NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 R 4.3913 8.3545 119.0729 55.4700 32.2224 176.5321 4 R 4.3762 7.4210 116.0488 54.9008 31.2196 176.5120 5 P 4.2069 0.0000 0.0000 62.3161 31.0761 177.0937 6 A 4.5515 8.3003 121.0085 53.1704 17.4615 176.9404 7 R 4.3998 7.7826 123.0410 57.9773 32.1527 181.7139 8 C 4.7505 8.1442 117.9927 55.5591 38.8080 173.8787 *9 Y 4.7029 7.2652 124.2292 55.8610 39.7825 177.3417 10 R 4.1464 8.7439 118.0799 60.0722 31.1241 170.5125 *11 Y 4.3586 8.2442 131.4677 56.4819 41.6207 170.5456 12 Q 4.2326 8.8632 129.4673 54.1947 34.2690 176.4901 13 K 3.9660 8.2344 119.6428 53.9038 29.7341 176.5819 14 N 4.9592 7.6920 131.1367 53.2825 41.1150 177.8996 15 K 3.7117 8.0418 128.9062 55.7812 31.9585 172.5543 16 P 4.8758 0.0000 0.0000 62.8782 33.7637 176.3622 *17 Y 4.3684 7.8838 131.3261 54.8532 35.7999 174.6160 18 P 4.3340 0.0000 0.0000 63.4577 31.3930 178.9995 19 K 4.2160 8.0147 120.2524 57.1402 30.6912 181.5135 20 S 4.9615 7.7944 130.2664 59.5440 60.8659 181.4410 21 R 4.0439 8.4363 119.4554 61.2577 29.4442 175.8566 *22 Y 4.3722 7.9167 116.7683 58.3291 37.9099 179.4387 23 N 4.8543 8.2736 119.3246 51.1176 37.3889 176.6573 24 R 4.1796 8.0234 119.2955 56.8608 29.5428 176.4113 25 A 4.9128 8.9767 135.0000 52.1057 19.3383 176.2472 26 V 3.4445 7.6497 119.2180 61.1365 30.9584 178.2032 27 P 4.2062 0.0000 0.0000 62.0641 30.3319 173.9934 28 D 4.6033 8.6576 125.3801 52.2706 41.2357 176.8499 29 S 4.7501 8.3905 114.8435 58.9500 61.3348 175.8622 30 K 4.7697 8.6306 116.1743 57.5774 39.0218 173.5454 31 I 4.5289 7.6021 118.6163 58.8109 35.5775 178.6785 32 R 4.4893 7.9931 130.1685 57.1328 30.1111 177.1803 33 I 4.7198 8.0939 118.1203 58.8351 39.6462 178.3121 *34 Y 5.5120 8.2255 128.6439 57.0402 37.8623 169.9805 35 D 4.5528 8.7494 133.4191 53.9660 38.3295 178.5483 36 L 4.0413 5.9744 117.5034 55.3912 38.3400 180.4712 37 G 4.0567 7.7033 116.5674 46.3903 0.0000 172.0748 38 K 4.3532 8.6184 120.7121 54.7969 31.6271 173.5708 39 K 4.0538 8.1366 124.3257 56.3891 32.1128 178.7134 40 K 3.9004 8.8186 114.6397 56.7667 28.8905 170.5775 41 A 4.2688 8.0184 124.7788 53.9517 18.7574 179.0236 42 T 4.0162 8.5179 112.0442 62.3353 68.7183 174.0172 43 V 3.5294 8.0109 116.1479 62.1535 30.8643 176.7792 44 D 5.1530 7.7359 119.8763 53.4610 42.0162 181.8002 45 E 3.6851 8.8700 118.0755 59.1927 29.0393 174.4573 *46 F 4.5249 9.1018 114.3835 58.5668 37.5415 174.8785 47 P 4.6316 0.0000 0.0000 63.5372 30.1223 182.4196 48 L 3.7662 7.6658 116.5659 55.8078 37.1764 173.1293 49 C 4.9086 8.3039 127.3981 54.3608 42.0576 171.5779 50 V 4.6457 7.9008 125.4713 59.8613 33.4014 173.5092 *51 H 4.9811 9.4283 126.1867 53.1032 32.5231 171.0733 52 L 4.9058 8.5335 124.0826 54.2855 42.6134 176.8163 53 V 4.5535 8.2481 127.1422 60.6511 33.7279 173.7029 54 S 4.6619 9.4186 126.0775 56.6604 64.5168 173.3519 55 N 5.1028 8.1610 125.9333 48.8438 37.0686 172.8234 56 E 5.1174 8.2092 116.8940 58.9216 32.4932 180.7172 57 L 4.3680 6.6799 123.7477 55.2650 38.3031 176.6501 58 E 4.8300 8.1108 124.4229 55.3040 35.2281 175.4842 59 Q 5.7491 8.4750 119.3981 54.6898 27.8479 170.6626 60 L 4.0317 8.3080 127.2922 55.6261 41.6553 177.6029 61 S 4.1146 8.6594 127.0586 59.4802 62.9647 172.0463 62 S 4.5007 9.1758 118.5078 63.5680 61.7286 172.0559 63 E 4.1252 8.3928 119.3682 61.4871 29.8989 181.2946 64 A 4.2321 8.1318 123.1001 55.9189 18.3100 179.9521 65 L 4.0017 7.4727 121.1478 61.2021 41.1216 181.0805 66 E 3.9980 8.5411 117.5317 60.7634 29.4469 181.4871 67 A 4.0659 8.5065 119.2148 55.4177 19.0290 178.9096 68 A 3.9105 8.3942 121.3712 56.2654 18.2461 180.2567 69 R 3.9214 8.6771 119.6402 62.0241 29.6533 181.3873 70 I 3.4895 8.2954 116.2418 66.6459 35.0541 179.0479 71 C 4.2104 6.5095 124.2681 62.9763 28.4829 177.6530 72 A 4.2854 7.9881 123.5116 56.5283 17.9598 180.0325 73 N 4.3361 9.0722 119.9577 59.1726 37.7314 180.3842 74 K 4.4304 8.4229 127.6509 60.5102 31.9104 180.4646 *75 Y 4.2027 8.4943 122.2332 63.7247 36.9546 181.3929 76 M 3.9380 7.8060 123.1055 60.5306 31.4237 181.2602 77 T 4.5299 8.7903 118.9755 66.0099 68.6697 179.5680 78 T 4.4431 8.2499 121.0544 65.7203 68.7392 177.4813 79 V 4.8240 7.8413 117.7875 61.3868 33.2424 181.9732 80 S 4.6447 9.8235 117.2925 58.6076 69.3002 177.5853 81 G 3.9991 8.2242 106.1452 45.5596 0.0000 174.5429 82 R 3.9233 8.4582 118.9645 58.7377 29.5284 176.6008 83 D 4.7573 7.6990 114.5182 52.5798 39.1727 179.4543 84 A 4.8098 7.9868 135.0000 53.1785 21.7010 177.9138 *85 F 4.7890 7.6748 122.0088 57.0281 36.4541 179.7477 *86 H 4.2828 9.2774 113.7750 57.0120 23.7085 172.8315 87 L 4.8727 8.3163 129.4182 52.8328 40.0260 175.4094 88 R 3.6579 8.3473 125.0860 57.8911 29.6818 177.0159 89 V 3.3910 9.1076 126.5143 62.2750 31.4822 174.7129 90 R 4.1122 8.0827 118.4769 57.3619 28.6582 179.2769 91 V 4.1063 7.7150 117.7994 61.4461 31.4212 182.8061 *92 H 4.4853 9.5402 113.7714 55.0550 28.2399 175.9040 93 P 5.1891 0.0000 0.0000 59.6932 31.0522 175.2335 *94 F 4.4002 7.9128 133.4625 56.0906 37.9214 178.9785 *95 H 3.7491 9.0323 111.1861 57.7984 24.1340 171.1846 96 V 4.1881 8.0815 126.1678 60.9526 31.6606 175.0404 97 L 4.5047 8.7722 131.7438 54.3012 42.7699 172.9259 98 R 5.5849 8.3185 118.9933 56.1811 34.1767 173.5812 99 I 4.8168 8.2731 117.3820 61.0079 40.3716 171.8853 100 N 5.4549 8.2971 119.7167 53.4855 41.5197 171.4998 101 K 4.1037 8.3624 119.6105 56.2494 35.3893 176.4459 *113 Q 4.2961 8.4313 115.2502 56.2125 28.5317 174.9873 114 G 4.2165 8.8134 113.0596 44.2049 0.0000 172.4319 115 M 5.2668 7.5994 132.7125 55.7288 33.6009 179.5472 116 R 4.3357 7.5835 120.4082 55.4456 29.0297 174.4960 117 G 3.7195 8.5046 115.4468 44.4722 0.0000 169.9586 118 A 4.5228 8.2270 129.5351 50.3375 21.7536 176.6078 *119 W 4.5252 8.4982 123.7423 54.7421 30.0150 172.8394 120 G 4.4756 8.4490 107.1881 47.7662 0.0000 173.8253 121 K 4.7601 8.5468 127.7863 53.0032 34.0439 175.0307 122 P 4.7069 0.0000 0.0000 63.3561 31.6694 174.6354 *123 H 4.7103 9.9490 118.1351 55.5678 29.8337 174.1867 124 G 3.9747 8.5088 110.0445 45.3745 0.0000 174.1299 125 L 5.2029 8.7207 125.0957 52.5082 42.8395 173.7296 126 A 5.0763 8.4042 126.3752 49.2037 22.9961 174.1118 127 A 4.7150 8.3669 118.7919 51.3130 23.1866 177.3871 128 R 4.4392 8.7112 123.5995 56.4605 29.7080 177.8062 129 V 3.9412 8.7367 128.5008 60.6103 32.0965 173.6989 130 D 4.7330 8.7005 130.9183 53.4408 41.1338 174.2852 131 I 4.1820 8.4733 120.8971 62.2607 34.0249 172.5799 132 G 3.4615 9.0382 122.1090 45.3569 0.0000 173.2801 133 Q 4.2602 8.6830 124.9708 56.4409 29.4576 181.5240 134 I 4.4844 8.3517 122.7641 60.8178 36.9556 176.6945 135 I 4.4686 8.2094 129.1230 58.0954 39.5334 174.8689 *136 F 4.4140 6.8862 121.5970 60.9311 34.1140 173.7074 137 S 4.7913 8.2417 121.3248 58.1789 63.0931 177.9377 138 V 4.7046 8.3911 125.3338 59.5273 35.9764 172.0159 139 R 4.9193 8.3273 119.4487 58.2131 33.2459 173.0280 140 T 4.6170 8.0890 118.0947 60.1915 73.1491 171.8493 141 K 4.3003 8.6661 123.3198 56.0764 32.6956 175.5849 142 D 4.6017 9.0334 120.1541 58.2961 39.5118 181.4845 143 S 4.3593 8.2535 112.6963 59.4571 61.7769 176.9229 144 N 4.9474 8.4805 119.7584 53.3081 39.0879 181.1924 145 K 3.7806 7.7087 118.6497 62.3262 31.6792 183.3783 146 D 4.6890 8.9794 122.9983 59.6427 40.5926 181.0900 147 V 3.3508 8.2832 115.9247 66.9391 31.6054 181.1884 148 V 3.8572 7.2653 120.8694 67.4177 32.2318 181.0836 149 V 3.8991 8.5616 122.5346 66.8725 31.2278 180.8459 150 E 4.3172 9.1000 119.0383 60.8841 29.8736 181.4314 151 G 4.0003 8.1681 108.6070 48.5434 0.0000 176.3227 152 L 4.1098 8.2249 128.1109 59.4994 40.5988 181.8885 153 R 4.1540 8.2592 122.0502 64.1299 29.2307 183.8814 154 R 3.7728 8.0037 118.6879 60.0367 29.4882 179.9085 155 A 4.2041 8.5815 123.3194 56.0952 18.3709 180.6166 156 R 3.8874 7.6623 116.8363 60.3226 29.6782 180.3656 *157 Y 4.1143 7.8842 118.1393 59.4078 37.0878 179.2275 158 K 4.3166 9.0148 123.0656 54.6110 33.0639 179.4573 *159 F 3.3408 7.7031 120.3217 59.3636 34.4578 174.5779 160 P 3.9983 0.0000 0.0000 62.5172 27.6425 175.6015 161 G 3.7423 7.6801 113.1646 47.3941 0.0000 172.1153 162 Q 4.0334 9.6168 117.6155 54.0860 29.7346 172.0589 163 Q 4.0124 9.1806 118.5438 58.2367 26.7510 168.8343 164 K 4.2941 8.2507 125.1220 55.6843 34.3303 174.5947 165 I 3.3343 7.6536 117.3762 61.0134 32.6447 176.1311 166 I 4.3638 7.9711 123.7363 59.4875 37.2553 177.5331 167 L 5.1070 8.3382 125.0408 53.2388 43.6586 177.2380 168 S 4.8202 8.8611 120.2870 57.3841 63.5077 173.7849 169 K 4.2783 8.0962 120.5890 58.9894 36.7928 170.6886 170 K 4.3827 9.3811 118.5854 57.8948 37.2377 172.8215 *171 W 3.4949 8.6907 117.8090 58.3684 26.0975 172.0490 172 G 4.6570 8.1535 105.1552 48.2253 0.0000 173.4861 *173 F 4.3734 8.2102 116.8728 58.0830 39.1398 178.1053 174 T 4.4315 7.7793 112.5967 63.9127 71.0984 179.3877 175 N 3.8446 7.6611 114.1046 56.1423 39.1430 171.0970 176 L 4.3777 7.6929 120.5637 53.3412 44.2048 176.4377 177 D 4.5849 9.5301 127.1353 54.0704 39.2379 173.8352 178 R 3.7870 8.4016 122.9999 56.6007 27.6654 174.7600 179 P 4.3054 0.0000 0.0000 66.8665 31.0209 183.2059 180 E 3.9954 8.2784 117.1882 59.3971 29.5560 180.8205 *181 Y 4.1282 7.4705 122.4090 61.4791 35.2183 181.9484 182 L 4.3059 8.0122 125.4755 60.5243 41.4961 182.1838 183 K 4.4353 8.2991 124.8509 59.0003 31.7647 181.4187 184 K 4.6619 10.5398 124.5326 60.0757 32.3265 185.0000 185 R 4.6327 7.3744 119.9681 59.1380 29.3590 181.2802 186 E 4.3479 8.2290 119.7062 61.4146 29.9520 180.0520 187 A 4.4379 7.6406 130.2530 54.9034 18.5516 175.3919 188 G 3.8443 8.8043 113.6880 46.8598 0.0000 172.0682 189 E 5.4931 9.7045 128.5273 57.9963 32.4478 175.8353 190 V 2.9737 8.2220 120.9178 61.3543 31.5698 172.1505 191 K 4.0016 8.6307 120.2990 58.9717 33.0833 173.1718 192 D 4.5127 8.6933 123.7889 53.3781 39.0424 178.0894 193 D 4.2832 8.8799 118.4163 55.4294 39.2547 176.3653 194 G 4.0925 8.4444 111.3006 45.8589 0.0000 175.4066 195 A 4.3170 8.2511 131.5815 53.0571 21.5884 175.3292 *196 F 4.4389 8.4356 131.1775 58.5426 44.9063 176.3432 197 V 4.0704 9.0564 115.7479 62.0444 29.3145 178.7213 198 K 4.4020 7.9775 129.7401 54.8498 29.8346 178.8435 *199 F 4.7717 7.8862 130.8750 56.1298 38.6638 177.9902 200 L 4.7232 7.5413 121.4729 60.4537 42.2679 183.0302 201 S 3.8057 7.0148 119.5374 60.5379 59.1001 175.9914 202 K 4.1057 7.8801 126.8637 55.6919 32.5501 179.5239 203 K 4.3160 9.7258 116.5563 55.6199 31.0171 181.7386 204 G 3.9529 8.0441 112.6632 46.3744 0.0000 172.0376 205 S 4.6120 8.2961 128.0389 58.4886 69.4998 173.8991 206 L 4.5592 6.7480 120.8139 54.1219 43.4222 182.1848 207 E 3.4095 7.9983 111.9884 57.3799 32.3025 183.8738 208 N 3.5024 7.1993 116.9696 54.9616 39.7472 178.8934 209 N 4.4729 6.9563 121.7439 58.9423 38.0594 179.2144 210 I 3.9512 7.9874 123.5635 66.1295 35.1242 180.9830 211 R 4.0440 8.6488 124.6981 61.8202 29.1929 180.2925 212 E 4.4731 8.8555 120.2949 60.0273 29.1512 184.8822 *213 F 4.2087 7.3950 124.8445 63.3997 38.9338 178.3324 214 P 4.0115 0.0000 0.0000 69.4260 30.5229 179.8035 215 E 4.3204 8.2657 120.3517 61.3269 30.0445 181.2180 *216 Y 4.5035 7.6936 121.1258 62.4313 37.0043 183.0608 *217 F 4.7867 7.7559 118.3867 60.8697 40.0792 182.6728 218 A 4.1604 8.2235 120.7104 55.1577 18.2586 178.5823 219 A 4.1174 8.6809 120.7650 55.8703 18.7712 179.8014 220 Q 4.3271 8.1990 115.9226 54.1362 27.2766 179.0524 221 A 4.1670 7.6438 127.6028 53.6404 19.0881 176.9458 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 3 R 8.35 4.39 0.00 1.85 1.79 0.00 3.21 0.00 0.00 3.22 7.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.20 0.00 4 R 7.42 4.38 0.00 1.84 1.74 0.00 3.35 0.00 0.00 3.25 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.26 0.00 5 P 0.00 4.21 0.00 2.25 2.00 0.00 3.70 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.57 0.00 6 A 8.30 4.55 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 7 R 7.78 4.40 0.00 1.82 1.82 0.00 3.27 0.00 0.00 3.26 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.16 0.00 8 C 8.14 4.75 0.00 2.72 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 *9 Y 7.27 4.70 0.00 2.30 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 0.00 0.00 0.00 10 R 8.74 4.15 0.00 1.82 1.79 0.00 3.28 0.00 0.00 3.26 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.21 0.00 *11 Y 8.24 4.36 0.00 2.26 1.55 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 0.00 0.00 0.00 0.00 12 Q 8.86 4.23 0.00 1.91 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.16 0.00 0.00 0.00 0.00 0.00 2.13 1.76 0.00 13 K 8.23 3.97 0.00 1.84 1.86 0.00 1.93 0.00 0.00 1.74 0.00 0.00 2.80 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.29 0.99 7.81 14 N 7.69 4.96 0.00 2.86 2.70 0.00 0.00 6.74 7.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 K 8.04 3.71 0.00 1.76 1.60 0.00 1.81 0.00 0.00 1.74 0.00 0.00 2.91 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.37 1.03 7.81 16 P 0.00 4.88 0.00 2.02 1.82 0.00 3.71 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.51 0.00 *17 Y 7.88 4.37 0.00 2.23 2.24 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 18 P 0.00 4.33 0.00 1.99 2.08 0.00 3.82 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.60 0.00 19 K 8.01 4.22 0.00 1.85 1.76 0.00 1.77 0.00 0.00 1.74 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.32 1.24 7.81 20 S 7.79 4.96 0.00 3.69 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 21 R 8.44 4.04 0.00 1.83 1.87 0.00 3.22 0.00 0.00 3.26 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.26 0.00 *22 Y 7.92 4.37 0.00 2.32 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 0.00 0.00 0.00 0.00 23 N 8.27 4.85 0.00 2.65 2.62 0.00 0.00 6.94 7.70 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 24 R 8.02 4.18 0.00 1.83 1.78 0.00 3.33 0.00 0.00 3.23 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.19 0.00 25 A 8.98 4.91 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 26 V 7.65 3.44 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 0.74 0.00 0.00 0.93 0.00 0.00 27 P 0.00 4.21 0.00 2.08 1.95 0.00 3.76 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.62 0.00 28 D 8.66 4.60 0.00 2.68 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 29 S 8.39 4.75 0.00 3.62 3.64 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 30 K 8.63 4.77 0.00 1.72 1.67 0.00 1.71 0.00 0.00 1.74 0.00 0.00 2.97 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.27 0.99 7.81 31 I 7.60 4.53 1.87 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 1.27 1.25 0.91 0.00 0.00 32 R 7.99 4.49 0.00 1.82 1.82 0.00 3.17 0.00 0.00 3.26 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.18 0.00 33 I 8.09 4.72 1.87 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 1.27 1.24 0.91 0.00 0.00 *34 Y 8.23 5.51 0.00 2.38 2.16 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 35 D 8.75 4.55 0.00 2.69 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 36 L 5.97 4.04 0.00 1.70 1.60 0.92 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 37 G 7.70 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 38 K 8.62 4.35 0.00 1.79 1.69 0.00 1.86 0.00 0.00 1.74 0.00 0.00 2.88 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.36 1.00 7.81 39 K 8.14 4.05 0.00 1.76 1.73 0.00 1.92 0.00 0.00 1.74 0.00 0.00 2.95 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.38 1.06 7.81 40 K 8.82 3.90 0.00 1.85 1.71 0.00 1.79 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.28 0.98 7.81 41 A 8.02 4.27 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 42 T 8.52 4.02 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 43 V 8.01 3.53 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 0.93 0.00 0.00 44 D 7.74 5.15 0.00 2.66 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 45 E 8.87 3.69 0.00 2.12 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 2.13 1.85 0.00 *46 F 9.10 4.52 0.00 2.29 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 0.00 0.00 0.00 0.00 47 P 0.00 4.63 0.00 1.99 1.66 0.00 3.70 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.58 0.00 48 L 7.67 3.77 0.00 1.72 1.80 0.92 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 49 C 8.30 4.91 0.00 2.51 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 50 V 7.90 4.65 2.08 0.00 0.00 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2.22 0.00 67 A 8.51 4.07 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 68 A 8.39 3.91 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 R 8.68 3.92 0.00 1.82 1.99 0.00 3.31 0.00 0.00 3.20 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.55 0.00 70 I 8.30 3.49 1.87 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 1.50 0.53 0.91 0.00 0.00 71 C 6.51 4.21 0.00 2.86 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 72 A 7.99 4.29 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 73 N 9.07 4.34 0.00 2.71 2.84 0.00 0.00 7.28 7.09 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 74 K 8.42 4.43 0.00 1.75 1.77 0.00 1.78 0.00 0.00 1.68 0.00 0.00 2.91 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.38 1.39 7.81 *75 Y 8.49 4.20 0.00 2.36 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 76 M 7.81 3.94 0.00 2.15 1.96 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.49 0.00 77 T 8.79 4.53 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 78 T 8.25 4.44 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 79 V 7.84 4.82 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 0.86 0.00 0.00 0.93 0.00 0.00 80 S 9.82 4.64 0.00 3.58 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 81 G 8.22 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 82 R 8.46 3.92 0.00 1.84 1.86 0.00 3.25 0.00 0.00 3.26 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.19 0.00 83 D 7.70 4.76 0.00 2.68 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.93 0.00 0.00 *92 H 9.54 4.49 0.00 2.99 3.24 0.00 7.13 0.00 0.00 0.00 0.00 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 P 0.00 5.19 0.00 2.05 1.86 0.00 3.61 0.00 0.00 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.50 0.00 *94 F 7.91 4.40 0.00 2.29 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 0.00 0.00 0.00 *95 H 9.03 3.75 0.00 2.90 3.03 0.00 7.15 0.00 0.00 0.00 0.00 6.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 V 8.08 4.19 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 0.84 0.00 0.00 0.93 0.00 0.00 97 L 8.77 4.50 0.00 1.35 1.58 0.92 0.74 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 98 R 8.32 5.58 0.00 1.52 1.68 0.00 3.07 0.00 0.00 3.92 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.02 0.00 99 I 8.27 4.82 1.87 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 1.20 0.67 0.91 0.00 0.00 100 N 8.30 5.45 0.00 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0.00 0.00 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 G 8.45 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 K 8.55 4.76 0.00 1.45 1.68 0.00 1.83 0.00 0.00 1.85 0.00 0.00 2.78 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.36 0.99 7.81 122 P 0.00 4.71 0.00 1.84 1.91 0.00 3.73 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.64 0.00 *123 H 9.95 4.71 0.00 2.47 2.88 0.00 7.15 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 0.00 124 G 8.51 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 0.00 125 L 8.72 5.20 0.00 1.43 1.46 0.92 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 126 A 8.40 5.08 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 0.00 127 A 8.37 4.71 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 0.00 128 R 8.71 4.44 0.00 1.61 1.78 0.00 3.27 0.00 0.00 3.26 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.20 0.00 129 V 8.74 3.94 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 0.61 0.00 0.00 0.93 0.00 0.00 130 D 8.70 4.73 0.00 2.36 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 0.00 131 I 8.47 4.18 1.87 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 1.35 1.10 0.91 0.00 0.00 132 G 9.04 3.46 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 0.00 133 Q 8.68 4.26 0.00 1.72 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.97 6.87 0.00 0.00 0.00 0.00 0.00 2.29 2.19 0.00 134 I 8.35 4.48 1.87 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 1.20 1.13 0.91 0.00 0.00 135 I 8.21 4.47 1.87 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 1.09 0.67 0.91 0.00 0.00 *136 F 6.89 4.41 0.00 2.09 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 0.00 137 S 8.24 4.79 0.00 3.41 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 0.00 138 V 8.39 4.70 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 0.69 0.00 0.00 0.93 0.00 0.00 139 R 8.33 4.92 0.00 1.54 1.66 0.00 3.27 0.00 0.00 3.26 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.46 0.00 140 T 8.09 4.62 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 0.00 141 K 8.67 4.30 0.00 1.77 1.62 0.00 1.81 0.00 0.00 1.74 0.00 0.00 2.75 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.36 1.00 7.81 142 D 9.03 4.60 0.00 2.59 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 0.00 143 S 8.25 4.36 0.00 3.62 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 0.00 144 N 8.48 4.95 0.00 2.57 2.79 0.00 0.00 7.13 7.69 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 0.00 145 K 7.71 3.78 0.00 1.76 1.64 0.00 1.78 0.00 0.00 1.85 0.00 0.00 2.93 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.45 1.13 7.81 146 D 8.98 4.69 0.00 2.67 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 0.00 147 V 8.28 3.35 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 0.74 0.00 0.00 0.93 0.00 0.00 148 V 7.27 3.86 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 0.71 0.00 0.00 0.93 0.00 0.00 149 V 8.56 3.90 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 0.71 0.00 0.00 0.93 0.00 0.00 150 E 9.10 4.32 0.00 1.91 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.21 0.00 151 G 8.17 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 0.00 152 L 8.22 4.11 0.00 1.67 1.71 0.92 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 153 R 8.26 4.15 0.00 1.81 2.00 0.00 3.26 0.00 0.00 3.20 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.55 0.00 154 R 8.00 3.77 0.00 1.87 1.84 0.00 3.26 0.00 0.00 3.17 7.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.58 0.00 155 A 8.58 4.20 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 0.00 156 R 7.66 3.89 0.00 1.80 1.90 0.00 3.27 0.00 0.00 3.26 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.50 0.00 *157 Y 7.88 4.11 0.00 2.35 2.24 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 0.00 158 K 9.01 4.32 0.00 1.58 1.64 0.00 1.91 0.00 0.00 1.74 0.00 0.00 2.94 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.35 1.24 7.81 *159 F 7.70 3.34 0.00 2.46 2.24 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 0.00 160 P 0.00 4.00 0.00 2.15 2.19 0.00 3.72 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.61 0.00 161 G 7.68 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 0.00 0.00 0.00 162 Q 9.62 4.03 0.00 2.16 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.85 5.51 0.00 0.00 0.00 0.00 0.00 2.09 1.72 0.00 163 Q 9.18 4.01 0.00 2.18 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.82 6.80 0.00 0.00 0.00 0.00 0.00 2.13 1.88 0.00 164 K 8.25 4.29 0.00 1.83 1.70 0.00 1.91 0.00 0.00 1.74 0.00 0.00 2.77 0.00 0.00 2.62 0.00 0.00 0.00 0.00 1.28 1.21 7.81 165 I 7.65 3.33 1.87 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 1.27 1.01 0.91 0.00 0.00 166 I 7.97 4.36 1.87 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 1.16 0.58 0.91 0.00 0.00 167 L 8.34 5.11 0.00 1.64 1.46 0.92 0.71 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 0.00 168 S 8.86 4.82 0.00 3.62 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 8.10 4.28 0.00 1.87 1.73 0.00 1.81 0.00 0.00 1.74 0.00 0.00 2.89 0.00 0.00 2.57 0.00 0.00 0.00 0.00 1.12 0.73 7.81 170 K 9.38 4.38 0.00 1.71 1.59 0.00 1.86 0.00 0.00 1.74 0.00 0.00 2.92 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.21 1.17 7.81 *171 W 8.69 3.49 0.00 2.69 1.74 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 0.00 172 G 8.15 4.66 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 *173 F 8.21 4.37 0.00 2.31 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 0.00 174 T 7.78 4.43 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 0.00 175 N 7.66 3.84 0.00 2.76 2.67 0.00 0.00 6.18 7.79 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 0.00 176 L 7.69 4.38 0.00 1.61 1.42 0.92 0.88 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 0.00 177 D 9.53 4.58 0.00 2.59 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 0.00 178 R 8.40 3.79 0.00 1.81 2.32 0.00 3.22 0.00 0.00 3.37 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.20 0.00 179 P 0.00 4.31 0.00 1.99 2.05 0.00 3.71 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.59 0.00 180 E 8.28 4.00 0.00 1.98 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 1.89 0.00 *181 Y 7.47 4.13 0.00 2.31 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 0.00 0.00 0.00 182 L 8.01 4.31 0.00 1.61 1.73 0.92 0.87 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 0.00 183 K 8.30 4.44 0.00 1.85 1.76 0.00 1.76 0.00 0.00 1.74 0.00 0.00 3.02 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.39 1.33 7.81 184 K 10.54 4.66 0.00 1.75 1.82 0.00 1.78 0.00 0.00 1.68 0.00 0.00 2.91 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.30 1.30 7.81 185 R 7.37 4.63 0.00 1.87 1.84 0.00 3.28 0.00 0.00 3.26 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.52 0.00 186 E 8.23 4.35 0.00 2.03 1.89 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 2.27 2.25 0.00 187 A 7.64 4.44 1.26 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 0.00 188 G 8.80 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 0.00 189 E 9.70 5.49 0.00 2.11 1.80 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 1.99 1.60 0.00 190 V 8.22 2.97 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 0.83 0.00 0.00 0.93 0.00 0.00 191 K 8.63 4.00 0.00 1.76 1.66 0.00 1.90 0.00 0.00 1.74 0.00 0.00 2.98 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.37 1.04 7.81 192 D 8.69 4.51 0.00 2.86 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 193 D 8.88 4.28 0.00 2.80 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 0.00 0.00 0.00 194 G 8.44 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 0.00 195 A 8.25 4.32 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 *196 F 8.44 4.44 0.00 2.25 1.45 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 0.00 197 V 9.06 4.07 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 0.86 0.00 0.00 0.93 0.00 0.00 198 K 7.98 4.40 0.00 1.77 1.67 0.00 1.75 0.00 0.00 1.74 0.00 0.00 2.94 0.00 0.00 2.60 0.00 0.00 0.00 0.00 1.36 1.00 7.81 *199 F 7.89 4.77 0.00 2.28 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 0.00 0.00 0.00 200 L 7.54 4.72 0.00 1.59 1.44 0.92 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 201 S 7.01 3.81 0.00 3.67 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 0.00 202 K 7.88 4.11 0.00 1.77 1.75 0.00 1.80 0.00 0.00 1.74 0.00 0.00 3.02 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.36 1.00 7.81 203 K 9.73 4.32 0.00 1.93 1.86 0.00 1.80 0.00 0.00 1.71 0.00 0.00 2.92 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.22 0.98 7.81 204 G 8.04 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 205 S 8.30 4.61 0.00 3.58 3.69 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 0.00 206 L 6.75 4.56 0.00 1.51 1.42 0.92 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 207 E 8.00 3.41 0.00 1.91 1.80 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 2.31 1.94 0.00 208 N 7.20 3.50 0.00 2.84 2.50 0.00 0.00 6.48 7.99 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 0.00 209 N 6.96 4.47 0.00 2.82 2.86 0.00 0.00 7.36 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 0.00 210 I 7.99 3.95 1.87 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 1.50 0.53 0.91 0.00 0.00 211 R 8.65 4.04 0.00 1.78 1.98 0.00 3.24 0.00 0.00 3.20 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.53 0.00 212 E 8.86 4.47 0.00 1.97 1.80 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 2.24 2.19 0.00 *213 F 7.39 4.21 0.00 2.34 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 0.00 0.00 0.00 0.00 214 P 0.00 4.01 0.00 2.07 1.95 0.00 3.70 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.71 0.00 215 E 8.27 4.32 0.00 1.81 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 2.24 2.19 0.00 *216 Y 7.69 4.50 0.00 2.42 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 0.00 0.00 0.00 0.00 *217 F 7.76 4.79 0.00 2.20 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 0.00 0.00 0.00 0.00 218 A 8.22 4.16 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 0.00 219 A 8.68 4.12 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 0.00 220 Q 8.20 4.33 0.00 2.06 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.85 0.00 0.00 0.00 0.00 0.00 2.31 2.18 0.00 221 A 7.64 4.17 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 * Residues marked with a * may have inaccurate shift predictions.