00 1.84 1.69 0.00 3.03 0.00 0.00 3.06 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.45 0.00 56 G 8.84 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 0.00 0.00 0.00 57 A 8.46 3.98 1.27 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 58 N 9.00 4.16 0.00 2.92 2.84 0.00 0.00 6.77 7.71 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 59 F 7.39 4.15 0.00 3.15 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 60 I 7.66 2.85 1.85 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.11 0.85 0.00 0.00 61 A 7.82 3.81 1.19 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 0.00 0.00 62 V 7.31 3.28 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 0.99 0.00 0.00 0.89 0.00 0.00 63 H 8.05 3.86 0.00 2.22 2.85 0.00 5.81 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 E 8.23 3.90 0.00 1.85 1.83 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 2.25 2.33 0.00 65 M 7.89 3.59 0.00 1.85 1.79 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 1.48 0.00 66 L 7.72 3.40 0.00 1.61 1.47 0.88 1.00 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 67 D 7.54 4.16 0.00 2.57 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 G 7.31 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 69 F 7.28 3.87 0.00 3.02 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 70 R 7.92 3.91 0.00 1.77 2.01 0.00 2.92 0.00 0.00 2.97 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.60 0.00 71 T 7.82 3.85 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 1.23 0.00 0.00 72 A 7.95 4.11 1.71 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 0.00 0.00 73 L 8.78 4.25 0.00 2.15 1.87 1.11 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 74 I 8.05 3.80 2.04 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 1.44 0.97 0.93 0.00 0.00 75 C 8.03 4.06 0.00 3.02 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 76 H 8.35 4.08 0.00 3.46 3.18 0.00 5.71 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 L 8.35 3.60 0.00 1.97 1.89 1.00 0.86 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 78 A 8.60 3.98 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 79 T 7.94 3.79 4.37 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 1.18 0.00 0.00 80 M 8.23 3.92 0.00 1.89 2.06 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.37 0.00 81 A 8.00 3.97 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 82 E 8.51 3.89 0.00 2.15 1.99 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 2.31 2.51 0.00 83 R 7.97 3.81 0.00 1.90 2.06 0.00 3.11 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.66 0.00 84 A 8.00 3.94 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 85 V 7.84 3.74 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 1.01 0.00 0.00 0.99 0.00 0.00 86 Q 8.04 4.05 0.00 2.22 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.99 0.00 0.00 0.00 0.00 0.00 2.37 2.61 0.00 87 L 7.39 4.41 0.00 1.77 1.66 0.89 0.73 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 88 G 8.30 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 89 G 7.49 4.16 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 90 V 8.02 4.17 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 0.85 0.00 0.00 0.93 0.00 0.00 91 A 8.68 4.15 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 92 L 9.46 4.67 0.00 1.65 1.61 0.92 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 93 G 8.40 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 0.00 0.00 0.00 0.00 94 T 7.84 4.26 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 1.22 0.00 0.00 95 T 8.49 3.85 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 96 Q 8.04 3.98 0.00 2.11 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.68 0.00 0.00 0.00 0.00 0.00 2.46 2.38 0.00 97 V 7.36 3.68 2.23 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 1.04 0.00 0.00 0.94 0.00 0.00 98 I 7.89 3.67 2.02 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 1.64 0.75 0.93 0.00 0.00 99 N 8.22 4.28 0.00 2.74 3.11 0.00 0.00 7.36 8.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 S 7.59 4.41 0.00 4.17 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 0.00 101 K 8.10 4.01 0.00 1.73 1.94 0.00 1.75 0.00 0.00 1.64 0.00 0.00 2.96 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.49 1.54 7.81 102 T 8.03 3.82 4.31 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 1.25 0.00 0.00 103 P 0.00 4.64 0.00 2.22 2.13 0.00 3.79 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.99 0.00 104 L 7.55 4.56 0.00 1.83 1.67 0.95 0.85 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 0.00 105 K 8.68 3.90 0.00 1.73 1.75 0.00 1.84 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.44 1.40 7.81 106 S 8.64 4.12 0.00 3.90 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 0.00 107 Y 8.54 4.33 0.00 3.03 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 0.00 108 P 0.00 4.42 0.00 2.02 1.88 0.00 2.71 0.00 0.00 3.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.55 0.00 109 L 8.55 4.74 0.00 1.69 1.78 0.98 1.21 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 0.00 110 D 7.88 4.84 0.00 2.73 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 0.00 111 I 7.37 4.17 1.70 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.38 0.81 0.00 0.00 112 H 8.48 5.03 0.00 3.18 3.31 0.00 5.65 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 N 8.46 4.65 0.00 2.82 2.76 0.00 0.00 6.69 7.71 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 0.00 114 V 9.17 3.67 2.21 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 1.11 0.00 0.00 1.12 0.00 0.00 115 Q 8.13 4.03 0.00 2.12 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.69 0.00 0.00 0.00 0.00 0.00 2.47 2.41 0.00 116 D 8.42 4.34 0.00 2.76 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 0.00 117 H 8.18 4.35 0.00 3.44 3.47 0.00 5.92 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 0.00 118 L 8.31 3.97 0.00 2.10 1.76 0.92 0.69 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 0.00 119 K 8.15 3.94 0.00 2.05 1.87 0.00 1.74 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.48 1.66 7.81 120 E 8.58 3.97 0.00 2.11 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 1.64 2.32 0.00 121 L 8.86 4.21 0.00 2.00 1.77 0.96 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 122 A 8.44 4.04 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 D 8.11 4.33 0.00 3.03 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 0.00 124 R 7.93 3.97 0.00 1.93 2.02 0.00 3.40 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.06 0.00 125 Y 8.93 3.79 0.00 3.09 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 0.00 126 A 8.33 3.94 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.71 3.59 2.06 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 1.42 0.91 0.90 0.00 0.00 128 V 7.53 3.46 1.85 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 0.56 0.00 0.00 0.77 0.00 0.00 129 A 8.78 3.92 1.34 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 0.00 0.00 0.00 0.00 0.00 0.00 130 N 8.60 4.26 0.00 2.80 2.88 0.00 0.00 6.75 8.07 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 0.00 131 D 8.37 4.39 0.00 2.79 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 0.00 132 V 8.03 3.80 2.30 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 0.88 0.00 0.00 1.01 0.00 0.00 133 R 7.77 3.90 0.00 1.94 2.14 0.00 3.23 0.00 0.00 3.34 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.65 0.00 134 K 7.88 4.09 0.00 1.88 1.82 0.00 1.76 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.76 1.59 7.81 135 A 8.10 4.04 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 0.00 136 I 7.48 3.78 1.96 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.19 0.94 0.00 0.00 137 G 7.71 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 0.00 0.00 0.00 138 E 7.62 4.34 0.00 1.93 2.14 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 2.27 2.31 0.00 139 A 7.14 4.28 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 0.00 140 K 8.56 4.06 0.00 2.11 1.87 0.00 1.98 0.00 0.00 1.62 0.00 0.00 2.93 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.42 1.41 7.81 141 D 7.98 4.49 0.00 2.72 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 D 8.80 4.40 0.00 2.70 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 0.00 143 D 8.26 4.34 0.00 2.69 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 0.00 144 T 8.11 3.83 4.34 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 0.00 0.00 0.00 1.17 0.00 0.00 145 A 8.17 3.96 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 0.00 146 D 8.05 4.21 0.00 2.80 2.82 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 0.00 147 I 7.70 3.66 2.00 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 1.49 0.53 0.84 0.00 0.00 148 L 7.99 3.96 0.00 1.84 1.68 0.92 0.51 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 0.00 149 T 8.03 3.79 4.36 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 1.18 0.00 0.00 150 A 8.31 3.98 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 0.00 151 A 7.89 3.28 1.27 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 0.00 152 S 8.47 3.95 0.00 3.86 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 0.00 153 R 8.20 3.79 0.00 2.03 1.99 0.00 3.10 0.00 0.00 3.12 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.63 0.00 154 D 7.60 4.00 0.00 2.60 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 0.00 0.00 0.00 155 L 7.50 3.62 0.00 1.59 1.60 0.80 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 156 D 8.33 4.33 0.00 2.61 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 0.00 157 K 7.33 4.12 0.00 1.83 1.82 0.00 1.65 0.00 0.00 1.68 0.00 0.00 2.77 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.12 1.49 7.81 158 F 8.04 3.78 0.00 2.90 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 0.00 0.00 0.00 159 L 8.16 3.86 0.00 1.88 1.97 1.05 1.04 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 0.00 160 W 8.13 4.41 0.00 3.43 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 0.00 161 F 8.09 4.01 0.00 3.12 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 162 I 8.24 3.83 1.94 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.00 0.90 0.00 0.00 163 E 8.65 4.01 0.00 2.29 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.55 0.00 164 S 8.22 4.30 0.00 3.72 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 0.00 165 N 7.79 4.63 0.00 2.78 2.80 0.00 0.00 7.01 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 I 7.03 4.18 2.05 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 1.31 0.72 0.98 0.00 0.00 167 E 8.94 4.15 0.00 1.98 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 2.34 2.26 0.00