NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.3084 7.8827 121.4518 61.2165 38.7478 173.8098 17 V 4.4324 8.5609 125.7311 61.6536 32.9675 174.2005 18 G 4.1079 8.3830 113.6841 46.1751 0.0000 173.0851 19 G 4.3266 7.8700 110.5059 43.6981 0.0000 172.3306 20 Y 4.9735 7.7691 116.8406 55.0950 42.2434 174.8199 21 T 4.3239 8.5742 116.8239 63.8457 68.4382 175.5835 22 C 4.3481 8.8155 125.3268 60.4184 35.1275 174.8392 23 G 4.1373 8.5613 106.3533 44.0257 0.0000 172.8987 24 A 4.2800 8.5996 125.8445 53.5946 18.6716 176.9149 25 N 4.2507 8.8481 119.3731 54.5269 36.1938 175.2560 26 T 4.2335 7.6304 106.7872 62.5142 69.8576 175.1630 27 V 4.0917 7.0232 122.1277 60.2081 31.3054 173.6810 28 P 4.5594 0.0000 0.0000 63.7726 32.0054 178.0799 29 Y 4.9784 6.8463 115.8181 56.3594 38.8432 174.7401 30 Q 4.5906 7.3328 123.4614 56.3494 29.2587 175.3913 31 V 4.8667 8.8255 118.4259 59.6631 36.4610 174.1153 32 S 4.9146 8.7912 116.6291 56.5635 65.1545 172.5528 33 L 4.5680 8.3605 127.1707 53.0872 43.4267 174.9552 34 N 5.8051 8.9859 122.6717 49.9667 42.1887 174.8985 *37 S 4.3685 8.4358 120.0347 58.4202 64.1858 174.5491 38 G 4.0452 9.9255 109.2644 46.3699 0.0000 172.7247 39 Y 4.5457 6.8453 115.6366 56.3929 40.2079 172.4112 40 H 4.7064 8.6799 120.8947 55.2181 30.5709 174.6305 41 F 4.8684 7.5966 120.1077 57.0766 39.7220 173.8275 42 C 4.7157 6.5901 116.6635 56.0875 44.9657 172.9807 43 G 4.2781 8.3970 108.7369 45.4695 0.0000 172.0734 44 G 4.5822 7.8804 104.8070 46.4984 0.0000 172.6328 45 S 5.4873 8.7776 115.2948 56.5059 67.0036 173.5678 46 L 4.7745 9.0923 127.0722 54.5215 42.6697 176.9846 47 I 4.5315 8.3146 119.0442 60.7066 39.2544 174.3502 48 N 4.5969 7.5135 117.5967 52.2692 39.4250 175.0753 49 S 4.3753 8.4971 112.0521 60.3063 63.2106 174.6363 50 Q 4.5458 9.1598 121.4042 55.3317 30.8616 174.3037 51 W 5.5417 8.3894 116.3984 55.5867 33.5381 174.3414 52 V 5.1569 9.0497 122.6895 61.0643 34.7106 174.3967 53 V 4.9667 8.8365 125.8360 60.4848 34.1236 174.8411 54 S 5.0071 8.9433 116.8534 57.8314 65.9630 171.9553 55 A 4.8228 8.5217 120.3574 50.4720 20.7454 178.2292 56 A 3.7526 8.3788 124.5123 55.4595 18.4015 179.0990 57 H 4.5251 8.5278 108.4527 56.8413 28.5411 175.1407 58 C 4.7415 7.9681 117.0795 57.0577 40.5132 173.3495 59 Y 4.1619 7.8171 122.4050 57.5392 38.8319 174.9521 60 K 3.7299 6.5736 123.2957 56.1804 34.6815 174.3999 61 S 4.2788 8.1500 114.7643 57.7923 65.0128 173.2163 62 G 3.6450 8.2981 105.7637 46.6947 0.0000 173.6772 63 I 4.4764 7.2770 118.6883 59.4004 40.2092 175.8747 64 Q 4.7867 8.7556 127.3132 54.2200 31.8152 174.0849 65 V 4.4777 8.9291 126.8293 61.6270 33.6731 174.5504 65A R 5.0919 8.7990 126.9593 54.6508 32.5449 175.1023 66 L 4.7009 9.0130 124.6817 52.7804 44.7101 177.2462 *69 G 3.8709 8.2255 105.9991 46.2884 0.0000 172.8590 70 E 4.6444 8.4192 118.7606 55.3430 30.4728 174.2421 71 D 4.7559 7.7561 117.1451 55.0687 44.0675 173.9878 72 N 4.9596 8.8807 118.7418 52.8166 39.3546 176.1250 73 I 4.0088 8.3802 119.4441 61.9775 37.9263 176.1372 74 N 4.7985 8.5289 117.9082 53.0649 39.4113 174.7477 75 V 4.2885 7.3514 116.9411 60.7516 34.2968 175.0849 76 V 4.1258 8.4331 126.9066 62.5069 30.6976 175.0798 77 E 4.3507 8.9886 127.2982 55.4416 30.4491 176.9734 78 G 4.0026 8.4549 106.3599 45.8452 0.0000 173.8425 79 N 4.6573 8.9703 117.1336 52.6761 36.9082 174.6725 80 E 5.0159 7.5486 116.4919 56.1151 30.5428 176.5008 81 Q 4.4332 8.6134 120.6442 54.3123 33.1225 173.7014 82 F 5.5426 8.8832 122.6477 55.9381 41.1828 175.0805 83 I 4.7366 8.9083 124.4800 59.5038 41.3079 175.3493 84 S 4.6843 8.6152 121.2500 58.0569 64.4499 173.1921 85 A 4.4403 8.1715 124.6391 52.1641 18.5330 177.6384 86 S 4.4507 9.0854 117.8180 60.3204 63.4007 174.3930 87 K 4.7608 7.5888 116.4153 55.6972 35.8668 174.8098 88 S 5.2238 8.7743 117.0078 56.9641 66.1824 173.8118 89 I 4.4876 9.2478 125.4506 59.4321 39.0003 175.0158 90 V 4.1928 8.2934 127.0872 62.1569 32.6948 175.3215 91 H 3.9610 8.5859 126.3766 55.6284 30.1247 174.6056 92 P 4.3159 0.0000 0.0000 65.3469 31.3236 177.1734 93 S 4.7032 7.8933 111.8974 58.1342 63.3508 173.2726 94 Y 4.2695 8.0960 123.4134 57.7092 38.9624 174.4196 95 N 4.4724 8.2985 126.0885 51.3853 39.6718 175.2077 96 S 3.9061 7.7886 120.3279 59.6148 63.4320 174.8962 97 N 4.4636 8.4733 118.8556 54.5407 38.8697 175.9279 98 T 4.0408 7.7381 105.7221 60.5641 70.2478 174.9532 99 L 3.7990 7.9634 120.8107 55.3970 39.7491 173.9165 100 N 4.4878 7.7418 117.3043 54.5961 39.5574 174.4999 101 N 4.9623 8.6485 119.3275 54.3275 35.7594 175.6036 102 D 4.7195 7.9278 117.7020 53.0614 39.8213 174.8041 103 I 4.8349 7.1932 121.0400 59.2999 42.4107 172.9142 104 M 5.4267 9.0927 126.0289 54.2486 36.3335 173.2891 105 L 5.4054 9.0971 123.7685 53.1038 45.3997 175.4226 106 I 5.0084 9.0801 123.2212 59.4570 40.6807 174.3095 107 K 3.7926 8.9011 128.3524 54.5408 33.8581 175.2537 108 L 4.6254 7.9594 127.1486 53.5872 42.4029 176.8573 109 K 4.0445 8.9431 124.7908 59.1298 32.5391 177.1164 110 S 4.6912 7.7382 112.3879 56.1089 66.8130 173.2828 111 A 4.4500 8.3155 123.4588 51.9399 18.9094 177.3382 112 A 4.4299 8.8462 122.6981 51.6216 20.0573 177.4108 113 S 4.5575 8.8057 116.5127 57.4451 63.5553 174.6109 114 L 4.6288 8.4774 125.2669 54.2348 43.3308 176.4042 115 N 4.7071 8.7197 117.0556 52.8435 39.9419 175.0195 116 S 4.2864 8.8058 111.5077 61.4974 63.5967 175.2047 117 R 4.1717 8.7242 119.8036 56.7514 30.6538 175.8906 118 V 4.4632 7.8306 115.7343 60.9410 33.3108 173.6791 119 A 5.1450 8.6184 128.4902 50.3415 22.9928 174.9809 120 S 5.0818 8.6951 113.8665 57.5361 65.0851 173.1068 121 I 4.4469 8.2275 120.8470 59.3303 39.7467 175.3421 122 S 4.5431 8.2826 122.3787 57.6500 64.0056 173.9017 123 L 4.3010 8.0710 122.8573 53.3818 42.4681 175.3013 124 P 4.5748 0.0000 0.0000 62.8459 32.4538 176.0249 125 T 4.2442 8.2041 107.9993 62.1216 70.4276 174.4168 *127 S 4.9951 7.5857 114.4871 58.1723 64.0204 173.8889 128 C 4.4562 8.3846 117.8622 56.4481 40.8711 173.4695 129 A 4.4448 7.9635 124.2980 51.4392 19.9584 177.1576 130 S 4.4181 8.0132 115.0500 56.9770 64.9700 173.5835 *132 A 4.3265 8.1408 123.7711 53.4160 19.1611 177.3527 133 G 3.9855 9.1352 109.6419 45.4193 0.0000 174.4311 134 T 3.9806 7.6517 117.5922 63.6672 69.4477 173.3268 135 Q 4.6679 8.5696 127.4244 55.5735 30.3147 175.1488 136 C 5.2624 9.2596 122.5123 55.1817 46.8000 172.2477 137 L 5.2045 9.0045 122.3870 53.5096 44.0893 174.9806 138 I 5.2659 9.0716 127.2072 58.7370 40.0503 174.8413 139 S 4.9352 9.0701 119.6631 56.0794 66.7265 173.1409 140 G 3.8728 7.3454 109.2077 45.9489 0.0000 172.5888 141 W 4.8093 8.4123 117.3089 56.2835 29.4104 177.1730 142 G 4.1413 8.3067 108.5760 44.2700 0.0000 173.5984 143 N 3.9276 8.7036 118.3785 54.4293 38.9422 174.5301 144 T 5.0965 8.3164 112.8704 60.5776 69.7120 174.3495 145 K 4.6356 7.7533 121.3448 54.8816 34.6977 176.3974 146 S 4.2634 8.7305 118.8064 60.9197 63.0876 174.7810 147 S 4.4515 7.9827 117.2472 57.1408 62.5254 172.1785 148 G 3.8143 7.8458 110.1953 43.6213 0.0000 170.5781 149 T 4.5135 8.2003 115.6392 61.6472 71.0513 174.3472 150 S 4.4503 9.4607 121.8269 56.9131 65.4369 171.9924 151 Y 5.0054 8.6867 125.1915 55.7034 39.6604 174.3054 152 P 4.7545 0.0000 0.0000 62.2257 33.2557 175.4533 153 D 4.6478 8.6738 117.5124 55.7359 41.6237 177.1852 154 V 5.6733 7.4010 109.9416 58.4135 34.6574 175.6562 155 L 3.1720 8.3050 123.2405 54.9884 42.8699 175.9548 156 K 4.8699 8.1051 124.8544 54.9137 35.1940 174.5863 157 C 5.2698 8.5936 119.2922 55.2133 43.6736 172.9367 158 L 5.0020 8.6188 122.3252 53.7773 45.6745 174.4002 159 K 5.1489 8.9408 124.9155 54.9545 33.8053 175.6133 160 A 4.8742 9.3270 125.9626 49.2825 23.1318 173.5594 161 P 5.0682 0.0000 0.0000 61.8921 34.1024 174.8811 162 I 4.5042 8.2450 122.0605 61.1069 38.2896 176.1492 163 L 4.7868 8.7492 127.6999 53.4171 43.4068 176.7122 164 S 4.4553 8.3986 114.3475 57.9400 64.1612 175.1169 165 D 4.4595 8.6639 121.6673 57.4685 40.6177 179.2555 166 S 4.1585 8.0114 114.5378 61.6218 63.1171 176.6612 167 S 4.1445 8.1188 118.8888 61.1162 62.5337 175.7474 168 C 4.2710 8.3298 121.2144 59.8948 38.5483 175.9951 169 K 3.9343 8.2969 119.7891 59.4074 31.3186 179.6027 170 S 4.1675 7.7783 114.5649 61.2569 62.7929 176.0719 171 A 3.9996 7.7477 122.9305 53.7532 19.6445 177.3992 172 Y 4.9573 7.9625 113.6039 55.7057 38.3503 173.9822 173 P 4.6876 0.0000 0.0000 63.7226 32.0736 177.7333 174 G 3.9775 9.0285 109.3892 45.9883 0.0000 173.5948 175 Q 4.5348 8.3259 116.7703 55.4333 29.9879 175.2625 176 I 4.4737 7.8250 119.8478 59.8499 38.5617 175.3248 177 T 4.5751 8.1994 115.3811 59.6719 71.0077 174.9647 178 S 4.4592 8.5576 113.8397 59.8372 63.1053 174.0081 179 N 5.1313 8.2428 118.4005 53.4744 39.5733 173.9574 180 M 6.0327 8.2599 117.3027 52.9484 36.3841 174.4041 181 F 5.0739 8.1860 114.1668 56.0623 41.8795 173.5327 182 C 5.5846 9.0471 116.1338 55.6002 42.1936 172.7649 183 A 5.0464 9.1686 121.6370 51.2315 22.5947 176.3689 184 G 4.0137 7.0223 106.3845 44.4966 0.0000 172.0889 184A Y 4.6482 8.3798 118.1031 56.0862 40.8608 176.5305 185 L 4.2795 8.6039 124.7367 56.7890 42.1116 178.6020 186 E 4.1899 8.2034 115.6484 57.1341 30.0808 177.1217 187 G 3.8084 7.5122 105.9970 45.0191 0.0000 171.7836 188 G 4.1668 9.2245 105.5070 44.6145 0.0000 173.6764 188A K 4.8842 7.2227 117.2889 54.7833 35.3717 175.3705 189 D 4.6104 8.8181 123.3884 54.1457 45.7756 174.6073 190 S 4.9867 8.7339 115.9784 57.7980 65.4560 173.0532 191 C 4.7313 9.2569 118.8226 55.4383 45.5456 172.1423 192 Q 4.2949 8.6310 120.9900 58.1387 28.7566 177.0632 193 G 4.2621 9.3012 112.6927 45.7284 0.0000 174.0576 194 D 4.6805 8.5032 118.9871 55.7245 41.7228 176.8631 195 S 4.4842 8.0818 114.6771 60.4993 63.5795 175.2408 196 G 3.9402 8.9889 112.7071 46.4181 0.0000 173.7939 197 G 4.5420 7.9104 107.3616 44.7056 0.0000 171.1351 198 P 5.1485 0.0000 0.0000 62.2846 33.6105 175.8169 199 V 4.5882 8.4590 120.6347 61.4716 34.3707 173.9431 200 V 4.9009 8.7315 128.7229 61.2178 34.0172 173.6658 201 C 5.1385 8.8736 124.6145 55.8037 43.8205 174.6125 202 S 3.5660 9.8256 120.0436 59.6934 60.1860 173.0806 203 G 3.9087 8.3488 103.8497 45.7634 0.0000 173.7581 204 K 4.6777 7.7703 118.1248 53.0440 35.0980 175.5399 *209 L 4.2375 8.2418 122.6080 55.4399 42.1080 175.7992 210 Q 4.4728 8.7659 126.0968 56.8239 30.7665 175.8403 211 G 5.3526 8.0074 104.3998 45.7537 0.0000 171.3858 212 I 5.1817 8.1918 119.3039 58.9135 41.1880 175.3745 213 V 3.8052 8.9646 127.4475 63.8716 31.7820 174.1058 214 S 4.8952 8.4446 121.0112 58.4161 64.3432 173.9497 215 W 4.9903 7.5142 113.9310 55.7075 32.1552 172.3262 216 G 3.8616 8.3648 106.0445 46.2360 0.0000 173.5010 217 S 4.5954 8.7832 115.4822 56.7725 61.7549 172.9317 *219 G 4.1877 7.9192 117.2767 45.5183 0.0000 170.5887 220 C 5.0173 8.1538 114.6757 56.4197 43.9970 173.8173 221 A 4.0053 8.9738 125.1503 53.1599 16.6159 176.9492 221A Q 4.6749 7.2810 117.0273 55.8778 30.1226 176.0210 222 K 4.1449 8.4300 121.8906 57.9277 32.7409 176.1008 223 N 4.2588 9.2017 121.4365 54.0557 36.9706 175.3381 224 K 4.2681 7.5120 117.3687 53.6631 32.2288 173.6734 225 P 4.6281 0.0000 0.0000 62.1244 33.3209 176.9192 226 G 3.7468 8.4387 106.2335 45.6595 0.0000 172.9162 227 V 4.4110 7.4228 120.9094 60.6625 34.3350 174.0663 228 Y 4.9000 8.1016 124.4018 56.0680 41.9119 174.9606 229 T 4.5250 8.5345 119.4837 63.4295 70.1549 174.5464 230 K 5.0732 9.3147 128.1987 55.4001 31.3632 177.2123 231 V 3.9293 8.7900 126.4111 65.9094 31.3890 174.8922 232 C 4.3785 8.3547 112.5734 58.2395 41.4421 174.7531 233 N 4.3092 8.0144 116.9104 54.1580 38.5833 174.9807 234 Y 4.8075 8.0024 117.8175 57.4671 39.3495 177.5431 235 V 3.6814 8.0657 121.5444 66.3713 31.5085 178.1008 236 S 4.1325 8.1004 114.3436 61.1586 62.6613 176.2722 237 W 4.1494 8.2758 130.5755 60.5347 30.4847 177.8100 238 I 3.1788 8.3364 120.0227 64.2207 36.5194 178.5076 239 K 3.7452 8.0251 119.1426 59.6491 31.7661 179.5018 240 Q 3.8651 8.2699 118.5702 59.1408 28.3604 178.9675 241 T 3.5602 7.4148 116.1861 66.4227 68.7072 176.5708 242 I 2.7801 7.3319 121.7112 63.9609 36.8008 178.4189 243 A 4.0454 7.8128 120.6096 54.1377 18.1602 178.7383 244 S 4.6498 7.3597 110.3820 58.2518 63.5208 174.0846 245 N 4.6783 7.9248 125.4090 53.8891 39.2954 174.0354 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 16 I 7.88 4.31 1.79 0.00 0.00 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 1.50 0.63 0.90 0.00 0.00 17 V 8.56 4.43 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 1.03 0.00 0.00 0.96 0.00 0.00 18 G 8.38 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 G 7.87 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 0.00 0.00 0.00 0.00 20 Y 7.77 4.97 0.00 2.92 2.98 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 0.00 0.00 0.00 21 T 8.57 4.32 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 1.22 0.00 0.00 22 C 8.82 4.35 0.00 2.73 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 23 G 8.56 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 24 A 8.60 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 25 N 8.85 4.25 0.00 2.86 2.91 0.00 0.00 7.35 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 26 T 7.63 4.23 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 1.31 0.00 0.00 27 V 7.02 4.09 1.75 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 0.31 0.00 0.00 0.77 0.00 0.00 28 P 0.00 4.56 0.00 2.39 2.42 0.00 3.83 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 1.97 0.00 29 Y 6.85 4.98 0.00 3.16 3.38 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 30 Q 7.33 4.59 0.00 1.78 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.52 0.00 0.00 0.00 0.00 0.00 1.93 2.52 0.00 31 V 8.83 4.87 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 0.87 0.00 0.00 0.97 0.00 0.00 32 S 8.79 4.91 0.00 3.06 3.29 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 33 L 8.36 4.57 0.00 0.56 0.91 0.81 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 34 N 8.99 5.81 0.00 2.36 2.42 0.00 0.00 6.50 7.03 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 *37 S 8.44 4.37 0.00 3.85 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 G 9.93 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 39 Y 6.85 4.55 0.00 3.04 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 40 H 8.68 4.71 0.00 2.82 3.12 0.00 5.86 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 7.60 4.87 0.00 3.12 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 42 C 6.59 4.72 0.00 2.37 2.88 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 43 G 8.40 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 0.00 0.00 0.00 0.00 44 G 7.88 4.58 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 0.00 0.00 0.00 45 S 8.78 5.49 0.00 3.81 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 46 L 9.09 4.77 0.00 1.87 1.66 1.07 0.84 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 47 I 8.31 4.53 1.90 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.92 0.95 0.00 0.00 48 N 7.51 4.60 0.00 2.99 2.99 0.00 0.00 6.12 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 49 S 8.50 4.38 0.00 4.05 4.19 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 50 Q 9.16 4.55 0.00 2.08 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.92 0.00 0.00 0.00 0.00 0.00 2.07 2.20 0.00 51 W 8.39 5.54 0.00 3.39 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 52 V 9.05 5.16 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 1.16 0.00 0.00 0.98 0.00 0.00 53 V 8.84 4.97 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 0.74 0.00 0.00 1.01 0.00 0.00 54 S 8.94 5.01 0.00 3.90 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 55 A 8.52 4.82 1.23 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 0.00 0.00 0.00 56 A 8.38 3.75 0.26 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 57 H 8.53 4.53 0.00 3.35 3.55 0.00 5.55 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 7.97 4.74 0.00 3.20 3.29 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 59 Y 7.82 4.16 0.00 2.99 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 60 K 6.57 3.73 0.00 1.49 1.32 0.00 0.78 0.00 0.00 1.31 0.00 0.00 2.45 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.74 1.00 7.81 61 S 8.15 4.28 0.00 3.95 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 62 G 8.30 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 0.00 0.00 0.00 63 I 7.28 4.48 1.84 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 1.39 1.23 0.89 0.00 0.00 64 Q 8.76 4.79 0.00 1.98 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.86 0.00 0.00 0.00 0.00 0.00 2.04 2.19 0.00 65 V 8.93 4.48 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 0.91 0.00 0.00 0.88 0.00 0.00 65A R 8.80 5.09 0.00 1.49 1.67 0.00 2.62 0.00 0.00 2.26 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 1.12 0.00 66 L 9.01 4.70 0.00 1.63 1.62 0.95 0.98 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 *69 G 8.23 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 E 8.42 4.64 0.00 2.06 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 2.35 2.06 0.00 71 D 7.76 4.76 0.00 2.72 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 72 N 8.88 4.96 0.00 2.84 2.82 0.00 0.00 7.22 7.97 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 73 I 8.38 4.01 1.40 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.53 -0.52 0.00 0.00 74 N 8.53 4.80 0.00 2.84 2.87 0.00 0.00 6.62 8.79 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 75 V 7.35 4.29 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 0.73 0.00 0.00 0.99 0.00 0.00 76 V 8.43 4.13 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 0.75 0.00 0.00 0.95 0.00 0.00 77 E 8.99 4.35 0.00 2.01 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 2.47 0.00 78 G 8.45 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 79 N 8.97 4.66 0.00 2.90 3.20 0.00 0.00 6.94 7.67 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 80 E 7.55 5.02 0.00 1.56 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 2.71 2.31 0.00 81 Q 8.61 4.43 0.00 1.98 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 6.87 0.00 0.00 0.00 0.00 0.00 2.31 2.36 0.00 82 F 8.88 5.54 0.00 2.77 2.79 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 83 I 8.91 4.74 1.87 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 1.25 0.80 0.95 0.00 0.00 84 S 8.62 4.68 0.00 3.75 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 85 A 8.17 4.44 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 86 S 9.09 4.45 0.00 3.72 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 K 7.59 4.76 0.00 1.86 1.84 0.00 1.60 0.00 0.00 1.92 0.00 0.00 2.85 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.30 1.37 7.81 88 S 8.77 5.22 0.00 4.10 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 89 I 9.25 4.49 2.06 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.19 1.08 0.00 0.00 90 V 8.29 4.19 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 0.59 0.00 0.00 0.76 0.00 0.00 91 H 8.59 3.96 0.00 2.82 3.08 0.00 5.65 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 P 0.00 4.32 0.00 2.06 2.14 0.00 3.13 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.22 0.00 93 S 7.89 4.70 0.00 3.91 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 Y 8.10 4.27 0.00 2.94 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 95 N 8.30 4.47 0.00 2.59 2.46 0.00 0.00 6.50 6.86 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 96 S 7.79 3.91 0.00 3.93 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 97 N 8.47 4.46 0.00 2.70 2.78 0.00 0.00 6.76 7.25 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 98 T 7.74 4.04 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 1.15 0.00 0.00 99 L 7.96 3.80 0.00 1.51 1.91 0.73 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 100 N 7.74 4.49 0.00 2.81 2.64 0.00 0.00 7.27 6.40 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 0.00 101 N 8.65 4.96 0.00 3.05 2.65 0.00 0.00 7.22 8.27 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 0.00 102 D 7.93 4.72 0.00 3.08 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 I 7.19 4.83 1.46 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 1.34 1.22 0.18 0.00 0.00 104 M 9.09 5.43 0.00 2.13 1.83 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.65 0.00 105 L 9.10 5.41 0.00 1.82 1.88 0.28 0.62 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 0.00 106 I 9.08 5.01 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 1.20 0.83 0.88 0.00 0.00 107 K 8.90 3.79 0.00 0.79 1.12 0.00 1.21 0.00 0.00 1.34 0.00 0.00 2.61 0.00 0.00 2.80 0.00 0.00 0.00 0.00 0.67 0.21 7.81 108 L 7.96 4.63 0.00 1.50 1.54 0.96 1.06 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 0.00 109 K 8.94 4.04 0.00 1.77 1.80 0.00 1.72 0.00 0.00 1.68 0.00 0.00 2.91 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.42 1.39 7.81 110 S 7.74 4.69 0.00 3.81 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 0.00 111 A 8.32 4.45 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 0.00 112 A 8.85 4.43 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 0.00 113 S 8.81 4.56 0.00 3.78 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 L 8.48 4.63 0.00 1.66 1.69 0.96 1.11 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 0.00 115 N 8.72 4.71 0.00 2.85 2.92 0.00 0.00 6.94 7.72 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 0.00 116 S 8.81 4.29 0.00 4.01 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 0.00 117 R 8.72 4.17 0.00 2.02 2.02 0.00 3.07 0.00 0.00 3.35 7.38 0.00 0.00 0.00 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1.20 0.00 0.00 *127 S 7.59 5.00 0.00 4.00 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 0.00 128 C 8.38 4.46 0.00 2.94 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 0.00 129 A 7.96 4.44 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 S 8.01 4.42 0.00 3.84 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *132 A 8.14 4.33 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 0.00 133 G 9.14 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 T 7.65 3.98 4.17 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 0.00 0.00 0.00 1.14 0.00 0.00 135 Q 8.57 4.67 0.00 2.03 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.77 6.90 0.00 0.00 0.00 0.00 0.00 2.33 2.47 0.00 136 C 9.26 5.26 0.00 2.79 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 0.00 137 L 9.00 5.20 0.00 1.75 1.56 1.04 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 138 I 9.07 5.27 1.86 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 0.75 1.44 0.96 0.00 0.00 139 S 9.07 4.94 0.00 3.49 3.58 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 0.00 140 G 7.35 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 W 8.41 4.81 0.00 3.11 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 0.00 142 G 8.31 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 0.00 143 N 8.70 3.93 0.00 2.28 2.66 0.00 0.00 7.00 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 T 8.32 5.10 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 145 K 7.75 4.64 0.00 1.81 1.70 0.00 1.72 0.00 0.00 1.66 0.00 0.00 3.00 0.00 0.00 3.30 0.00 0.00 0.00 0.00 1.31 1.36 7.81 146 S 8.73 4.26 0.00 3.86 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 0.00 147 S 7.98 4.45 0.00 3.82 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 0.00 148 G 7.85 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 0.00 0.00 0.00 149 T 8.20 4.51 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 1.34 0.00 0.00 150 S 9.46 4.45 0.00 3.73 3.60 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.69 5.01 0.00 2.96 2.92 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 0.00 152 P 0.00 4.75 0.00 2.43 2.11 0.00 4.21 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.05 0.00 153 D 8.67 4.65 0.00 2.80 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 0.00 154 V 7.40 5.67 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 1.00 0.00 0.00 0.97 0.00 0.00 155 L 8.30 3.17 0.00 1.26 1.24 -0.83 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.11 4.87 0.00 1.69 1.50 0.00 1.61 0.00 0.00 1.56 0.00 0.00 2.82 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.41 1.47 7.81 157 C 8.59 5.27 0.00 1.46 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 0.00 0.00 0.00 0.00 158 L 8.62 5.00 0.00 1.69 1.44 1.01 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 159 K 8.94 5.15 0.00 1.82 1.82 0.00 1.89 0.00 0.00 1.77 0.00 0.00 2.79 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.64 7.81 160 A 9.33 4.87 1.17 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 0.00 0.00 0.00 0.00 0.00 0.00 161 P 0.00 5.07 0.00 2.03 2.26 0.00 3.13 0.00 0.00 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.75 0.00 162 I 8.24 4.50 1.88 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.59 0.79 0.00 0.00 163 L 8.75 4.79 0.00 1.55 1.62 0.93 0.85 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 0.00 164 S 8.40 4.46 0.00 4.01 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 D 8.66 4.46 0.00 2.77 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 0.00 166 S 8.01 4.16 0.00 4.05 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 0.00 167 S 8.12 4.14 0.00 3.93 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 0.00 168 C 8.33 4.27 0.00 3.20 3.33 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 0.00 169 K 8.30 3.93 0.00 1.97 1.90 0.00 1.76 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.54 1.64 7.81 170 S 7.78 4.17 0.00 4.02 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 0.00 171 A 7.75 4.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 Y 7.96 4.96 0.00 3.11 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 0.00 173 P 0.00 4.69 0.00 2.21 2.11 0.00 3.58 0.00 0.00 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.96 0.00 174 G 9.03 3.98 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 0.00 0.00 0.00 0.00 0.00 0.00 175 Q 8.33 4.53 0.00 2.32 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.94 0.00 0.00 0.00 0.00 0.00 2.28 2.54 0.00 176 I 7.83 4.47 1.98 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 1.89 0.98 1.00 0.00 0.00 177 T 8.20 4.58 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 1.25 0.00 0.00 178 S 8.56 4.46 0.00 4.01 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 0.00 179 N 8.24 5.13 0.00 2.97 3.10 0.00 0.00 6.68 7.54 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 0.00 180 M 8.26 6.03 0.00 1.80 1.98 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.44 0.00 181 F 8.19 5.07 0.00 2.98 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 0.00 182 C 9.05 5.58 0.00 2.97 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 0.00 183 A 9.17 5.05 1.18 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 0.00 0.00 0.00 0.00 0.00 0.00 184 G 7.02 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184A Y 8.38 4.65 0.00 3.00 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 0.00 185 L 8.60 4.28 0.00 1.73 1.72 0.92 0.88 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 0.00 186 E 8.20 4.19 0.00 2.10 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 0.00 2.33 2.26 0.00 187 G 7.51 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 0.00 0.00 0.00 188 G 9.22 4.17 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188A K 7.22 4.88 0.00 1.43 1.63 0.00 0.88 0.00 0.00 1.38 0.00 0.00 2.42 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.19 1.15 7.81 189 D 8.82 4.61 0.00 2.79 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 S 8.73 4.99 0.00 4.02 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 191 C 9.26 4.73 0.00 2.95 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 0.00 192 Q 8.63 4.29 0.00 2.23 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.16 5.27 0.00 0.00 0.00 0.00 0.00 2.67 2.53 0.00 193 G 9.30 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 0.00 194 D 8.50 4.68 0.00 2.96 2.79 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 0.00 195 S 8.08 4.48 0.00 3.97 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 0.00 196 G 8.99 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 0.00 197 G 7.91 4.54 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 0.00 0.00 0.00 198 P 0.00 5.15 0.00 2.33 2.35 0.00 3.70 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.22 0.00 199 V 8.46 4.59 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.64 0.00 0.00 200 V 8.73 4.90 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 0.81 0.00 0.00 0.67 0.00 0.00 201 C 8.87 5.14 0.00 2.79 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 0.00 202 S 9.83 3.57 0.00 3.91 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 0.00 203 G 8.35 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 0.00 204 K 7.77 4.68 0.00 1.69 1.64 0.00 1.88 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.48 1.40 7.81 *209 L 8.24 4.24 0.00 1.51 1.65 1.02 0.76 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 0.00 210 Q 8.77 4.47 0.00 1.99 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 6.33 0.00 0.00 0.00 0.00 0.00 2.25 2.33 0.00 211 G 8.01 5.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 I 8.19 5.18 1.92 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 1.30 0.96 1.01 0.00 0.00 213 V 8.96 3.81 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 1.19 0.00 0.00 214 S 8.44 4.90 0.00 3.88 3.75 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 0.00 0.00 0.00 0.00 215 W 7.51 4.99 0.00 3.37 2.98 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 0.00 0.00 0.00 216 G 8.36 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 0.00 217 S 8.78 4.60 0.00 4.32 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *219 G 7.92 4.19 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 0.00 220 C 8.15 5.02 0.00 2.95 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 0.00 221 A 8.97 4.01 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221A Q 7.28 4.67 0.00 2.25 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.20 6.95 0.00 0.00 0.00 0.00 0.00 2.38 2.47 0.00 222 K 8.43 4.14 0.00 1.72 1.71 0.00 1.94 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.42 1.55 7.81 223 N 9.20 4.26 0.00 2.78 2.80 0.00 0.00 6.76 7.50 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 0.00 224 K 7.51 4.27 0.00 1.66 1.80 0.00 1.63 0.00 0.00 1.34 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.49 7.81 225 P 0.00 4.63 0.00 2.13 2.11 0.00 3.57 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 2.11 1.99 0.00 226 G 8.44 3.75 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 227 V 7.42 4.41 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 0.00 0.00 0.45 0.00 0.00 -0.65 0.00 0.00 228 Y 8.10 4.90 0.00 1.43 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 229 T 8.53 4.52 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 1.22 0.00 0.00 230 K 9.31 5.07 0.00 2.11 1.92 0.00 1.82 0.00 0.00 1.81 0.00 0.00 2.90 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.54 1.63 7.81 231 V 8.79 3.93 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 1.14 0.00 0.00 232 C 8.35 4.38 0.00 3.17 3.23 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 0.00 233 N 8.01 4.31 0.00 2.39 2.41 0.00 0.00 6.92 7.63 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 0.00 234 Y 8.00 4.81 0.00 3.09 3.19 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 0.00 235 V 8.07 3.68 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 1.04 0.00 0.00 1.11 0.00 0.00 236 S 8.10 4.13 0.00 3.97 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 237 W 8.28 4.15 0.00 3.50 3.63 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 0.00 238 I 8.34 3.18 2.03 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 1.65 1.08 0.77 0.00 0.00 239 K 8.03 3.75 0.00 1.86 1.78 0.00 1.65 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.38 1.60 7.81 240 Q 8.27 3.87 0.00 2.01 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.81 0.00 0.00 0.00 0.00 0.00 2.34 2.49 0.00 241 T 7.41 3.56 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 0.79 0.00 0.00 242 I 7.33 2.78 1.55 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.28 0.41 0.00 0.00 243 A 7.81 4.05 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 0.00 244 S 7.36 4.65 0.00 3.95 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 0.00 245 N 7.92 4.68 0.00 3.07 3.07 0.00 0.00 6.75 7.59 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 * Residues marked with a * may have inaccurate shift predictions.