NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 G 3.7359 8.3544 109.7373 46.6498 0.0000 173.7491 1 D 4.5282 8.9081 110.3172 52.3662 38.8009 171.8592 2 S 4.9826 7.7725 118.8270 55.8827 68.1773 172.6041 3 V 4.8041 8.3987 120.0144 60.3379 33.5807 174.9460 4 T 4.9343 9.0192 120.2655 61.9450 72.5031 172.9011 5 Q 4.9576 8.5523 121.8038 54.4566 32.5530 173.7280 6 M 4.0693 8.5344 122.1220 57.1239 32.5046 176.7313 7 E 4.3727 8.8615 122.4365 55.0952 30.9344 172.5271 8 G 4.1198 8.3840 105.6343 45.6549 0.0000 171.8382 9 P 5.0830 0.0000 0.0000 61.8744 30.3377 176.4774 10 V 4.0041 8.9849 123.5063 63.0756 33.5847 172.1650 11 T 4.1470 8.4095 115.3624 57.5032 67.7253 172.8295 12 L 5.3166 7.8544 132.0255 56.8179 41.7215 174.4205 13 S 4.6283 7.9264 120.1663 57.1394 63.0583 169.6542 14 E 4.1095 8.0092 122.9923 58.8464 29.0917 177.1191 15 E 4.0649 9.4996 125.3680 55.8549 28.7641 176.0517 16 A 4.5639 7.6016 122.2524 52.0477 19.5347 176.7658 17 F 4.4794 8.7758 115.9952 60.0144 40.2617 172.2932 18 L 3.5772 8.0064 135.0000 55.0603 41.6885 173.4887 19 T 4.5382 8.2054 121.6826 60.0253 72.0586 170.3273 20 I 4.3986 8.3523 126.7162 57.5811 38.4208 172.3808 21 N 5.1647 8.9417 125.1311 52.0208 40.5653 174.8386 22 C 6.1169 8.1454 120.8495 57.0288 47.8447 172.3173 23 T 5.2669 8.6178 117.5221 60.4211 72.0398 172.9135 24 Y 5.2075 7.2172 119.4529 56.8468 41.4739 174.8936 25 T 4.7338 9.1130 112.8388 61.1813 69.7516 174.8137 26 A 4.8494 8.7345 135.0000 50.9844 17.5670 178.4198 27 T 4.2975 8.2305 122.2887 66.6478 72.1445 173.4612 28 G 4.2622 7.6103 108.3728 46.0019 0.0000 176.2502 29 Y 4.4864 8.6752 117.0327 55.2900 36.8819 172.4320 30 P 4.6206 0.0000 0.0000 63.0799 32.9949 176.6266 31 S 4.2330 8.8066 114.5485 57.4018 67.4882 173.7911 32 L 4.3151 8.0890 123.2941 52.8461 45.3778 175.1937 33 F 5.2597 8.7661 118.3723 56.3194 44.2343 173.4442 34 W 5.1326 9.1613 120.0307 55.2735 32.2596 174.3922 35 Y 5.3914 9.8906 123.1896 56.2669 41.1021 174.9516 36 V 4.2092 9.0119 121.8153 59.8879 34.4782 174.4298 37 Q 4.7822 8.2280 126.5737 53.4721 29.5494 174.3048 38 Y 4.5800 8.1128 123.0003 56.5742 39.8361 173.2236 39 P 4.2464 0.0000 0.0000 63.9119 31.3166 176.2185 40 G 3.9984 9.0013 110.5272 46.2070 0.0000 172.2502 41 E 4.8695 8.1190 119.7787 54.3326 32.2503 174.5153 42 G 3.9834 8.1689 108.1812 44.9285 0.0000 171.7037 43 L 4.5917 8.1591 119.4535 54.4434 42.2726 176.8960 44 Q 4.7814 9.0766 123.3349 54.1570 31.8448 174.2647 45 L 4.6498 8.6142 123.9451 54.5413 42.7120 174.9767 46 L 4.5248 9.1159 129.7247 55.9093 42.2913 175.7043 47 L 5.1853 7.9193 119.5788 52.2913 46.3254 175.6997 48 K 5.1925 8.8908 123.9707 53.5454 34.8765 175.5491 49 A 4.8028 8.8582 128.5915 48.8996 21.6659 176.7002 50 T 4.7199 8.2401 112.2280 60.4383 69.3939 174.6079 51 K 4.6909 7.5176 123.6988 54.3315 40.3500 178.4364 52 A 4.5074 7.9155 119.7391 52.4347 22.5872 177.5331 53 D 4.8621 7.6061 121.6281 55.8460 42.4028 175.0664 54 D 5.0105 8.9578 116.0671 56.2686 47.3800 175.1048 55 K 3.5930 8.2218 121.1133 57.2109 30.0866 174.9956 56 G 3.1925 7.6280 108.5669 43.8892 0.0000 173.6171 57 S 4.5259 8.6440 109.9282 58.1232 62.7710 168.2539 58 N 3.7756 9.1994 121.9094 53.4091 40.2813 176.5438 59 K 4.2722 8.0265 119.0718 55.1003 28.3372 173.0342 *61 G 3.8700 7.3099 106.2666 46.2588 0.0000 172.5946 62 F 4.8974 8.7502 118.6070 56.1336 40.7412 175.3250 63 E 4.9749 8.7553 121.1691 55.1758 33.9764 173.8099 64 A 5.1472 8.1485 120.7350 52.2899 23.1424 175.3244 65 T 5.1055 8.4452 119.2695 61.7946 71.1945 173.6218 66 Y 4.7972 9.5158 128.2266 57.7426 39.8425 174.7801 67 R 4.6872 9.3516 130.2813 54.5802 31.0106 177.6001 68 K 3.9751 8.2764 125.4066 57.4989 31.5129 176.5314 69 E 3.8172 7.7590 117.0543 59.9954 29.6686 177.6608 70 T 4.2026 7.7004 107.6109 61.7515 69.4889 176.2053 71 T 3.4435 7.8244 108.5739 62.6937 67.4916 170.8234 72 S 4.8742 8.9099 124.9186 57.8829 67.4913 173.9884 73 F 5.7351 9.3372 123.7266 57.2775 40.4106 172.4022 74 H 5.1739 8.5839 121.3989 54.4017 30.9278 173.7078 75 L 4.4619 8.1793 123.0442 53.2192 43.3987 175.6192 76 E 4.9125 8.9925 122.5450 54.7029 34.3438 174.0352 77 K 4.8997 7.1576 125.2793 53.3472 35.1073 175.7357 78 G 4.0171 8.5907 116.6954 48.8838 0.0000 173.4040 79 S 5.0340 9.4693 125.8325 59.3219 62.8608 168.0179 80 V 3.3816 7.3843 119.5516 61.5258 32.3285 174.5846 81 Q 4.8265 8.4986 122.8928 53.7429 32.1415 176.3027 82 V 3.7906 8.6749 125.2509 64.8801 31.3143 178.9288 83 S 4.1526 8.2882 115.3679 61.2315 61.9599 176.8729 84 D 5.1938 8.3913 117.7182 54.4747 41.0629 177.4117 85 S 3.6742 8.3293 111.0658 59.8901 63.1038 178.5850 86 A 3.5268 8.9081 130.6555 53.6145 18.3945 176.2291 87 V 4.7526 7.1481 110.6856 62.0381 35.5121 175.0840 88 Y 4.9765 10.3315 124.2029 56.1623 41.2860 174.6437 89 F 5.5146 9.5480 121.8877 56.0614 42.1742 173.4243 90 C 4.0615 8.6943 123.9384 55.1898 43.5509 171.9901 91 A 4.8771 8.3314 125.8107 50.9012 22.9764 174.6988 92 L 4.9378 7.8504 118.9272 54.4954 44.8069 175.0167 93 S 4.5824 8.6930 111.0735 58.5557 66.4758 176.7264 94 G 3.8613 8.7258 108.4360 45.6438 0.0000 173.5490 *98 G 4.2261 7.6153 107.4430 46.0048 0.0000 173.0954 99 D 4.0796 9.4633 122.1428 54.8481 40.2625 176.2337 100 S 4.0518 5.8100 118.6926 59.5096 64.0790 174.7305 101 S 4.5863 8.0746 122.7145 57.9969 65.1779 174.0222 102 Y 3.9337 8.3507 116.3326 59.3337 35.9797 169.4865 103 K 4.6249 7.8318 117.1444 55.6443 35.4405 174.8998 104 L 4.8644 8.2455 116.6955 53.4612 45.5908 176.2471 105 I 4.3475 8.2418 123.2980 60.1448 38.9543 174.8472 106 F 5.0712 8.6947 124.1894 55.5564 42.2097 175.4997 107 G 4.0169 9.0366 112.0911 45.8569 0.0000 175.0273 108 S 4.7683 8.8241 113.2552 57.4099 62.0145 167.7914 109 G 3.7426 8.0303 116.0336 46.3804 0.0000 173.5521 110 T 4.6768 9.2000 120.7016 61.6811 71.5256 173.2209 111 R 4.7596 8.0899 128.4432 55.4598 31.3836 175.8887 112 L 4.8382 8.5430 130.7349 53.9386 43.7706 174.1109 113 L 4.7274 8.3823 123.9711 52.6844 43.9550 173.8097 114 V 5.3333 8.1433 124.9307 58.8994 32.8036 176.0046 115 R 4.2731 8.5885 127.8716 55.7950 31.3407 175.3574 116 P 4.0667 0.0000 0.0000 63.1166 30.9767 174.4806 117 D 4.0327 9.0308 122.7080 53.1665 41.6341 178.9434 118 I 3.5346 6.9458 122.9276 61.3732 40.9280 171.0106 119 Q 4.4850 7.7064 122.9003 54.4925 36.6941 170.4979 120 N 4.8692 8.2086 116.9493 50.5654 38.3001 172.1442 121 P 4.3872 0.0000 0.0000 62.0931 31.9384 176.2940 122 D 5.3738 8.4221 131.1053 52.8219 40.5917 174.7614 123 P 5.2075 0.0000 0.0000 62.7299 32.8521 176.3512 *125 V 4.0800 8.0579 118.3328 62.2316 32.9997 170.9950 126 Y 5.1362 9.0126 126.1278 57.0707 42.3336 174.5404 127 Q 5.2125 8.8940 120.6272 56.1687 32.2412 170.2777 128 L 4.9903 9.1329 128.2569 52.8250 45.3404 172.9501 129 R 4.9759 8.4492 119.8796 56.2255 32.5670 176.6761 130 D 4.4731 8.9229 122.8436 54.2499 40.0596 177.4751 131 S 4.6352 8.5395 113.5097 60.4371 62.6332 173.8547 132 K 4.3184 7.7895 121.1119 56.7102 34.5010 181.9912 *136 K 4.2629 7.8793 120.1944 55.1895 33.0527 177.4744 137 S 4.7661 8.1935 112.2719 60.1109 64.4358 173.1615 138 V 4.6337 7.1307 115.3200 61.6434 36.2895 174.1586 139 C 5.8284 9.3104 125.2208 55.2826 37.4231 172.6806 140 L 4.9703 8.6677 126.6559 54.3698 43.9799 175.2885 141 F 5.3224 9.1037 128.7107 57.7112 42.1708 174.2662 142 T 4.5266 8.2569 118.7824 60.5751 73.5749 169.1763 143 D 4.6958 7.9361 116.1514 56.7081 38.0713 174.3325 144 F 5.1823 6.5357 113.6854 54.9224 41.2294 175.0184 145 D 4.4950 8.7522 120.6791 53.5306 40.1558 178.5365 146 S 4.0712 9.0683 122.4238 61.9520 62.9305 176.8064 147 Q 4.0998 8.2300 116.8037 57.5560 27.8918 179.4250 148 T 4.4800 8.4239 115.2884 64.3459 70.6699 177.1889 149 N 5.0320 8.5483 124.8849 51.2615 35.8000 179.2039 150 V 4.7110 10.0461 111.4574 60.9489 32.5931 171.6214 151 S 3.2748 8.9967 119.6395 60.6008 60.6862 170.7865 152 Q 3.6703 8.6309 117.4810 59.2820 26.2770 169.9886 153 S 4.8020 8.2740 113.5470 60.4809 65.1510 173.0348 *157 D 4.3682 8.4327 121.8191 53.7167 40.9391 174.6943 158 V 3.0627 8.4096 123.6125 63.9274 29.7529 173.0725 *159 Y 3.7491 7.7296 119.6847 56.8765 35.8593 178.9022 160 I 3.1335 7.1764 124.4350 58.4104 36.7322 170.7418 161 T 4.3547 7.7069 117.5624 61.4481 71.2159 173.6681 162 D 4.0999 8.7809 117.5501 56.4061 39.2187 174.5896 163 K 5.3045 8.2742 126.8422 55.3495 33.5443 174.0535 164 T 4.4299 7.8187 113.1770 64.5346 73.2241 172.4463 165 V 4.6757 8.3504 123.9972 62.3200 33.9016 175.8913 166 L 4.5113 9.0905 130.8905 54.5899 42.8998 172.3851 167 D 4.6915 8.2817 118.9291 53.1580 43.4280 175.9605 168 M 4.4435 8.3849 131.7038 57.7785 31.6019 179.0624 169 R 3.7480 7.8724 121.9853 59.3527 31.4087 178.0968 170 S 4.1348 8.2836 113.7944 61.4346 63.3226 175.1739 171 M 4.5311 9.0065 119.7153 53.9601 31.7132 178.7022 172 D 4.2953 7.7143 115.7523 55.7394 40.4102 172.8170 173 F 4.8037 7.7483 122.4362 57.5554 41.9437 174.7904 174 K 4.6619 6.7499 120.2296 54.7211 35.0977 171.7604 175 S 4.4655 8.7116 118.1793 57.8062 66.3396 173.3545 176 N 5.3640 8.1244 121.0745 51.7892 40.6895 173.0965 177 S 4.5036 8.6566 114.6196 58.3152 67.0306 172.7426 178 A 5.2480 8.8523 120.6215 51.8901 23.0733 175.3331 179 V 5.2813 8.2672 117.9026 61.9377 35.1842 173.9921 180 A 4.6744 9.4747 127.8814 50.0107 22.1739 175.1266 181 W 5.5994 7.9183 118.4015 54.9015 31.9914 173.9964 182 S 4.5872 8.2913 114.5683 59.1221 64.0477 175.9456 183 N 5.1689 9.0105 122.4179 52.1425 38.7385 176.0431 184 K 4.7052 7.7651 118.2162 54.7091 36.2167 180.8953 185 S 3.3440 8.7281 116.9449 59.8536 63.8430 171.2977 186 D 4.5004 8.7170 121.0805 54.3140 40.1038 172.5741 *187 F 4.5608 7.9041 118.8904 55.1276 41.7916 169.7399 188 A 4.4917 8.2003 124.0864 51.2686 21.4145 178.1341 189 C 3.9497 9.3677 117.8110 60.5253 40.4241 176.1267 190 A 3.9352 7.5704 121.1602 54.6665 18.0298 177.2353 191 N 4.3737 7.8185 111.8975 49.2223 39.2792 178.4704 192 A 3.4720 8.4902 121.8793 52.5208 18.7325 178.3918 193 F 4.1700 9.3346 123.2160 56.2453 39.3862 174.0954 194 N 5.1023 8.0842 125.5941 52.7532 41.3900 173.2927 195 N 3.9408 9.2284 113.8763 55.2184 35.0770 172.1694 196 S 3.7508 8.1912 123.6239 58.0524 64.1592 172.4764 197 I 3.8091 8.1552 129.2390 60.4174 37.8516 176.9640 198 I 4.1942 7.5900 112.5733 59.3981 39.3209 175.5976 199 P 4.3294 0.0000 0.0000 64.7896 32.1437 177.3298 200 E 4.6459 7.3535 116.6064 54.4870 29.0915 180.1592 201 D 4.9015 7.7420 122.7034 52.8854 44.0471 177.9209 202 T 4.0813 8.4882 119.1673 61.4266 68.9721 169.4160 *203 F 4.7517 8.2335 117.5720 57.6150 42.0399 171.0420 *204 F 4.6391 8.3672 119.6171 55.9923 37.6237 173.5247 205 P 4.5433 0.0000 0.0000 61.6796 30.4820 174.6202 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 0 G 8.35 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 1 D 8.91 4.53 0.00 3.24 2.61 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.77 4.98 0.00 3.90 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 3 V 8.40 4.80 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 0.76 0.00 0.00 0.89 0.00 0.00 4 T 9.02 4.93 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 5 Q 8.55 4.96 0.00 2.33 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.88 0.00 0.00 0.00 0.00 0.00 2.30 2.46 0.00 6 M 8.53 4.07 0.00 2.10 2.20 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.54 0.00 7 E 8.86 4.37 0.00 2.02 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 0.00 2.17 1.86 0.00 8 G 8.38 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 P 0.00 5.08 0.00 2.21 1.76 0.00 3.85 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.96 0.00 10 V 8.98 4.00 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 0.67 0.00 0.00 0.90 0.00 0.00 11 T 8.41 4.15 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 12 L 7.85 5.32 0.00 1.96 1.88 0.91 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.84 0.00 0.00 0.00 0.00 0.00 0.00 13 S 7.93 4.63 0.00 3.68 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 14 E 8.01 4.11 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 2.31 2.29 0.00 15 E 9.50 4.06 0.00 2.10 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.20 0.00 16 A 7.60 4.56 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 17 F 8.78 4.48 0.00 2.93 3.04 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 18 L 8.01 3.58 0.00 1.70 1.44 0.61 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 19 T 8.21 4.54 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 20 I 8.35 4.40 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 1.23 0.68 0.91 0.00 0.00 21 N 8.94 5.16 0.00 2.79 2.95 0.00 0.00 6.60 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 22 C 8.15 6.12 0.00 3.45 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 23 T 8.62 5.27 4.15 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 1.25 0.00 0.00 24 Y 7.22 5.21 0.00 2.96 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 25 T 9.11 4.73 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 26 A 8.73 4.85 1.08 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 0.00 0.00 27 T 8.23 4.30 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 1.22 0.00 0.00 28 G 7.61 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 29 Y 8.68 4.49 0.00 2.91 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 30 P 0.00 4.62 0.00 1.58 1.86 0.00 3.63 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.06 0.00 31 S 8.81 4.23 0.00 3.50 3.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 L 8.09 4.32 0.00 0.27 0.57 -0.76 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 33 F 8.77 5.26 0.00 2.40 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 34 W 9.16 5.13 0.00 3.30 3.13 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 35 Y 9.89 5.39 0.00 3.09 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 36 V 9.01 4.21 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 0.41 0.00 0.00 -0.81 0.00 0.00 37 Q 8.23 4.78 0.00 2.23 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.95 0.00 0.00 0.00 0.00 0.00 2.26 2.43 0.00 38 Y 8.11 4.58 0.00 2.97 2.78 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 39 P 0.00 4.25 0.00 2.09 2.09 0.00 3.97 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.21 0.00 40 G 9.00 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 41 E 8.12 4.87 0.00 2.15 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.24 0.00 42 G 8.17 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 43 L 8.16 4.59 0.00 1.21 1.36 0.22 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 44 Q 9.08 4.78 0.00 2.13 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.87 0.00 0.00 0.00 0.00 0.00 2.39 2.38 0.00 45 L 8.61 4.65 0.00 1.96 1.72 1.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 46 L 9.12 4.52 0.00 1.73 1.87 0.99 0.94 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 47 L 7.92 5.19 0.00 1.95 1.69 0.99 1.09 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 48 K 8.89 5.19 0.00 1.48 1.54 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.78 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.24 0.97 7.81 49 A 8.86 4.80 0.64 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 0.00 0.00 50 T 8.24 4.72 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 51 K 7.52 4.69 0.00 1.75 1.60 0.00 1.85 0.00 0.00 1.71 0.00 0.00 2.76 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.25 0.97 7.81 52 A 7.92 4.51 1.08 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 0.00 0.00 53 D 7.61 4.86 0.00 2.83 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 54 D 8.96 5.01 0.00 2.68 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 55 K 8.22 3.59 0.00 1.94 1.90 0.00 1.82 0.00 0.00 1.77 0.00 0.00 2.94 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.42 1.57 7.81 56 G 7.63 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 0.00 0.00 0.00 57 S 8.64 4.53 0.00 4.12 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 0.00 58 N 9.20 3.78 0.00 2.95 2.91 0.00 0.00 7.22 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 59 K 8.03 4.27 0.00 1.85 2.01 0.00 1.84 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.31 1.02 7.81 *61 G 7.31 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 62 F 8.75 4.90 0.00 3.02 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 E 8.76 4.97 0.00 1.99 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 0.00 2.27 2.30 0.00 64 A 8.15 5.15 0.28 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 65 T 8.45 5.11 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 66 Y 9.52 4.80 0.00 2.86 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 R 9.35 4.69 0.00 1.96 1.87 0.00 3.37 0.00 0.00 3.25 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.75 0.00 68 K 8.28 3.98 0.00 1.68 1.82 0.00 1.83 0.00 0.00 1.82 0.00 0.00 2.86 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.45 1.04 7.81 69 E 7.76 3.82 0.00 1.92 1.97 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 2.30 2.26 0.00 70 T 7.70 4.20 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 1.20 0.00 0.00 71 T 7.82 3.44 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 72 S 8.91 4.87 0.00 3.72 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 73 F 9.34 5.74 0.00 3.00 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 74 H 8.58 5.17 0.00 3.16 3.11 0.00 5.67 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 L 8.18 4.46 0.00 0.27 0.64 -0.01 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 76 E 8.99 4.91 0.00 1.66 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 1.92 1.85 0.00 77 K 7.16 4.90 0.00 0.85 1.15 0.00 0.61 0.00 0.00 0.86 0.00 0.00 2.46 0.00 0.00 2.66 0.00 0.00 0.00 0.00 0.96 0.87 7.81 78 G 8.59 4.02 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 S 9.47 5.03 0.00 3.72 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 V 7.38 3.38 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 0.74 0.00 0.00 0.92 0.00 0.00 81 Q 8.50 4.83 0.00 2.02 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.79 6.73 0.00 0.00 0.00 0.00 0.00 2.24 2.24 0.00 82 V 8.67 3.79 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 1.01 0.00 0.00 83 S 8.29 4.15 0.00 3.65 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 D 8.39 5.19 0.00 2.99 3.32 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 85 S 8.33 3.67 0.00 3.98 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 86 A 8.91 3.53 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 0.00 0.00 0.00 0.00 0.00 87 V 7.15 4.75 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 0.00 0.00 0.90 0.00 0.00 88 Y 10.33 4.98 0.00 3.04 3.09 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 89 F 9.55 5.51 0.00 3.30 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 90 C 8.69 4.06 0.00 1.23 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 0.00 0.00 0.00 0.00 91 A 8.33 4.88 0.74 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 92 L 7.85 4.94 0.00 1.31 1.10 0.71 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 93 S 8.69 4.58 0.00 3.98 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 94 G 8.73 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 *98 G 7.62 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 0.00 0.00 0.00 0.00 99 D 9.46 4.08 0.00 2.86 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 S 5.81 4.05 0.00 4.08 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 0.00 101 S 8.07 4.59 0.00 2.84 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 Y 8.35 3.93 0.00 3.18 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 0.00 103 K 7.83 4.62 0.00 1.86 1.82 0.00 1.58 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.51 1.40 7.81 104 L 8.25 4.86 0.00 1.20 1.09 0.69 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 105 I 8.24 4.35 1.73 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 1.12 1.40 0.89 0.00 0.00 106 F 8.69 5.07 0.00 2.81 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 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3.17 0.00 0.00 3.41 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.66 0.00 116 P 0.00 4.07 0.00 1.85 1.84 0.00 3.76 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.59 0.00 117 D 9.03 4.03 0.00 2.61 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 I 6.95 3.53 1.81 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 1.20 0.62 0.88 0.00 0.00 119 Q 7.71 4.48 0.00 2.05 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.92 7.12 0.00 0.00 0.00 0.00 0.00 2.13 1.89 0.00 120 N 8.21 4.87 0.00 2.76 2.84 0.00 0.00 6.85 8.02 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 0.00 121 P 0.00 4.39 0.00 2.21 2.12 0.00 3.98 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 2.01 1.99 0.00 122 D 8.42 5.37 0.00 2.92 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 0.00 123 P 0.00 5.21 0.00 2.41 2.40 0.00 4.08 0.00 0.00 5.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.11 0.00 *125 V 8.06 4.08 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 0.73 0.00 0.00 0.93 0.00 0.00 126 Y 9.01 5.14 0.00 2.87 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 Q 8.89 5.21 0.00 1.79 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.80 0.00 0.00 0.00 0.00 0.00 2.19 1.92 0.00 128 L 9.13 4.99 0.00 1.30 1.52 0.92 0.56 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 0.00 129 R 8.45 4.98 0.00 1.55 1.69 0.00 3.26 0.00 0.00 3.26 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.16 0.00 130 D 8.92 4.47 0.00 2.69 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 0.00 131 S 8.54 4.64 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 0.00 132 K 7.79 4.32 0.00 1.71 1.67 0.00 1.81 0.00 0.00 1.74 0.00 0.00 2.97 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.24 0.96 7.81 *136 K 7.88 4.26 0.00 1.79 1.69 0.00 1.72 0.00 0.00 1.74 0.00 0.00 2.83 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.01 7.81 137 S 8.19 4.77 0.00 3.33 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 V 7.13 4.63 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 1.05 0.00 0.00 139 C 9.31 5.83 0.00 3.39 3.26 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 0.00 140 L 8.67 4.97 0.00 1.95 1.77 1.15 0.88 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 0.00 141 F 9.10 5.32 0.00 1.87 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 0.00 142 T 8.26 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 0.00 143 D 7.94 4.70 0.00 3.04 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 0.00 144 F 6.54 5.18 0.00 2.97 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 145 D 8.75 4.50 0.00 2.62 2.61 0.00 0.00 0.00 0.00 0.00 0.00 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 S 9.07 4.07 0.00 3.87 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 0.00 147 Q 8.23 4.10 0.00 2.07 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 7.03 0.00 0.00 0.00 0.00 0.00 2.29 1.98 0.00 148 T 8.42 4.48 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 1.02 0.00 0.00 149 N 8.55 5.03 0.00 2.74 1.70 0.00 0.00 6.76 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 0.00 150 V 10.05 4.71 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 0.81 0.00 0.00 0.93 0.00 0.00 151 S 9.00 3.27 0.00 3.76 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 0.00 152 Q 8.63 3.67 0.00 2.24 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.86 6.96 0.00 0.00 0.00 0.00 0.00 2.16 1.91 0.00 153 S 8.27 4.80 0.00 3.63 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 *157 D 8.43 4.37 0.00 2.72 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 V 8.41 3.06 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 0.71 0.00 0.00 0.86 0.00 0.00 *159 Y 7.73 3.75 0.00 2.37 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 0.00 160 I 7.18 3.13 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 1.47 0.86 0.91 0.00 0.00 161 T 7.71 4.35 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 162 D 8.78 4.10 0.00 2.80 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 163 K 8.27 5.30 0.00 1.54 1.61 0.00 1.74 0.00 0.00 2.36 0.00 0.00 2.88 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.35 0.88 7.81 164 T 7.82 4.43 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 0.00 165 V 8.35 4.68 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 0.77 0.00 0.00 0.91 0.00 0.00 166 L 9.09 4.51 0.00 1.33 1.52 0.92 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 167 D 8.28 4.69 0.00 2.58 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 0.00 168 M 8.38 4.44 0.00 2.03 2.17 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.52 0.00 169 R 7.87 3.75 0.00 1.94 1.89 0.00 3.10 0.00 0.00 3.22 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.64 0.00 170 S 8.28 4.13 0.00 4.02 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 0.00 171 M 9.01 4.53 0.00 1.86 2.03 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.31 0.00 172 D 7.71 4.30 0.00 2.68 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 0.00 173 F 7.75 4.80 0.00 3.32 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 0.00 174 K 6.75 4.66 0.00 1.52 1.49 0.00 1.86 0.00 0.00 1.76 0.00 0.00 2.94 0.00 0.00 2.50 0.00 0.00 0.00 0.00 1.16 0.89 7.81 175 S 8.71 4.47 0.00 3.73 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 0.00 176 N 8.12 5.36 0.00 2.42 2.70 0.00 0.00 6.40 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 0.00 177 S 8.66 4.50 0.00 3.95 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 0.00 178 A 8.85 5.25 1.72 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 0.00 0.00 179 V 8.27 5.28 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 1.11 0.00 0.00 1.15 0.00 0.00 180 A 9.47 4.67 0.65 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 0.00 181 W 7.92 5.60 0.00 3.24 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 0.00 182 S 8.29 4.59 0.00 3.67 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 0.00 183 N 9.01 5.17 0.00 2.73 2.61 0.00 0.00 6.33 7.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 K 7.77 4.71 0.00 1.74 1.53 0.00 1.92 0.00 0.00 1.75 0.00 0.00 2.92 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.28 1.24 7.81 185 S 8.73 3.34 0.00 4.04 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 0.00 186 D 8.72 4.50 0.00 2.72 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *187 F 7.90 4.56 0.00 2.23 2.01 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 0.00 188 A 8.20 4.49 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 0.00 189 C 9.37 3.95 0.00 3.01 3.24 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 0.00 190 A 7.57 3.94 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 0.00 191 N 7.82 4.37 0.00 2.84 2.73 0.00 0.00 7.22 7.41 0.00 0.00 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 A 8.49 3.47 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 0.00 0.00 0.00 0.00 0.00 193 F 9.33 4.17 0.00 2.50 2.76 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 0.00 194 N 8.08 5.10 0.00 2.62 2.70 0.00 0.00 7.21 8.00 0.00 0.00 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 N 9.23 3.94 0.00 2.80 2.82 0.00 0.00 6.78 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 0.00 196 S 8.19 3.75 0.00 4.00 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 0.00 197 I 8.16 3.81 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 0.39 0.91 0.00 0.00 198 I 7.59 4.19 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 1.47 0.30 0.91 0.00 0.00 199 P 0.00 4.33 0.00 2.17 2.19 0.00 3.70 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 200 E 7.35 4.65 0.00 2.15 1.78 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 2.16 2.11 0.00 201 D 7.74 4.90 0.00 2.58 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 0.00 202 T 8.49 4.08 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 *203 F 8.23 4.75 0.00 2.22 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *204 F 8.37 4.64 0.00 2.27 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 0.00 0.00 0.00 0.00 205 P 0.00 4.54 0.00 2.08 1.85 0.00 3.74 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 1.94 1.59 0.00 * Residues marked with a * may have inaccurate shift predictions.