NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 44 V 4.3420 8.0549 114.0681 60.8258 33.0051 174.9272 45 E 4.1006 8.8470 121.9524 55.1317 29.7901 175.9575 46 T 4.2042 8.4506 110.0035 62.6471 70.7834 174.6756 47 E 3.9677 8.2264 123.7884 56.0396 29.9300 175.8247 48 N 4.1385 8.7950 125.5131 52.8620 37.7886 174.9875 49 I 3.9091 8.2489 119.0889 62.0048 38.3363 177.3813 50 A 4.0840 8.0675 124.7444 54.0349 18.6322 177.4713 51 R 4.2122 7.4139 117.4674 57.6394 30.2031 176.8490 52 G 3.9148 9.0949 113.5490 45.7060 0.0000 173.6286 53 K 4.2093 7.7784 118.9270 55.4576 32.9142 176.3922 54 Q 4.2005 8.4941 121.8382 56.3294 29.7524 174.7015 55 A 5.1476 8.5220 127.4486 50.4079 22.6284 174.5474 56 S 4.6958 8.3902 113.0737 57.7880 67.0448 172.7158 57 Q 4.1232 7.9329 117.5893 54.7663 30.8002 174.4696 58 S 3.3244 7.3542 115.0145 60.9303 63.5054 174.4103 59 S 4.4519 7.3020 112.4934 57.4032 65.4224 172.7492 60 T 4.9846 8.2272 116.3011 61.7146 71.2037 173.5531 61 A 4.5904 8.5485 127.7184 51.0392 22.3293 174.9184 62 Y 3.7732 8.9915 113.7548 58.9632 35.5799 171.8926 63 G 3.9399 8.5096 104.4699 46.3681 0.0000 176.0032 64 G 4.0265 8.3640 110.4298 43.3677 0.0000 174.0049 65 A 4.2432 7.8681 121.9236 52.8534 19.7076 178.8543 66 A 4.4523 8.9683 124.1429 55.6997 18.4131 179.9744 67 T 4.1456 8.0124 106.9784 64.2552 68.6512 176.5816 68 R 4.0045 8.0301 120.5534 58.7427 30.3401 177.7679 69 A 4.2173 8.1050 119.1552 52.9215 18.4600 178.2086 70 V 4.6007 7.9135 111.5229 61.1413 32.9572 176.3778 71 D 4.6381 8.5704 117.2515 52.8314 39.6448 176.4274 72 G 3.7348 8.6048 107.3587 46.4213 0.0000 173.5243 73 N 4.6542 8.0767 117.3650 51.6809 40.3742 174.2826 74 V 3.5994 8.1029 118.2240 61.1160 31.8690 176.0350 75 D 4.2615 8.1276 121.0099 55.1427 41.1464 176.1986 76 S 4.4673 8.6321 119.7934 58.0518 63.8367 172.8089 77 D 4.6280 8.2405 122.8292 53.4520 41.1204 175.9053 78 Y 3.9645 9.6847 129.8597 60.8120 38.7896 178.5989 79 G 3.6552 8.4933 107.1384 47.7947 0.0000 173.5658 80 H 4.5302 8.3487 117.1086 55.5065 28.9243 175.4898 81 H 4.0845 7.7983 115.3333 56.9178 26.2929 174.8522 82 S 4.7270 7.4118 111.3184 57.8078 63.1459 173.3797 83 V 4.7094 7.4829 117.1054 60.6254 33.8729 175.4003 84 T 4.4984 8.6076 118.0549 62.0828 71.0281 173.0826 85 H 4.8494 9.0573 119.9532 55.8507 33.6644 173.4079 86 T 5.4476 8.0983 116.7894 59.3961 70.8386 174.0863 87 N 4.5895 8.7654 118.7201 53.2009 39.9393 175.1237 88 F 4.1617 9.1096 120.0536 58.3430 39.3287 174.0638 89 E 4.7986 8.4135 121.1503 55.0428 33.5527 173.4333 90 D 4.9678 8.6880 119.5142 54.0866 42.1312 176.7909 91 N 5.0497 9.0911 118.9376 53.3069 36.7359 174.2302 92 A 4.4652 7.8211 118.9001 52.3976 20.0466 177.7156 93 W 5.8715 8.5849 116.2073 55.1400 32.3466 173.5260 94 W 5.6550 9.6087 129.7690 56.2165 34.1887 173.4173 95 Q 4.8872 8.4303 126.1253 54.3194 32.7666 173.5338 96 V 4.4108 8.2560 124.4219 59.7276 34.5012 173.8960 97 D 4.6123 8.6835 124.7000 52.9153 41.1074 176.3402 98 L 3.9408 8.6145 127.5529 56.2023 41.4714 178.4279 99 G 3.9244 10.1621 107.9684 44.9048 0.0000 172.7593 100 K 4.5191 7.0840 116.7519 55.8619 36.5042 174.8653 101 T 4.6606 8.2855 117.2276 63.3138 68.9852 174.5537 102 E 4.7089 9.2179 125.6420 54.3339 34.3330 175.0405 103 N 4.9773 8.7112 121.4461 53.1151 40.0132 173.4487 104 V 4.4842 9.0686 128.1324 61.7172 32.7528 176.3164 105 G 4.5726 9.0661 114.0120 46.4158 0.0000 172.8371 106 K 5.1169 8.0910 121.1966 54.8968 36.1449 174.8171 107 V 4.8663 9.1073 127.2232 60.9480 34.6682 173.7655 108 K 4.9205 9.5050 129.3286 54.6417 34.6570 174.4089 109 L 4.9759 8.6861 127.8523 53.4549 44.1392 174.9648 110 Y 4.8673 8.8406 121.2943 56.1113 40.2068 175.1638 111 N 4.7704 9.1745 123.9533 52.7853 40.1190 174.6602 112 R 4.1717 8.5469 123.6478 56.7208 30.4026 176.4079 113 G 4.0873 9.4170 112.4228 44.0619 0.0000 172.6772 114 D 4.7227 7.9704 118.6477 52.8128 41.4695 176.7077 115 G 3.7959 8.6819 107.0139 44.9987 0.0000 173.1723 116 N 4.2011 8.0264 114.3678 54.8186 36.2430 174.8156 117 V 4.4314 7.4302 105.3461 60.9348 33.7620 178.0398 118 A 4.0055 8.2359 126.5315 55.2218 18.2352 180.3654 119 N 4.5142 8.0671 111.7945 55.3519 37.5249 176.4905 120 R 3.9751 7.7405 118.0982 58.8861 30.3426 177.1821 121 L 4.2114 7.3786 120.7916 53.2375 40.2741 175.3197 122 S 4.9081 7.6940 115.0936 56.8659 67.0930 174.1064 123 N 4.2367 9.0756 118.4675 54.5667 37.2516 172.3097 124 F 5.5491 7.9649 114.4705 55.4305 42.7500 174.8600 125 D 5.5382 9.5045 119.3308 52.7365 44.0636 175.5157 126 V 5.0395 9.1392 121.8963 61.3747 34.0594 174.4747 127 V 4.9648 9.3366 128.0419 61.1222 34.7460 173.8740 128 L 5.1154 8.6084 126.9868 53.0099 44.0653 175.4777 129 L 5.3180 8.8323 123.0873 52.8051 45.8740 176.7190 130 N 4.7646 9.1362 119.9249 51.8285 38.9367 175.4451 131 E 3.9359 8.7418 117.8347 59.4168 29.6400 177.3178 132 A 4.2506 7.9757 118.5380 51.9454 18.5192 177.1610 133 K 3.8286 8.1350 114.7592 57.5893 30.1861 175.9942 134 Q 4.3463 7.6303 117.3493 54.4099 29.9232 175.0225 135 E 4.4134 8.6106 122.3399 56.7539 30.0644 176.7859 136 V 4.4631 8.5687 118.2425 61.5292 33.8406 175.3818 137 A 4.6801 7.6968 119.9981 51.4752 22.5135 175.1698 138 R 5.2031 8.4705 117.8509 55.6762 33.3137 174.1123 139 Q 4.5731 9.3997 125.0048 54.3308 32.5122 173.7273 140 H 5.1596 8.3712 122.8667 54.6985 31.8196 173.9384 141 F 4.3803 7.8928 122.8600 55.6367 42.1866 175.8296 142 D 4.3781 8.7541 122.8272 57.3539 41.8499 176.1750 143 S 4.8433 7.7166 108.8715 57.8890 65.1591 174.4991 144 L 4.3428 8.3743 122.2177 54.4495 42.0539 177.3798 145 N 4.4598 9.3307 115.4755 54.2262 36.2405 175.1007 146 G 4.0593 8.5151 108.3060 45.3740 0.0000 175.2623 147 K 4.0847 7.6761 118.6181 56.1996 32.7770 177.8661 148 A 4.4147 8.5333 123.8666 54.5112 19.3910 176.7634 149 E 4.8879 7.5228 111.1726 54.9079 33.3672 174.7459 150 L 4.5988 8.5951 121.7642 53.3500 45.5154 174.6867 151 E 4.5110 8.7336 125.7149 55.0167 30.9146 175.3860 152 V 4.2649 8.6151 125.4871 61.0782 33.7685 174.1109 153 F 5.2801 8.8177 126.4247 55.8511 41.0548 175.0218 154 F 4.8936 9.2482 122.1005 56.1925 42.2084 175.4635 155 T 4.1095 8.9362 119.4209 63.3644 67.4599 174.3789 156 A 4.3845 8.0254 132.0576 51.6092 16.5182 177.5967 157 K 4.4774 7.9601 120.6856 55.1964 34.4633 177.8678 158 D 5.2248 8.7580 125.2961 53.8403 41.3075 175.6433 159 A 4.7175 9.1252 125.2477 50.5884 22.7073 176.1101 160 R 4.4369 9.1607 119.9317 55.8092 32.6789 175.4358 161 Y 5.1539 7.8811 115.6427 55.8707 41.7198 174.7103 162 V 4.8168 8.5774 122.9161 61.0074 34.3949 174.1773 163 K 5.2440 9.4974 128.9039 54.6665 35.9086 174.5317 164 V 5.1239 9.3516 126.4491 61.3322 34.2788 174.1575 165 E 5.3152 9.4568 126.5909 54.5750 33.0672 175.2654 166 L 4.6229 9.2746 125.7048 54.4688 43.0888 177.7006 167 K 5.0638 8.6424 120.5830 55.6186 33.3752 175.6698 168 T 4.7277 7.8276 114.8651 60.1239 70.1656 173.7239 169 K 4.5109 8.6962 126.4468 57.1851 33.1134 176.1927 170 N 4.3080 8.9654 119.3281 55.1827 37.8963 174.2070 171 T 4.7592 8.2481 112.2230 60.8880 72.0563 173.1078 172 P 4.5327 0.0000 0.0000 61.6030 33.0985 175.0279 173 L 4.4852 8.4097 124.1231 53.8075 43.7978 175.2585 174 S 5.1268 8.3184 121.3321 55.5485 66.3049 173.3194 175 L 4.6035 8.7114 124.3379 52.7071 44.3122 177.6946 176 A 4.1069 8.9059 126.1623 54.9275 19.1054 177.3951 177 E 4.6147 7.4245 112.0299 55.4379 33.0596 174.9848 178 V 4.8250 8.8974 126.0499 61.2346 33.7902 174.4189 179 E 4.8620 9.1838 127.3664 54.5353 32.7876 175.2923 180 V 4.7127 7.7938 121.4762 61.1234 35.4383 173.9387 181 F 5.2033 9.0165 125.5683 55.4048 42.6695 174.9724 182 R 4.5926 8.7725 121.7385 56.1028 31.3023 176.2708 183 S 4.5733 8.9883 118.5395 58.5395 63.7269 174.6917 184 A 4.1859 8.7942 124.7236 52.9125 18.0461 177.4662 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 44 V 8.05 4.34 2.29 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 1.09 0.00 0.00 0.87 0.00 0.00 45 E 8.85 4.10 0.00 2.09 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 2.40 2.38 0.00 46 T 8.45 4.20 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 1.19 0.00 0.00 47 E 8.23 3.97 0.00 2.02 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 2.32 2.34 0.00 48 N 8.79 4.14 0.00 2.74 2.69 0.00 0.00 6.96 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 49 I 8.25 3.91 1.83 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 1.28 0.62 0.90 0.00 0.00 50 A 8.07 4.08 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 51 R 7.41 4.21 0.00 1.68 1.98 0.00 3.58 0.00 0.00 3.21 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 52 G 9.09 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 K 7.78 4.21 0.00 1.89 1.94 0.00 1.68 0.00 0.00 1.60 0.00 0.00 2.92 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.53 1.52 7.81 54 Q 8.49 4.20 0.00 2.12 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.77 0.00 0.00 0.00 0.00 0.00 2.42 2.36 0.00 55 A 8.52 5.15 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 56 S 8.39 4.70 0.00 3.91 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 Q 7.93 4.12 0.00 2.02 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 7.09 0.00 0.00 0.00 0.00 0.00 2.15 2.39 0.00 58 S 7.35 3.32 0.00 3.55 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 59 S 7.30 4.45 0.00 3.92 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 60 T 8.23 4.98 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 1.29 0.00 0.00 61 A 8.55 4.59 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 Y 8.99 3.77 0.00 3.06 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 63 G 8.51 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 G 8.36 4.03 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 0.00 0.00 0.00 0.00 0.00 0.00 65 A 7.87 4.24 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 66 A 8.97 4.45 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 T 8.01 4.15 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 1.25 0.00 0.00 68 R 8.03 4.00 0.00 1.96 2.12 0.00 3.34 0.00 0.00 3.25 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.65 0.00 69 A 8.11 4.22 0.84 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 70 V 7.91 4.60 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 1.19 0.00 0.00 1.18 0.00 0.00 71 D 8.57 4.64 0.00 2.76 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 72 G 8.60 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 73 N 8.08 4.65 0.00 2.54 2.77 0.00 0.00 7.07 8.99 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 74 V 8.10 3.60 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 -0.11 0.00 0.00 0.77 0.00 0.00 75 D 8.13 4.26 0.00 2.76 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.63 4.47 0.00 4.26 4.08 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 77 D 8.24 4.63 0.00 2.60 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 0.00 0.00 0.00 0.00 78 Y 9.68 3.96 0.00 3.02 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 79 G 8.49 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 0.00 0.00 0.00 80 H 8.35 4.53 0.00 3.19 3.23 0.00 5.76 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 H 7.80 4.08 0.00 3.27 3.30 0.00 5.59 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 S 7.41 4.73 0.00 3.87 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 83 V 7.48 4.71 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 1.01 0.00 0.00 0.93 0.00 0.00 84 T 8.61 4.50 4.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 85 H 9.06 4.85 0.00 3.46 3.52 0.00 5.57 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 86 T 8.10 5.45 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 1.16 0.00 0.00 87 N 8.77 4.59 0.00 2.67 2.84 0.00 0.00 7.47 8.81 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 88 F 9.11 4.16 0.00 2.91 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 E 8.41 4.80 0.00 2.02 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 2.46 2.35 0.00 90 D 8.69 4.97 0.00 2.64 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 91 N 9.09 5.05 0.00 3.05 3.00 0.00 0.00 6.76 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 A 7.82 4.47 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 93 W 8.58 5.87 0.00 3.55 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 W 9.61 5.65 0.00 3.42 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 95 Q 8.43 4.89 0.00 2.11 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.53 0.00 0.00 0.00 0.00 0.00 2.23 2.39 0.00 96 V 8.26 4.41 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 0.86 0.00 0.00 0.93 0.00 0.00 97 D 8.68 4.61 0.00 2.76 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 98 L 8.61 3.94 0.00 1.58 1.61 0.85 0.89 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 99 G 10.16 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 K 7.08 4.52 0.00 1.74 1.84 0.00 1.47 0.00 0.00 1.78 0.00 0.00 2.85 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.34 1.50 7.81 101 T 8.29 4.66 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 1.19 0.00 0.00 102 E 9.22 4.71 0.00 1.77 1.77 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 2.31 2.31 0.00 103 N 8.71 4.98 0.00 2.87 2.76 0.00 0.00 6.60 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 0.00 104 V 9.07 4.48 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 0.92 0.00 0.00 0.94 0.00 0.00 105 G 9.07 4.57 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 0.00 0.00 0.00 106 K 8.09 5.12 0.00 1.81 1.82 0.00 1.58 0.00 0.00 1.55 0.00 0.00 2.50 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.06 0.30 7.81 107 V 9.11 4.87 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 0.96 0.00 0.00 1.13 0.00 0.00 108 K 9.50 4.92 0.00 1.92 1.78 0.00 1.67 0.00 0.00 1.74 0.00 0.00 2.46 0.00 0.00 2.77 0.00 0.00 0.00 0.00 0.73 1.14 7.81 109 L 8.69 4.98 0.00 1.44 1.37 0.80 0.52 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 Y 8.84 4.87 0.00 2.88 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 0.00 111 N 9.17 4.77 0.00 2.61 2.67 0.00 0.00 7.21 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 0.00 112 R 8.55 4.17 0.00 1.84 1.76 0.00 3.17 0.00 0.00 3.14 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.85 0.00 113 G 9.42 4.09 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 0.00 0.00 0.00 114 D 7.97 4.72 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 0.00 115 G 8.68 3.80 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 0.00 0.00 0.00 116 N 8.03 4.20 0.00 2.82 2.87 0.00 0.00 6.81 7.68 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 0.00 117 V 7.43 4.43 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 0.79 0.00 0.00 0.89 0.00 0.00 118 A 8.24 4.01 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 0.00 119 N 8.07 4.51 0.00 2.84 2.98 0.00 0.00 6.04 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 0.00 120 R 7.74 3.98 0.00 1.83 2.07 0.00 3.01 0.00 0.00 2.89 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.59 0.00 121 L 7.38 4.21 0.00 1.43 1.47 -0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 122 S 7.69 4.91 0.00 4.21 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 0.00 123 N 9.08 4.24 0.00 2.98 2.90 0.00 0.00 7.02 7.26 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 0.00 124 F 7.96 5.55 0.00 3.33 3.14 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 0.00 125 D 9.50 5.54 0.00 2.77 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 0.00 126 V 9.14 5.04 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 1.34 0.00 0.00 127 V 9.34 4.96 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 0.96 0.00 0.00 1.04 0.00 0.00 128 L 8.61 5.12 0.00 1.38 1.35 0.32 -0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 129 L 8.83 5.32 0.00 1.64 1.63 0.66 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 130 N 9.14 4.76 0.00 2.86 2.99 0.00 0.00 6.72 7.56 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 0.00 131 E 8.74 3.94 0.00 1.95 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 2.32 2.37 0.00 132 A 7.98 4.25 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 0.00 133 K 8.13 3.83 0.00 1.75 1.70 0.00 1.41 0.00 0.00 1.19 0.00 0.00 2.23 0.00 0.00 2.63 0.00 0.00 0.00 0.00 0.52 1.08 7.81 134 Q 7.63 4.35 0.00 2.26 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 7.09 0.00 0.00 0.00 0.00 0.00 2.38 2.31 0.00 135 E 8.61 4.41 0.00 1.91 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 0.00 2.37 2.44 0.00 136 V 8.57 4.46 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 0.72 0.00 0.00 1.02 0.00 0.00 137 A 7.70 4.68 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 0.00 138 R 8.47 5.20 0.00 1.92 1.89 0.00 3.21 0.00 0.00 3.49 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.74 0.00 139 Q 9.40 4.57 0.00 2.09 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.57 0.00 0.00 0.00 0.00 0.00 2.12 2.23 0.00 140 H 8.37 5.16 0.00 3.09 2.99 0.00 5.86 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 0.00 141 F 7.89 4.38 0.00 1.66 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 0.00 142 D 8.75 4.38 0.00 2.61 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 S 7.72 4.84 0.00 3.82 3.72 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 0.00 144 L 8.37 4.34 0.00 1.81 1.68 1.07 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 145 N 9.33 4.46 0.00 2.85 2.95 0.00 0.00 7.22 7.58 0.00 0.00 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 G 8.52 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 0.00 147 K 7.68 4.08 0.00 1.90 1.71 0.00 1.67 0.00 0.00 1.64 0.00 0.00 2.96 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.51 1.55 7.81 148 A 8.53 4.41 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 E 7.52 4.89 0.00 1.52 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.96 0.00 150 L 8.60 4.60 0.00 1.58 1.31 0.68 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 151 E 8.73 4.51 0.00 1.89 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 2.08 2.17 0.00 152 V 8.62 4.26 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 0.84 0.00 0.00 0.70 0.00 0.00 153 F 8.82 5.28 0.00 2.90 2.95 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 0.00 154 F 9.25 4.89 0.00 3.01 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 0.00 155 T 8.94 4.11 4.33 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 1.26 0.00 0.00 156 A 8.03 4.38 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 157 K 7.96 4.48 0.00 1.69 1.71 0.00 1.73 0.00 0.00 1.71 0.00 0.00 3.19 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.68 1.69 7.81 158 D 8.76 5.22 0.00 2.56 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 0.00 159 A 9.13 4.72 1.13 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 0.00 160 R 9.16 4.44 0.00 1.70 1.75 0.00 2.89 0.00 0.00 3.11 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.92 0.00 161 Y 7.88 5.15 0.00 2.89 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 162 V 8.58 4.82 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 1.20 0.00 0.00 0.93 0.00 0.00 163 K 9.50 5.24 0.00 1.79 1.63 0.00 1.25 0.00 0.00 1.35 0.00 0.00 2.71 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.41 1.67 7.81 164 V 9.35 5.12 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 0.89 0.00 0.00 1.06 0.00 0.00 165 E 9.46 5.32 0.00 2.08 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 0.00 2.37 2.40 0.00 166 L 9.27 4.62 0.00 1.68 1.68 1.00 0.92 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 0.00 167 K 8.64 5.06 0.00 2.02 1.84 0.00 2.02 0.00 0.00 1.58 0.00 0.00 2.88 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.31 7.81 168 T 7.83 4.73 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 1.26 0.00 0.00 169 K 8.70 4.51 0.00 1.83 1.77 0.00 1.99 0.00 0.00 1.66 0.00 0.00 2.98 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.48 1.46 7.81 170 N 8.97 4.31 0.00 2.88 2.93 0.00 0.00 6.94 7.32 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 0.00 171 T 8.25 4.76 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 1.15 0.00 0.00 172 P 0.00 4.53 0.00 1.62 1.78 0.00 2.91 0.00 0.00 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.44 0.00 173 L 8.41 4.49 0.00 1.77 1.53 0.77 0.76 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 0.00 174 S 8.32 5.13 0.00 3.56 3.65 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 0.00 175 L 8.71 4.60 0.00 1.03 1.13 0.30 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 176 A 8.91 4.11 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 0.00 177 E 7.42 4.61 0.00 1.77 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 1.89 2.21 0.00 178 V 8.90 4.83 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 0.96 0.00 0.00 0.15 0.00 0.00 179 E 9.18 4.86 0.00 2.11 1.49 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 2.20 2.32 0.00 180 V 7.79 4.71 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 1.08 0.00 0.00 0.96 0.00 0.00 181 F 9.02 5.20 0.00 3.01 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 0.00 182 R 8.77 4.59 0.00 1.98 1.90 0.00 3.17 0.00 0.00 3.59 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.70 0.00 183 S 8.99 4.57 0.00 3.81 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 0.00 184 A 8.79 4.19 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