NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 K 4.2855 8.3031 119.9990 56.5417 34.1132 175.7485 5 G 3.6802 8.0888 105.8957 47.1343 0.0000 168.7217 6 V 4.8040 9.9284 116.8091 59.3042 36.3951 172.5956 7 E 5.1837 8.9635 120.7672 54.7490 32.3825 175.6190 8 V 4.9276 9.1633 124.6314 61.2004 34.6832 173.9838 9 I 4.8327 8.9774 129.0943 59.6256 39.5721 174.5952 10 I 4.7571 8.5747 128.4088 59.9572 38.7184 175.3095 11 A 4.8158 9.1968 129.2112 50.3603 21.0868 174.5857 12 L 4.7208 8.9160 125.1307 53.7870 44.1677 175.1736 13 D 3.3700 8.4717 127.4555 53.6840 41.5466 175.6676 14 I 4.5262 8.1586 120.1310 60.4838 37.5474 175.9585 15 S 4.5201 8.5344 118.1292 58.4543 63.5310 174.6941 16 N 4.5490 8.6860 119.0643 56.5532 38.8758 177.6130 17 S 4.3401 7.3431 114.3187 57.9404 61.4737 175.5005 *19 L 4.2343 7.7240 118.1802 54.7731 43.9766 177.8617 20 A 4.2135 7.6610 122.5845 52.8284 18.7498 177.7538 21 Q 4.9067 8.3970 118.8043 55.6938 29.5680 176.5380 22 D 4.6535 8.2397 117.0983 54.0244 39.9854 176.2672 23 V 4.5021 7.3571 119.4516 59.9181 34.3977 174.3999 24 Q 4.5011 8.7392 121.3760 54.4631 29.7310 174.7798 25 P 4.4130 0.0000 0.0000 65.0162 31.9365 176.5705 26 S 4.8095 7.4273 112.8806 56.6315 66.8695 175.3812 27 R 3.8770 8.5642 121.0518 59.3744 29.7180 179.3087 28 L 3.9051 7.7611 119.4945 58.1722 42.2640 178.4556 29 E 3.9366 8.3694 119.4377 58.8869 29.4931 178.5615 30 K 3.8873 8.3169 119.7873 59.4183 32.2066 178.5155 31 A 3.9671 8.0184 120.9609 55.2001 18.1976 179.7789 32 K 3.9040 8.1723 116.8843 59.7227 32.1315 179.8585 33 R 3.8984 8.0888 118.3471 59.0143 29.8444 178.9065 34 L 3.9395 8.1340 120.3181 58.1841 42.0278 179.1081 35 I 3.6583 7.9418 119.9172 64.3622 37.1368 178.1993 36 S 4.0646 8.2841 114.1883 61.6898 61.9494 176.5797 37 R 3.9667 7.6339 119.0761 58.6940 30.1328 178.3193 38 L 4.0313 8.1505 120.7167 58.2895 42.0791 179.2888 39 V 3.3238 7.9905 118.3429 66.0180 31.1930 177.6496 40 D 4.3670 7.7571 117.3314 56.9033 40.6936 177.7993 41 E 4.2433 7.6247 116.8267 56.1755 30.1955 176.8444 42 L 4.2166 6.8341 119.4279 54.4976 41.7772 174.2587 43 D 4.8219 8.4997 117.6930 54.2374 44.0970 174.9735 44 N 4.8692 8.1895 117.1132 53.9618 39.8810 174.4740 45 D 5.2530 8.0884 115.5814 52.2002 43.8738 175.7534 46 K 5.1783 8.9870 119.1953 54.7782 35.4901 176.0038 47 V 4.9508 9.1181 122.5838 60.3528 34.8888 174.9215 48 G 4.1288 8.7033 110.3206 45.9815 0.0000 170.7596 *50 I 4.3372 8.2514 119.4631 61.3473 39.0473 175.2946 51 V 4.9005 7.9367 118.9602 59.6727 34.6132 174.8139 52 F 5.4202 8.5252 117.2557 56.5892 41.9106 173.8815 53 A 4.8111 9.8662 121.6996 52.6809 20.7722 179.0004 54 G 3.9312 6.6043 109.5408 48.1371 0.0000 173.7574 55 D 5.5346 8.3013 118.3658 52.2812 45.3866 174.5618 56 A 5.5151 8.6089 120.5211 50.4294 21.9162 175.4341 57 F 5.0938 8.8092 115.0171 55.3505 42.2662 173.8414 58 T 4.3464 8.7978 116.9183 63.8461 68.1136 174.3655 59 Q 4.3563 8.8177 128.0533 57.5050 29.9874 175.2576 60 L 4.6225 7.5325 119.7100 52.4608 44.9962 174.1154 61 P 4.5159 0.0000 0.0000 61.9956 32.2985 176.2664 62 I 3.7566 8.1580 122.9630 62.3344 38.2738 174.7687 63 T 4.7288 8.9117 122.7155 61.1215 70.9985 173.9300 64 S 4.4853 8.5868 119.6648 58.5036 63.8674 174.9317 65 D 4.3782 7.7407 122.3135 53.8632 40.0973 175.6934 66 Y 4.4871 7.7377 124.5631 60.3556 37.9689 177.4616 67 I 3.7687 7.7840 119.8727 64.7523 37.3920 178.1414 68 S 4.3879 8.2175 114.1547 61.2984 63.0192 176.1696 69 A 4.1906 8.0801 123.6428 55.0977 17.9951 181.1445 70 K 4.2260 8.0451 115.0705 57.0369 32.0031 179.1622 *72 F 4.4605 8.1071 120.4893 57.4978 41.2838 177.4004 73 L 3.9736 7.9946 122.0702 58.0292 42.0421 178.6150 74 E 3.9801 7.8473 118.5440 59.0547 29.5497 177.6292 75 S 4.3360 7.4469 110.6445 59.0426 63.5660 174.3448 76 I 3.8834 7.5449 124.1171 61.3947 37.3569 175.3666 77 S 4.6410 8.2228 118.1148 56.3281 65.8744 173.3284 78 P 4.6210 0.0000 0.0000 64.9479 31.1363 178.9313 79 S 4.3242 7.4201 111.7361 60.2547 63.0270 175.4257 80 L 4.1782 7.9142 121.2298 57.0825 41.5338 177.3942 81 I 4.6722 7.7143 118.8428 59.4628 39.8779 175.3450 82 S 4.3021 8.8582 120.6558 60.3353 63.8997 174.9624 83 K 3.9405 8.0103 123.0196 56.4772 32.1199 175.9269 84 Q 4.6086 9.2903 125.1764 54.6238 30.1280 175.7761 85 G 4.2722 7.3996 106.1956 44.7744 0.0000 173.3987 86 T 4.7753 7.7132 113.1629 61.4711 69.5924 175.7870 87 A 4.4503 9.1469 131.6797 50.9914 15.7086 177.8040 88 I 2.8119 7.2404 127.5574 63.2264 37.7220 178.5712 89 G 3.5741 7.8650 106.0027 47.9929 0.0000 175.1684 90 E 3.9284 8.1911 120.9303 59.0014 29.3894 179.3849 91 A 3.8914 7.5845 120.1351 55.1466 18.4329 179.7384 92 I 3.6374 7.7861 118.5745 64.6170 37.0257 178.4821 93 N 4.3613 8.4568 117.6811 56.1580 38.1357 177.2463 94 L 3.9464 8.0197 120.8159 57.9987 42.4200 178.4512 95 A 4.0013 8.3649 121.4043 55.4605 18.1124 179.6893 96 T 4.1825 7.9130 106.9565 65.1024 68.8239 176.1857 97 R 4.2271 7.7311 118.4946 57.3280 30.3269 177.0687 98 S 4.5803 7.7937 113.8575 58.1536 63.8418 174.4239 99 F 4.5202 7.8882 119.3334 56.5513 39.6472 175.3663 100 T 4.1961 8.4570 113.2850 60.9256 69.0868 173.1752 101 P 4.2967 0.0000 0.0000 65.2406 31.6813 176.5741 102 Q 3.8179 7.2682 120.3311 56.5565 29.0355 176.2150 103 E 4.1518 8.6028 125.8362 56.7570 30.5687 176.1749 104 G 3.9029 8.9798 110.9599 45.2346 0.0000 172.9929 105 V 4.3251 7.3385 118.4030 60.1034 33.7834 175.4715 106 G 3.8012 8.5304 114.4601 46.5900 0.0000 172.4003 107 R 5.3044 8.4140 121.9456 54.2594 34.5397 173.9326 108 A 5.1949 9.2702 124.4010 50.2151 22.9951 174.6199 109 I 4.9445 8.7173 121.5507 59.6236 40.2710 174.8409 110 I 4.8114 8.8786 128.2059 59.5718 39.6048 174.6627 111 V 4.5800 8.8781 128.9967 62.0044 33.0951 174.7178 112 I 5.0274 8.6297 128.9174 60.2687 39.6260 174.5154 113 T 4.8492 8.6306 120.7715 61.2725 71.3952 173.2533 114 D 4.7333 8.3819 122.8570 51.6301 40.8056 177.2727 115 G 4.0742 8.2487 107.1636 46.5060 0.0000 172.9227 116 E 4.3016 8.3026 120.2955 56.0201 30.4429 176.1085 117 N 4.1423 8.7806 122.6741 54.3988 36.3627 173.9382 118 H 4.4534 7.5350 114.0092 56.1961 30.4760 174.8238 119 E 4.0826 8.4021 125.1493 56.2502 29.9155 176.5091 120 G 4.0677 7.7739 106.7865 45.1956 0.0000 173.1806 121 G 4.0508 9.4721 110.6101 46.1811 0.0000 176.2699 122 A 3.9019 8.6274 121.6426 55.1556 18.2963 179.7622 123 V 3.5179 7.7097 116.2104 66.0427 31.6209 177.9309 124 E 3.9271 8.1549 117.6742 59.3710 29.4219 178.9083 125 A 3.9546 8.3791 120.9388 55.2434 18.3773 179.6071 126 A 3.9570 8.2682 119.4116 54.9362 18.4486 179.7830 127 K 3.9860 8.2727 118.0593 59.7493 32.1164 178.8988 128 A 4.0052 8.0664 119.6575 55.0095 18.5407 179.1861 129 A 4.0608 8.1977 119.0896 55.3343 18.5181 179.6320 130 A 4.4208 8.0651 120.6968 54.8646 18.2293 179.4482 131 E 4.1353 8.1976 115.2354 58.1171 29.5749 178.3898 132 K 4.4690 7.7265 117.5578 55.5799 32.4038 177.0069 133 G 3.8277 7.7859 106.9651 45.7152 0.0000 173.3153 134 I 4.3361 7.3158 120.5648 59.6914 39.2937 174.5217 135 Q 4.8107 8.7949 126.5488 54.7213 30.4644 174.7805 136 V 4.6717 8.8827 125.3824 61.7764 33.0215 174.9302 137 S 5.1411 9.1195 124.4577 56.8976 66.3922 173.4119 138 V 4.9259 8.7305 121.1730 61.3280 34.9360 174.0432 139 L 4.8431 9.2306 128.6017 53.1078 43.7088 175.6305 140 G 4.3963 9.0172 113.2617 45.0601 0.0000 172.1201 141 V 4.6369 8.5713 126.3106 61.4785 34.2373 173.3684 142 G 4.1527 9.0502 112.3519 44.3589 0.0000 173.8434 *144 P 4.7773 0.0000 0.0000 62.3328 32.9649 177.1748 145 E 4.0454 8.1104 115.4999 57.2120 29.7964 177.6822 146 G 3.9999 9.1957 105.1592 45.4295 0.0000 172.5386 147 A 4.8357 8.6412 121.8502 49.3936 23.1013 174.2531 148 P 5.2543 0.0000 0.0000 61.8821 33.4993 175.5915 149 I 4.6012 8.2569 120.1479 58.6978 39.0131 173.8678 150 P 4.2881 0.0000 0.0000 62.6074 32.5719 175.7977 151 V 4.1801 8.0210 121.7316 60.8606 33.1635 174.7897 152 E 3.9080 8.8403 128.2080 58.1775 29.7222 176.9576 153 G 4.0010 8.9994 114.1214 45.3193 0.0000 172.7438 154 T 4.5101 7.2421 108.3038 60.2589 71.1112 173.7572 155 N 4.6468 8.4557 115.5578 53.1124 38.8833 174.3504 156 D 4.8702 7.8926 120.3179 53.3127 43.7406 174.3563 157 Y 5.1213 8.1724 116.2805 55.6490 42.0987 176.0520 158 R 4.1537 9.1387 121.5044 56.8535 31.2553 176.0849 159 R 5.2445 8.4143 121.1016 54.2563 34.1008 175.3626 160 D 4.7020 8.9865 122.3806 52.4643 40.9362 177.2334 161 R 3.9123 8.6300 117.3953 59.7283 29.8555 177.9997 162 E 4.1167 8.1598 113.7589 57.0426 29.7540 177.3670 163 G 3.9964 8.3246 107.7614 44.8744 0.0000 173.1982 164 N 4.7211 8.8886 118.2494 51.9292 40.1927 174.9194 165 V 4.0405 8.4540 122.7976 63.7304 32.2965 175.4390 166 I 4.0626 8.7782 129.4052 61.1317 38.3051 174.9572 167 V 4.7697 8.4116 126.5563 61.2968 33.6563 174.2456 168 T 4.8693 9.0697 122.9766 60.3897 69.7092 172.9622 169 R 4.9663 8.8272 127.0228 53.8569 33.2899 175.4698 170 L 4.1727 8.5090 124.6092 55.4003 43.4382 175.5620 171 N 4.9500 9.0530 126.2350 51.6547 38.2860 173.7428 172 E 3.8766 8.5912 126.7033 58.8520 30.2959 179.5490 173 G 3.7708 7.6296 102.9656 46.8965 0.0000 174.5567 *175 C 4.4640 8.1361 119.3426 59.6289 30.2457 176.3456 176 Q 3.8414 7.8921 118.6803 58.7897 28.1357 178.5848 177 E 3.9271 8.0580 119.6349 59.3781 29.5214 179.4508 178 I 3.6589 7.6855 119.0270 64.4307 37.3021 178.2530 179 A 4.2355 7.9978 121.5829 54.8552 18.1861 179.4575 180 K 3.8510 8.2450 118.2688 60.0687 32.1531 178.9225 181 D 4.5524 8.0439 117.5953 56.7077 41.0695 178.1494 182 G 3.8002 8.2527 104.7470 44.1950 0.0000 174.2934 183 K 4.1006 7.8824 119.0352 57.3913 30.5927 175.8906 184 G 4.7761 8.1849 107.9675 44.4539 0.0000 173.2275 185 I 4.8104 8.6036 114.5383 59.2559 41.1115 174.1279 186 Y 5.3308 8.5512 124.3763 55.9639 40.7992 175.1362 187 V 4.0262 7.5341 124.7987 59.7089 35.2596 174.1492 188 R 4.4677 8.0987 123.8798 55.8409 31.0164 175.4729 189 V 4.0803 8.8898 127.7430 62.2345 32.2306 174.7812 190 D 5.1916 8.2349 128.6598 52.3159 41.4509 175.0188 191 N 4.4510 8.7646 114.4929 55.6509 38.9394 175.2544 192 S 4.4967 7.8665 113.2866 57.4333 64.6528 173.5030 193 N 4.7535 8.4738 115.5926 53.0247 37.6428 176.8620 194 S 4.0460 8.0649 116.1745 61.9679 62.8477 176.3767 195 A 3.8929 7.8577 124.0895 54.6851 18.1426 179.1408 196 Q 3.8763 7.9765 117.5819 59.3839 29.1971 178.6078 197 K 3.9525 8.1132 119.2957 59.0885 32.0901 179.2080 198 A 3.9580 8.0681 121.1922 55.2661 18.2493 179.6023 199 I 3.6572 7.8650 117.1174 64.3351 38.0116 178.2775 200 S 4.0813 8.3182 116.2360 61.4069 62.4715 176.5298 201 Q 3.9050 8.1786 122.4823 59.0494 28.6023 177.8078 202 E 3.8976 7.9663 119.1360 59.3097 29.7586 178.4888 203 I 3.8507 7.7599 118.8163 64.6372 37.3766 178.1955 204 S 4.3224 8.2512 116.0529 61.3421 62.4493 177.2044 205 K 4.1848 8.1708 119.3380 57.1057 31.5079 178.1456 *207 A 4.2494 7.9593 122.1622 51.3584 20.2822 178.7737 208 K 4.2402 7.8221 113.6361 57.3662 32.7987 177.1138 209 S 4.3805 7.6419 118.3858 58.2251 63.1124 173.8497 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 4 K 8.30 4.29 0.00 2.10 1.97 0.00 1.55 0.00 0.00 1.85 0.00 0.00 2.95 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.31 1.46 7.81 5 G 8.09 3.68 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 0.00 0.00 0.00 6 V 9.93 4.80 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 1.02 0.00 0.00 7 E 8.96 5.18 0.00 2.13 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 0.00 2.32 2.30 0.00 8 V 9.16 4.93 2.11 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 1.10 0.00 0.00 0.97 0.00 0.00 9 I 8.98 4.83 1.63 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.20 0.76 0.00 0.00 10 I 8.57 4.76 1.87 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 1.16 0.53 0.92 0.00 0.00 11 A 9.20 4.82 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 L 8.92 4.72 0.00 1.69 1.46 0.85 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 13 D 8.47 3.37 0.00 2.46 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 14 I 8.16 4.53 1.78 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.88 0.81 0.00 0.00 15 S 8.53 4.52 0.00 4.12 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 16 N 8.69 4.55 0.00 2.77 2.95 0.00 0.00 6.99 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 17 S 7.34 4.34 0.00 4.10 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *19 L 7.72 4.23 0.00 1.80 1.80 0.91 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 20 A 7.66 4.21 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 21 Q 8.40 4.91 0.00 2.06 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.97 0.00 0.00 0.00 0.00 0.00 2.39 2.48 0.00 22 D 8.24 4.65 0.00 2.79 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 23 V 7.36 4.50 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 0.90 0.00 0.00 0.97 0.00 0.00 24 Q 8.74 4.50 0.00 2.15 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 7.06 0.00 0.00 0.00 0.00 0.00 2.35 2.46 0.00 25 P 0.00 4.41 0.00 2.03 2.10 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 2.02 2.06 0.00 26 S 7.43 4.81 0.00 4.11 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 27 R 8.56 3.88 0.00 1.88 2.01 0.00 3.31 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.88 0.00 28 L 7.76 3.91 0.00 1.71 1.63 0.86 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 29 E 8.37 3.94 0.00 2.11 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 2.29 2.35 0.00 30 K 8.32 3.89 0.00 2.11 2.03 0.00 1.57 0.00 0.00 1.78 0.00 0.00 3.23 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.43 1.49 7.81 31 A 8.02 3.97 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 32 K 8.17 3.90 0.00 1.96 1.86 0.00 1.65 0.00 0.00 1.74 0.00 0.00 2.94 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.45 1.55 7.81 33 R 8.09 3.90 0.00 1.98 1.97 0.00 3.12 0.00 0.00 3.09 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.82 0.00 34 L 8.13 3.94 0.00 1.78 1.83 0.89 0.84 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 35 I 7.94 3.66 1.99 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 1.39 0.66 0.90 0.00 0.00 36 S 8.28 4.06 0.00 3.87 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 37 R 7.63 3.97 0.00 1.92 1.95 0.00 3.33 0.00 0.00 3.13 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 38 L 8.15 4.03 0.00 1.78 1.85 0.90 0.95 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 39 V 7.99 3.32 2.11 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 2.32 2.40 0.00 75 S 7.45 4.34 0.00 4.08 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 76 I 7.54 3.88 1.97 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 1.34 0.78 0.86 0.00 0.00 77 S 8.22 4.64 0.00 3.94 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 78 P 0.00 4.62 0.00 2.19 2.22 0.00 3.86 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.00 0.00 79 S 7.42 4.32 0.00 3.92 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 80 L 7.91 4.18 0.00 1.85 2.15 1.01 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 81 I 7.71 4.67 1.94 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.89 1.05 0.00 0.00 82 S 8.86 4.30 0.00 3.99 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 83 K 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 T 8.46 4.20 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 101 P 0.00 4.30 0.00 2.21 2.25 0.00 3.83 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.97 0.00 102 Q 7.27 3.82 0.00 2.22 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.96 0.00 0.00 0.00 0.00 0.00 2.39 2.34 0.00 103 E 8.60 4.15 0.00 1.96 1.82 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 2.26 2.23 0.00 104 G 8.98 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 V 7.34 4.33 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 0.86 0.00 0.00 0.97 0.00 0.00 106 G 8.53 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 R 8.41 5.30 0.00 1.21 0.67 0.00 2.70 0.00 0.00 2.26 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.63 0.00 108 A 9.27 5.19 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 0.00 109 I 8.72 4.94 1.96 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.11 0.96 0.00 0.00 110 I 8.88 4.81 1.90 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 1.13 0.70 0.92 0.00 0.00 111 V 8.88 4.58 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 1.11 0.00 0.00 0.94 0.00 0.00 112 I 8.63 5.03 1.88 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 1.13 0.58 0.91 0.00 0.00 113 T 8.63 4.85 4.51 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 1.34 0.00 0.00 114 D 8.38 4.73 0.00 2.86 3.02 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 0.00 115 G 8.25 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 E 8.30 4.30 0.00 2.24 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.29 0.00 117 N 8.78 4.14 0.00 2.92 2.89 0.00 0.00 7.02 8.16 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 0.00 118 H 7.53 4.45 0.00 3.10 3.24 0.00 5.94 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 E 8.40 4.08 0.00 1.92 1.93 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 2.28 2.23 0.00 120 G 7.77 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 G 9.47 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 0.00 122 A 8.63 3.90 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 0.00 123 V 7.71 3.52 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 1.08 0.00 0.00 0.93 0.00 0.00 124 E 8.15 3.93 0.00 2.24 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.44 0.00 125 A 8.38 3.95 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 0.00 126 A 8.27 3.96 1.41 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 0.00 0.00 0.00 0.00 0.00 0.00 127 K 8.27 3.99 0.00 1.90 1.98 0.00 1.64 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.45 7.81 128 A 8.07 4.01 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 A 8.20 4.06 1.41 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 0.00 0.00 0.00 0.00 0.00 0.00 130 A 8.07 4.42 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 E 8.20 4.14 0.00 2.09 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 2.51 2.48 0.00 132 K 7.73 4.47 0.00 1.88 1.78 0.00 1.97 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.39 1.42 7.81 133 G 7.79 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 0.00 0.00 0.00 134 I 7.32 4.34 1.93 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 0.92 0.81 0.00 0.00 135 Q 8.79 4.81 0.00 1.99 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.79 0.00 0.00 0.00 0.00 0.00 2.30 2.26 0.00 136 V 8.88 4.67 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.95 0.00 0.00 137 S 9.12 5.14 0.00 3.79 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 0.00 138 V 8.73 4.93 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 1.19 0.00 0.00 1.06 0.00 0.00 139 L 9.23 4.84 0.00 1.63 1.54 0.88 0.56 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 0.00 140 G 9.02 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 V 8.57 4.64 2.09 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 0.94 0.00 0.00 0.99 0.00 0.00 142 G 9.05 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 0.00 0.00 0.00 0.00 *144 P 0.00 4.78 0.00 2.09 2.18 0.00 3.75 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.11 0.00 145 E 8.11 4.05 0.00 1.94 2.00 0.00 0.00 0.00 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 2.37 0.00 146 G 9.20 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 0.00 147 A 8.64 4.84 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 0.00 148 P 0.00 5.25 0.00 1.86 1.85 0.00 3.30 0.00 0.00 4.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.51 0.00 149 I 8.26 4.60 1.94 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.80 1.00 0.00 0.00 150 P 0.00 4.29 0.00 1.91 1.86 0.00 3.94 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.00 0.00 151 V 8.02 4.18 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 0.87 0.00 0.00 0.88 0.00 0.00 152 E 8.84 3.91 0.00 1.91 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.38 0.00 153 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 0.00 154 T 7.24 4.51 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 1.22 0.00 0.00 155 N 8.46 4.65 0.00 2.69 2.84 0.00 0.00 6.71 8.06 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 0.00 156 D 7.89 4.87 0.00 2.68 2.49 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 0.00 157 Y 8.17 5.12 0.00 2.86 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 0.00 158 R 9.14 4.15 0.00 1.78 1.88 0.00 3.07 0.00 0.00 3.19 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.83 0.00 159 R 8.41 5.24 0.00 1.66 1.81 0.00 3.23 0.00 0.00 3.44 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.83 0.00 160 D 8.99 4.70 0.00 2.87 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 0.00 161 R 8.63 3.91 0.00 1.81 2.06 0.00 3.26 0.00 0.00 3.23 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.74 0.00 162 E 8.16 4.12 0.00 2.05 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.31 0.00 163 G 8.32 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 0.00 164 N 8.89 4.72 0.00 2.90 2.74 0.00 0.00 6.60 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 V 8.45 4.04 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 0.93 0.00 0.00 166 I 8.78 4.06 1.90 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 1.13 0.94 0.93 0.00 0.00 167 V 8.41 4.77 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.90 0.00 0.00 168 T 9.07 4.87 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 1.28 0.00 0.00 169 R 8.83 4.97 0.00 1.70 1.91 0.00 3.22 0.00 0.00 3.26 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.53 0.00 170 L 8.51 4.17 0.00 1.95 1.66 1.04 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 171 N 9.05 4.95 0.00 2.67 2.89 0.00 0.00 7.17 7.60 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 0.00 172 E 8.59 3.88 0.00 2.02 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.02 0.00 173 G 7.63 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *175 C 8.14 4.46 0.00 2.83 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 0.00 176 Q 7.89 3.84 0.00 2.01 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.81 0.00 0.00 0.00 0.00 0.00 2.03 1.41 0.00 177 E 8.06 3.93 0.00 2.00 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 2.30 2.51 0.00 178 I 7.69 3.66 2.01 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.90 0.90 0.00 0.00 179 A 8.00 4.24 1.47 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 0.00 0.00 0.00 0.00 0.00 0.00 180 K 8.25 3.85 0.00 1.92 1.81 0.00 1.64 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.49 7.81 181 D 8.04 4.55 0.00 2.76 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 182 G 8.25 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 183 K 7.88 4.10 0.00 1.94 1.92 0.00 1.67 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.36 1.51 7.81 184 G 8.18 4.78 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 0.00 0.00 0.00 185 I 8.60 4.81 1.88 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 1.11 0.68 0.97 0.00 0.00 186 Y 8.55 5.33 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 0.00 187 V 7.53 4.03 1.90 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 0.63 0.00 0.00 0.79 0.00 0.00 188 R 8.10 4.47 0.00 2.02 1.83 0.00 3.46 0.00 0.00 3.18 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.71 0.00 189 V 8.89 4.08 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 0.80 0.00 0.00 0.89 0.00 0.00 190 D 8.23 5.19 0.00 2.75 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 191 N 8.76 4.45 0.00 2.73 2.91 0.00 0.00 6.79 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 0.00 192 S 7.87 4.50 0.00 3.99 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 0.00 193 N 8.47 4.75 0.00 2.95 3.06 0.00 0.00 5.70 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 0.00 194 S 8.06 4.05 0.00 4.07 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 0.00 195 A 7.86 3.89 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 0.00 196 Q 7.98 3.88 0.00 2.07 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.87 0.00 0.00 0.00 0.00 0.00 2.40 2.37 0.00 197 K 8.11 3.95 0.00 1.84 1.82 0.00 1.71 0.00 0.00 1.64 0.00 0.00 3.15 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.44 1.54 7.81 198 A 8.07 3.96 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 199 I 7.87 3.66 1.84 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 1.51 1.46 0.98 0.00 0.00 200 S 8.32 4.08 0.00 3.94 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 0.00 201 Q 8.18 3.90 0.00 2.23 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.81 0.00 0.00 0.00 0.00 0.00 2.34 2.40 0.00 202 E 7.97 3.90 0.00 1.99 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.40 0.00 203 I 7.76 3.85 1.99 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 1.53 0.75 0.91 0.00 0.00 204 S 8.25 4.32 0.00 4.00 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 0.00 205 K 8.17 4.18 0.00 1.91 1.95 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.45 7.81 *207 A 7.96 4.25 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 208 K 7.82 4.24 0.00 1.71 1.87 0.00 1.80 0.00 0.00 1.75 0.00 0.00 2.99 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.44 1.42 7.81 209 S 7.64 4.38 0.00 3.92 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 * Residues marked with a * may have inaccurate shift predictions.