NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -2 S 4.3254 8.3349 115.2895 58.3589 64.2436 175.4323 -1 N 3.7158 8.8270 114.3898 53.7369 35.9014 171.8483 0 A 3.3906 8.1423 125.1661 51.9346 16.9203 176.7607 0 K 3.3906 8.1923 121.7661 55.6346 30.9203 175.5607 3 L 4.6022 8.4186 123.7065 54.6155 42.6874 175.8595 4 T 4.7905 7.4591 108.5660 58.6701 71.1557 172.4390 5 P 4.4132 0.0000 0.0000 62.9125 32.2271 176.6947 6 N 4.6172 8.0871 120.0206 52.3569 37.3927 173.4512 7 Y 4.5272 7.5612 118.9502 57.2569 39.2456 175.2750 8 Y 3.9668 9.3855 125.6488 58.7008 39.3001 175.9406 9 R 3.5711 8.7771 126.1106 57.3644 27.8886 175.8579 10 D 4.4441 8.3181 111.6351 55.4184 38.8606 174.4975 11 R 4.5258 8.2811 117.5346 56.1118 33.3404 175.9060 12 V 5.0613 7.8023 117.4765 61.2058 35.3808 173.5116 13 C 5.1751 9.0993 127.0962 57.4855 34.7832 173.3814 14 L 4.6344 8.7268 125.8275 54.7729 43.1474 175.4810 15 N 5.4133 8.8362 119.1701 52.2151 41.9748 173.6672 16 V 5.1774 8.7556 118.1378 59.9365 36.8056 174.3753 17 L 4.9004 8.6745 121.4073 54.0308 43.0715 176.0150 18 A 4.8368 8.2822 123.6402 50.6642 20.3367 177.6189 19 G 3.7931 9.6113 109.7838 45.1899 0.0000 173.8798 20 S 4.6596 7.3679 113.5941 56.4933 66.4436 176.6579 21 K 3.6423 8.1505 121.3638 59.6447 31.7043 179.3349 22 D 4.3709 8.0092 118.6836 57.2800 40.6680 178.2434 23 N 4.3028 8.4040 117.5043 56.4881 38.9213 176.6150 24 A 4.0723 8.3631 122.4880 55.3537 18.4458 179.4497 25 R 3.8696 8.1156 116.7718 59.6846 30.0858 178.5710 26 A 4.0127 8.0741 120.4448 55.1329 18.2928 179.6746 27 I 3.6487 8.1586 118.6817 64.7625 37.1632 178.0239 28 Y 4.1011 8.3171 120.5018 60.6056 38.5386 177.8355 29 Q 3.8213 8.4564 120.3775 59.3139 29.0239 178.3009 30 A 3.9445 7.9869 120.0798 54.7403 18.7261 178.5887 31 A 4.1134 8.2511 117.4677 51.6752 18.6079 177.3357 32 E 3.6501 8.8514 116.0447 57.2425 27.5635 176.2681 33 G 3.0641 7.6679 106.3466 45.9162 0.0000 174.6859 34 H 5.1752 7.8536 119.2079 53.3783 27.7524 174.7034 35 V 5.0079 7.0812 117.0313 60.5739 34.9719 175.0235 36 L 4.8702 8.9921 122.9481 53.0881 44.4377 175.4701 37 V 4.6117 8.7590 124.9114 61.2672 33.2533 175.0046 38 G 4.0340 9.2622 116.9597 45.9608 0.0000 172.2828 39 V 4.6220 8.4859 124.3668 60.8717 35.2432 173.9430 40 L 5.1104 8.3072 126.9620 52.9188 43.4958 177.7350 41 S 4.2782 9.2405 119.0951 61.3473 63.0238 176.5981 42 K 4.2351 7.2564 117.1362 58.2391 31.9618 176.9205 43 N 4.5347 7.8208 113.9321 53.7694 38.4411 174.2966 44 Y 4.7904 7.5043 115.3531 55.4308 41.6631 173.9480 45 P 4.4673 0.0000 0.0000 65.0488 32.2601 175.8342 46 D 4.7204 7.8759 117.8883 50.7730 43.7618 176.1920 47 V 3.5183 8.3172 118.0573 66.3804 31.3263 177.3525 48 D 4.3609 8.0873 118.2132 57.3897 40.6767 178.9100 49 S 4.0747 8.9538 114.9084 61.2988 62.8665 176.2528 50 A 2.5800 7.5056 123.4143 54.2533 18.1309 179.3849 51 V 3.5397 7.6677 115.6520 65.9848 32.0339 177.5455 52 K 4.0063 8.0603 119.4093 59.6453 31.9678 178.9442 53 D 4.5467 7.8532 115.9383 54.9579 41.1162 177.8318 *55 R 4.2861 7.9882 118.8986 55.8259 32.2219 177.8598 56 E 3.9152 8.0537 116.1689 59.5772 29.7751 178.5757 57 Y 4.0634 8.0346 116.4789 61.0803 37.8773 178.6099 58 A 3.9713 8.1538 120.8699 55.2076 18.2713 179.3649 59 A 3.8991 7.7650 118.2584 55.2184 18.4769 179.5710 60 L 4.1709 7.6193 116.7086 56.5069 41.9388 177.6953 61 I 3.7375 6.8235 111.6241 60.0261 38.0477 174.8778 62 D 4.2510 8.9623 117.0674 56.4305 38.2370 173.9149 63 N 4.2032 8.4480 113.5034 54.2759 38.7528 174.3446 64 A 5.1929 7.5753 119.9296 50.7459 17.4611 177.1753 65 L 5.0631 7.4033 124.6801 52.8852 45.7845 175.7697 66 S 5.0454 8.7730 120.7933 56.3292 64.8582 173.0577 67 V 3.9911 8.8143 129.0398 62.8519 32.2999 175.0583 68 G 4.2500 9.0301 116.1702 44.8390 0.0000 174.7048 69 L 3.9196 8.5010 123.0855 57.8662 42.1488 176.8799 70 G 4.1550 8.7585 109.7142 46.7071 0.0000 173.1159 71 A 3.7677 8.9054 132.5550 53.1371 16.2891 177.5624 72 G 3.7919 8.2108 103.2886 47.4245 0.0000 173.7917 73 D 4.4107 7.9680 120.2986 53.2542 41.4218 175.4758 74 P 4.4285 0.0000 0.0000 65.3168 31.7798 178.5747 75 R 4.0129 8.1205 117.6287 58.6828 30.2925 177.2424 76 Q 4.3660 7.9979 115.8161 55.8830 29.1490 177.4464 77 S 4.1903 8.1802 114.8062 61.5397 62.6433 177.3141 78 V 3.6370 7.5873 118.4739 63.1199 30.8602 177.6389 *80 V 4.0350 7.9473 119.6080 62.5638 33.4779 177.4799 81 S 4.2118 7.9256 116.9208 61.1403 62.6400 176.7719 82 Q 3.9920 8.2168 120.7237 58.8759 28.3917 178.5919 83 I 3.7054 7.7092 120.3255 64.7188 37.2121 178.5365 84 S 4.0715 8.3724 116.1271 61.3116 62.3544 176.2103 85 Q 4.0683 7.6699 121.2911 59.6541 28.7742 178.6558 86 Q 4.1531 7.3661 116.3114 58.7098 29.0407 178.2960 87 V 3.6206 7.9622 118.5873 63.8030 32.9071 175.9460 88 Q 3.3385 7.9357 115.8529 56.3318 26.1641 170.4161 89 P 4.8154 0.0000 0.0000 62.0916 33.8008 176.6416 90 Q 4.5837 8.0565 115.3826 57.9588 29.7786 175.9319 91 H 5.2801 7.9568 116.8610 54.8396 34.0889 172.4582 92 V 4.6570 8.7521 124.3183 61.2139 34.9170 173.7290 93 N 5.3093 8.9546 125.7040 52.7593 39.5206 174.5840 94 Q 4.7171 9.3415 121.5481 54.1496 33.8370 175.3664 95 V 4.3421 8.2294 114.1526 60.2260 33.0200 177.4734 96 F 4.0567 8.8967 123.8758 61.5972 39.4133 176.6532 97 T 4.5013 8.2078 108.2432 62.0328 69.2937 175.4738 98 G 4.1460 8.1223 110.3238 44.0125 0.0000 175.7399 99 V 3.6444 7.3820 120.0710 65.8671 31.5897 178.1190 100 G 3.4996 7.9206 104.7239 47.8246 0.0000 175.3497 101 A 4.0380 7.9199 123.1829 54.8291 18.4961 179.8146 102 S 4.0296 8.0365 113.6356 61.6950 63.0586 176.8427 103 R 3.9521 8.2202 121.3668 59.2854 29.5894 178.3957 104 A 3.9926 7.7783 119.4751 55.3140 18.5253 179.4710 105 L 4.1030 8.0206 116.1738 57.4865 41.6982 179.3657 106 L 4.1630 7.8911 119.1208 55.8178 41.5660 178.4534 107 G 3.9565 9.1195 104.6332 45.4456 0.0000 172.5707 108 Q 4.5479 7.5353 115.0458 55.7193 30.9557 173.3634 109 H 4.7291 8.6300 116.6305 56.1916 30.2075 175.2464 110 D 4.5948 8.3471 118.9746 57.7216 41.0324 177.3265 111 T 4.2933 8.2254 115.2046 64.0290 69.2482 174.3358 112 V 3.9374 8.8874 126.8300 62.6444 33.1278 174.7506 113 V 4.8326 8.6251 128.4200 61.1025 33.5073 174.7883 114 N 5.2943 8.1731 126.1775 51.5422 39.2905 174.7742 115 G 4.2120 8.7133 105.5297 44.3475 0.0000 171.5588 116 L 5.0790 8.7694 128.8927 54.8150 42.6996 175.9786 117 I 5.1067 9.0417 119.1320 59.5212 41.6730 174.2971 118 S 5.1145 8.7315 117.7383 54.6610 67.1493 172.0355 119 P 4.9161 0.0000 0.0000 63.5527 31.4222 176.3445 120 T 4.4128 9.4555 110.7601 60.7336 69.9852 175.2444 121 G 3.8964 8.6833 110.4221 45.1464 0.0000 173.4613 122 K 4.4206 7.9384 119.3831 53.9730 33.7375 175.7934 123 V 3.5710 8.3682 123.9111 64.7344 31.7342 176.3781 124 G 2.6939 8.5342 114.4253 44.6516 0.0000 171.8725 125 Y 4.9732 7.4765 116.4697 56.1414 41.2293 175.4189 126 V 4.8224 8.8910 116.1573 59.4520 36.5992 174.2907 127 K 4.9837 8.9674 125.0364 55.4573 33.3078 176.6796 128 I 4.2478 8.5632 119.6721 59.9611 38.8432 176.6459 129 S 4.4537 7.6058 120.4987 57.6082 61.5337 174.3261 130 T 4.5506 7.7316 109.3539 61.9469 69.6246 175.3931 131 G 4.5247 8.1969 112.3978 43.4115 0.0000 173.5571 132 P 4.2469 0.0000 0.0000 65.8875 31.5812 178.0303 133 L 4.1939 8.0244 119.5056 57.0426 42.1310 179.4782 134 S 4.2220 8.1059 113.1902 60.9961 63.2356 176.3100 135 S 4.6126 8.5805 115.1438 59.9998 62.6378 174.8394 136 Q 4.3719 7.9457 117.4355 55.8931 28.5770 174.8563 137 Q 4.6080 7.5200 117.8802 53.5507 31.3560 175.1122 138 K 3.8536 8.4953 117.5646 57.0490 32.3796 176.9833 139 D 4.2662 8.6191 122.3806 54.6279 41.4060 175.7898 140 A 4.4821 8.7116 125.8404 51.0309 20.0061 176.0380 141 I 4.9721 8.2856 122.9141 60.1913 39.8436 175.7333 142 V 4.7173 8.7474 118.6342 59.0170 36.8261 172.9977 143 P 4.2386 0.0000 0.0000 62.2376 32.1145 177.7892 144 V 3.5980 8.4533 122.6440 66.6561 31.3066 178.7492 145 T 3.8235 7.9020 108.7000 65.2279 68.2696 176.2846 146 T 3.8158 7.7749 116.8951 66.2247 68.6405 176.0410 147 A 4.2723 8.0688 121.9279 55.1809 18.6146 179.4263 148 I 3.5328 8.1138 118.4479 64.1596 37.0544 179.7860 149 A 4.0723 7.8985 120.2316 52.2190 18.1079 179.3588 *151 L 4.0108 7.9081 122.2754 56.3914 43.7889 179.7091 152 K 3.9673 7.9776 116.8520 59.7006 31.9305 180.3425 153 D 4.4162 7.9454 118.9322 54.0684 39.7160 177.5982 *155 G 3.8876 8.2201 105.9666 44.8561 0.0000 174.1178 156 G 3.9175 8.3951 109.1083 45.4912 0.0000 173.9311 157 S 4.2941 9.0436 116.2088 59.1101 65.1339 174.3193 158 S 4.2153 7.4065 111.9909 56.8079 66.6011 173.2694 159 V 4.3849 8.7716 121.5218 61.8622 33.2352 174.4992 160 K 4.9747 9.0986 130.0218 55.2483 33.6331 174.8360 161 F 5.5081 8.9583 131.1790 57.2018 40.6095 174.1865 162 F 5.0554 8.6926 128.1429 56.5979 43.2549 172.7497 163 P 3.4216 0.0000 0.0000 61.5370 33.9233 174.9929 *165 N 4.4714 8.3797 111.1540 53.7853 40.7377 176.0891 166 G 3.7966 8.0684 115.2247 47.1940 0.0000 174.4700 167 L 4.4994 8.5591 126.0308 54.3590 41.9345 177.6019 168 D 4.2812 8.1765 119.9434 56.3569 41.0073 176.9346 169 S 4.8713 7.4010 114.5751 57.4995 63.6828 176.4834 170 I 3.8626 8.0998 122.5047 65.6412 37.8994 176.1248 171 D 4.4333 8.1735 119.2354 57.4628 40.7343 178.4830 172 E 4.0817 8.2970 118.6506 59.5612 29.5106 178.5565 173 Y 4.0040 8.6963 120.0339 60.6991 38.8376 178.1488 174 R 3.5577 8.3786 119.9256 59.1359 30.2063 178.1719 175 F 3.8228 8.0170 120.0508 61.2769 39.3616 177.1694 176 V 3.5339 7.8166 117.5474 65.9042 31.1633 177.6971 177 A 3.8084 7.8608 120.7174 55.3205 18.0779 179.5402 178 E 3.7390 8.1335 116.8571 59.3066 29.4164 179.5045 179 A 3.8063 7.7697 120.9351 55.0238 18.3294 179.5333 180 C 4.1302 8.4708 115.5196 62.8970 28.1265 175.9788 181 A 3.9853 8.1284 122.2176 55.3365 17.7375 179.4904 182 A 3.9541 8.0418 118.2916 54.8273 18.4978 178.9535 183 T 4.3975 7.6047 105.1744 60.8116 69.2601 175.1623 184 G 3.9264 7.7020 108.9738 46.7039 0.0000 173.3562 185 F 4.7900 8.4301 121.2153 56.1157 41.7528 174.8917 186 W 5.1917 6.9896 121.8700 55.3740 31.9278 174.9760 187 L 5.1443 8.7353 122.1410 53.9156 45.6727 174.9529 188 E 5.7420 9.8813 125.5272 52.3677 31.0936 172.3151 189 P 4.8688 0.0000 0.0000 63.1369 32.9034 175.7741 190 T 4.7722 8.7498 119.1362 63.0947 73.1194 173.9271 191 G 4.0443 9.8169 115.0377 47.1786 0.0000 174.0112 192 G 3.9253 8.9460 113.3638 45.4475 0.0000 172.1564 193 I 4.2530 7.5471 120.0811 60.4747 37.9952 174.8646 194 D 5.0514 9.3217 122.9054 50.5646 42.3900 175.9050 195 L 4.0496 8.4815 117.5227 57.4268 41.7152 178.0851 196 D 4.6261 8.2728 117.8287 55.4014 41.4459 177.3183 197 N 4.8964 8.1842 114.9337 52.4518 38.0637 176.1727 198 F 4.0901 8.0006 124.4395 61.6017 39.5641 176.2351 199 E 3.8256 8.4201 118.4074 59.5184 29.4090 178.4766 200 Q 4.0120 8.0166 118.8975 59.1455 29.1995 178.0330 201 I 3.8008 7.8074 120.9166 64.4374 37.1049 178.6463 202 V 3.6136 7.5809 119.1534 65.8540 31.2800 177.8473 203 Q 3.9115 8.4884 119.8633 59.0906 28.8577 178.1004 204 I 3.6601 7.9986 120.7428 64.4594 37.1679 178.2418 205 A 3.8460 7.6555 119.9569 55.0937 18.2724 179.7227 206 L 3.9282 8.0791 117.6318 58.0790 41.4621 179.5453 207 D 4.3602 8.4681 118.0609 57.1422 40.7837 178.3815 208 A 4.1000 7.7532 120.8286 53.4853 18.3019 178.4046 209 G 3.9600 7.5299 104.2762 45.2184 0.0000 173.7846 210 V 3.6645 7.4502 119.7108 63.1256 31.6079 176.3531 211 T 3.9881 8.8370 124.1148 65.8989 68.9732 174.3673 212 K 4.5274 7.4936 119.5739 54.1647 36.0313 175.5220 213 V 4.8091 8.8258 124.3667 61.3319 34.8867 174.3592 214 I 5.8140 9.1608 128.6083 57.6954 38.5590 172.5286 215 P 4.9565 0.0000 0.0000 62.7500 33.1937 174.8595 216 H 5.1820 8.7520 119.1181 54.2094 30.7247 174.3165 217 I 4.3623 8.3583 123.1488 60.2702 40.2592 174.1785 218 Y 4.8949 8.6635 124.1724 57.9403 38.4263 179.3342 219 S 4.2023 9.5760 129.3559 61.8590 63.5161 176.6694 220 S 4.2528 8.2879 115.6160 60.1717 63.1254 175.2410 221 I 4.7954 8.1149 113.3630 59.4959 37.6268 174.3314 222 I 4.6897 7.3078 121.5474 59.7083 38.8249 174.9210 223 D 4.5152 8.9308 125.7960 53.6270 40.8058 177.1291 224 S 4.1992 8.6116 122.3514 60.7840 63.5055 175.8211 225 K 4.1313 8.3480 120.9888 58.7632 31.8113 177.7738 226 T 4.3023 7.8571 106.1877 60.5787 70.2696 175.4183 227 G 3.8992 8.3347 109.5755 45.6380 0.0000 172.8172 228 N 4.9516 7.7979 117.8766 51.5623 39.9200 174.8936 229 T 4.2173 8.5466 119.7707 63.4908 69.4166 174.2985 230 R 4.0905 9.1400 126.2581 55.4145 30.3335 175.9776 231 P 4.3200 0.0000 0.0000 65.3383 31.2935 178.4659 232 E 4.0258 8.1231 116.1352 59.2597 29.5165 178.7685 233 D 4.3192 7.9442 119.8285 57.0137 40.7560 178.8230 234 V 3.4764 7.6284 118.5044 65.7189 31.5602 177.7285 235 K 3.8458 8.0765 119.4084 59.8740 32.0319 178.8447 236 T 3.7975 7.8612 115.9112 66.4213 68.2611 176.5792 237 L 3.4431 7.7197 120.7841 57.5107 41.6087 178.9250 238 L 3.7800 7.9654 120.5893 58.6328 41.9152 178.7401 239 D 4.3362 8.2248 118.5732 57.4961 40.6565 179.0436 240 I 3.7205 7.6879 120.0320 64.2903 37.1496 178.4821 241 V 3.6308 8.0248 119.1768 66.2258 31.1371 178.3229 242 K 3.8865 7.9469 116.9103 58.9393 31.8058 179.0855 243 K 4.1063 7.7640 119.7939 59.0944 32.2929 178.2389 244 I 4.4047 7.8327 111.2220 60.8344 38.4712 175.7453 245 V 4.0744 8.0547 120.8080 61.6842 30.5900 175.6185 246 Q 4.1919 8.3119 125.1880 56.0336 29.5791 175.5562 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 -2 S 8.33 4.33 0.00 3.85 3.96 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 -1 N 8.83 3.72 0.00 2.93 2.85 0.00 0.00 6.86 6.46 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 A 8.14 3.39 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 0 K 8.19 3.39 0.00 1.74 1.66 0.00 0.61 0.00 0.00 1.63 0.00 0.00 2.13 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.31 1.31 7.81 3 L 8.42 4.60 0.00 1.76 1.68 0.94 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 4 T 7.46 4.79 4.37 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 1.39 0.00 0.00 5 P 0.00 4.41 0.00 0.55 1.56 0.00 3.59 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.96 0.00 6 N 8.09 4.62 0.00 2.80 2.87 0.00 0.00 6.98 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 Y 7.56 4.53 0.00 2.94 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 Y 9.39 3.97 0.00 2.72 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 R 8.78 3.57 0.00 1.57 1.70 0.00 3.41 0.00 0.00 3.04 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.50 0.00 10 D 8.32 4.44 0.00 2.71 2.59 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 0.00 0.00 0.00 0.00 11 R 8.28 4.53 0.00 1.68 1.84 0.00 3.17 0.00 0.00 3.10 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.47 0.00 12 V 7.80 5.06 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 0.96 0.00 0.00 0.96 0.00 0.00 13 C 9.10 5.18 0.00 2.78 2.59 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 0.00 0.00 0.00 0.00 14 L 8.73 4.63 0.00 1.66 1.56 0.84 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 15 N 8.84 5.41 0.00 2.57 2.36 0.00 0.00 7.23 7.80 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 16 V 8.76 5.18 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 0.70 0.00 0.00 0.96 0.00 0.00 17 L 8.67 4.90 0.00 1.49 1.49 0.52 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 18 A 8.28 4.84 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 19 G 9.61 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 S 7.37 4.66 0.00 4.01 3.96 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 21 K 8.15 3.64 0.00 1.61 1.63 0.00 1.45 0.00 0.00 1.54 0.00 0.00 3.09 0.00 0.00 2.63 0.00 0.00 0.00 0.00 0.43 0.69 7.81 22 D 8.01 4.37 0.00 2.68 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 23 N 8.40 4.30 0.00 2.82 3.12 0.00 0.00 7.06 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 24 A 8.36 4.07 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 R 8.12 3.87 0.00 1.92 2.12 0.00 3.11 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.69 0.00 26 A 8.07 4.01 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 27 I 8.16 3.65 2.11 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 1.44 0.78 0.97 0.00 0.00 28 Y 8.32 4.10 0.00 3.12 3.16 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 29 Q 8.46 3.82 0.00 2.19 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.33 2.36 0.00 30 A 7.99 3.94 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 31 A 8.25 4.11 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 32 E 8.85 3.65 0.00 2.09 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 2.19 2.17 0.00 33 G 7.67 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 H 7.85 5.18 0.00 3.30 3.33 0.00 5.65 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 V 7.08 5.01 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 0.78 0.00 0.00 1.00 0.00 0.00 36 L 8.99 4.87 0.00 1.47 1.53 0.75 0.65 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 37 V 8.76 4.61 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 1.01 0.00 0.00 1.00 0.00 0.00 38 G 9.26 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 V 8.49 4.62 1.86 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 0.92 0.00 0.00 0.07 0.00 0.00 40 L 8.31 5.11 0.00 1.59 1.51 0.81 0.55 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 41 S 9.24 4.28 0.00 4.01 4.16 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 42 K 7.26 4.24 0.00 1.97 1.85 0.00 1.61 0.00 0.00 1.54 0.00 0.00 3.02 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.44 1.37 7.81 43 N 7.82 4.53 0.00 2.64 2.32 0.00 0.00 6.74 6.97 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 44 Y 7.50 4.79 0.00 2.99 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 45 P 0.00 4.47 0.00 2.21 2.20 0.00 3.94 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.99 0.00 46 D 7.88 4.72 0.00 2.91 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 47 V 8.32 3.52 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 2.31 2.55 0.00 57 Y 8.03 4.06 0.00 3.07 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 58 A 8.15 3.97 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 59 A 7.76 3.90 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 60 L 7.62 4.17 0.00 1.75 1.68 0.74 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 61 I 6.82 3.74 1.01 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 1.59 0.72 0.76 0.00 0.00 62 D 8.96 4.25 0.00 2.81 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 63 N 8.45 4.20 0.00 2.93 3.00 0.00 0.00 7.15 8.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 A 7.58 5.19 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 65 L 7.40 5.06 0.00 1.73 1.47 0.88 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 66 S 8.77 5.05 0.00 3.89 3.70 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 0.00 0.00 0.00 0.00 67 V 8.81 3.99 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 0.91 0.00 0.00 0.90 0.00 0.00 68 G 9.03 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 L 8.50 3.92 0.00 1.69 1.89 0.88 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 70 G 8.76 4.16 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 0.00 0.00 0.00 71 A 8.91 3.77 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 72 G 8.21 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 D 7.97 4.41 0.00 2.78 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 2.37 2.53 0.00 83 I 7.71 3.71 1.84 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 1.57 0.66 0.84 0.00 0.00 84 S 8.37 4.07 0.00 3.86 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 85 Q 7.67 4.07 0.00 2.17 2.32 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 2.37 2.64 0.00 86 Q 7.37 4.15 0.00 2.17 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.76 0.00 0.00 0.00 0.00 0.00 2.37 2.50 0.00 87 V 7.96 3.62 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 0.83 0.00 0.00 0.93 0.00 0.00 88 Q 7.94 3.34 0.00 2.21 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.67 0.00 0.00 0.00 0.00 0.00 2.42 2.41 0.00 89 P 0.00 4.82 0.00 2.36 2.07 0.00 3.75 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.97 0.00 90 Q 8.06 4.58 0.00 2.13 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.84 6.74 0.00 0.00 0.00 0.00 0.00 2.43 2.29 0.00 91 H 7.96 5.28 0.00 3.21 3.20 0.00 5.53 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 V 8.75 4.66 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 0.90 0.00 0.00 0.91 0.00 0.00 93 N 8.95 5.31 0.00 2.78 2.75 0.00 0.00 6.80 7.31 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 94 Q 9.34 4.72 0.00 2.11 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.82 0.00 0.00 0.00 0.00 0.00 2.26 2.57 0.00 95 V 8.23 4.34 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.99 0.00 0.00 96 F 8.90 4.06 0.00 3.41 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 97 T 8.21 4.50 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 98 G 8.12 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 99 V 7.38 3.64 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 1.01 0.00 0.00 1.00 0.00 0.00 100 G 7.92 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 A 7.92 4.04 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 0.00 102 S 8.04 4.03 0.00 3.89 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 0.00 103 R 8.22 3.95 0.00 1.88 1.99 0.00 3.20 0.00 0.00 3.24 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.70 0.00 104 A 7.78 3.99 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 0.00 105 L 8.02 4.10 0.00 1.61 1.74 0.92 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 106 L 7.89 4.16 0.00 1.77 1.73 0.90 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 107 G 9.12 3.96 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 0.00 0.00 0.00 108 Q 7.54 4.55 0.00 2.14 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 7.09 0.00 0.00 0.00 0.00 0.00 2.25 2.58 0.00 109 H 8.63 4.73 0.00 3.09 3.34 0.00 5.92 0.00 0.00 0.00 0.00 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 D 8.35 4.59 0.00 2.88 2.77 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 0.00 111 T 8.23 4.29 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 112 V 8.89 3.94 2.26 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 1.09 0.00 0.00 1.28 0.00 0.00 113 V 8.63 4.83 2.04 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 0.73 0.00 0.00 0.94 0.00 0.00 114 N 8.17 5.29 0.00 2.88 3.13 0.00 0.00 6.63 7.08 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 0.00 115 G 8.71 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 L 8.77 5.08 0.00 1.94 1.73 0.95 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 117 I 9.04 5.11 2.12 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.02 1.20 0.00 0.00 118 S 8.73 5.11 0.00 3.74 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 0.00 119 P 0.00 4.92 0.00 1.78 1.94 0.00 3.24 0.00 0.00 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.20 0.00 120 T 9.46 4.41 4.27 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 1.33 0.00 0.00 121 G 8.68 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 0.00 122 K 7.94 4.42 0.00 1.87 1.73 0.00 1.63 0.00 0.00 1.44 0.00 0.00 2.84 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.30 1.32 7.81 123 V 8.37 3.57 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 0.59 0.00 0.00 0.96 0.00 0.00 124 G 8.53 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 0.00 0.00 0.00 125 Y 7.48 4.97 0.00 2.99 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 0.00 126 V 8.89 4.82 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 0.94 0.00 0.00 1.01 0.00 0.00 127 K 8.97 4.98 0.00 1.83 1.67 0.00 1.73 0.00 0.00 1.69 0.00 0.00 2.91 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.36 1.35 7.81 128 I 8.56 4.25 0.56 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.40 0.61 0.00 0.00 129 S 7.61 4.45 0.00 4.21 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 T 7.73 4.55 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 1.27 0.00 0.00 131 G 8.20 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.25 0.00 2.21 2.22 0.00 3.81 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.11 0.00 133 L 8.02 4.19 0.00 1.75 1.76 0.94 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 134 S 8.11 4.22 0.00 4.02 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 0.00 135 S 8.58 4.61 0.00 4.01 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 Q 7.95 4.37 0.00 2.20 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.72 0.00 0.00 0.00 0.00 0.00 2.50 2.47 0.00 137 Q 7.52 4.61 0.00 2.18 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.65 6.76 0.00 0.00 0.00 0.00 0.00 2.49 2.44 0.00 138 K 8.50 3.85 0.00 1.73 1.76 0.00 1.75 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.45 1.49 7.81 139 D 8.62 4.27 0.00 2.65 2.59 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 0.00 0.00 0.00 0.00 140 A 8.71 4.48 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 I 8.29 4.97 1.87 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 1.35 0.71 0.99 0.00 0.00 142 V 8.75 4.72 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 0.67 0.00 0.00 0.90 0.00 0.00 143 P 0.00 4.24 0.00 2.12 1.78 0.00 3.65 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.18 0.00 144 V 8.45 3.60 2.31 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 1.20 0.00 0.00 0.94 0.00 0.00 145 T 7.90 3.82 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 146 T 7.77 3.82 4.37 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 1.23 0.00 0.00 147 A 8.07 4.27 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 0.00 148 I 8.11 3.53 1.86 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 1.38 0.75 0.30 0.00 0.00 149 A 7.90 4.07 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 *151 L 7.91 4.01 0.00 1.69 1.90 1.18 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 152 K 7.98 3.97 0.00 1.72 1.78 0.00 1.49 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.32 0.83 7.81 153 D 7.95 4.42 0.00 2.60 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *155 G 8.22 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 0.00 0.00 0.00 156 G 8.40 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 157 S 9.04 4.29 0.00 3.67 3.61 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 0.00 158 S 7.41 4.22 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 0.00 159 V 8.77 4.38 2.31 0.00 0.00 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185 F 8.43 4.79 0.00 2.82 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 0.00 186 W 6.99 5.19 0.00 3.37 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 187 L 8.74 5.14 0.00 1.84 1.53 1.15 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 188 E 9.88 5.74 0.00 2.02 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.34 0.00 189 P 0.00 4.87 0.00 1.97 2.06 0.00 3.96 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.13 0.00 190 T 8.75 4.77 4.44 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 0.00 0.00 0.00 1.12 0.00 0.00 191 G 9.82 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 0.00 0.00 0.00 192 G 8.95 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 0.00 0.00 0.00 193 I 7.55 4.25 2.02 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 1.45 0.57 1.15 0.00 0.00 194 D 9.32 5.05 0.00 2.80 2.77 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 0.00 195 L 8.48 4.05 0.00 1.65 1.75 0.93 0.90 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 0.00 196 D 8.27 4.63 0.00 2.83 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 0.00 197 N 8.18 4.90 0.00 2.98 3.04 0.00 0.00 5.92 8.12 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 0.00 198 F 8.00 4.09 0.00 3.29 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 0.00 199 E 8.42 3.83 0.00 2.17 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 2.39 2.39 0.00 200 Q 8.02 4.01 0.00 2.18 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.69 0.00 0.00 0.00 0.00 0.00 2.47 2.47 0.00 201 I 7.81 3.80 1.84 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.00 0.71 0.00 0.00 202 V 7.58 3.61 1.62 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 0.94 0.00 0.00 0.10 0.00 0.00 203 Q 8.49 3.91 0.00 2.28 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.54 0.00 0.00 0.00 0.00 0.00 2.35 2.59 0.00 204 I 8.00 3.66 2.23 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.57 0.65 0.00 0.00 205 A 7.66 3.85 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 0.00 206 L 8.08 3.93 0.00 1.80 1.70 0.91 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 207 D 8.47 4.36 0.00 2.55 2.70 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 0.00 0.00 0.00 0.00 208 A 7.75 4.10 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 209 G 7.53 3.96 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 0.00 0.00 0.00 210 V 7.45 3.66 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 0.95 0.00 0.00 0.97 0.00 0.00 211 T 8.84 3.99 4.36 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 1.12 0.00 0.00 212 K 7.49 4.53 0.00 0.79 0.74 0.00 0.61 0.00 0.00 0.64 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.30 0.21 7.81 213 V 8.83 4.81 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 1.07 0.00 0.00 0.91 0.00 0.00 214 I 9.16 5.81 2.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 2.30 0.88 0.00 0.00 215 P 0.00 4.96 0.00 2.34 2.19 0.00 4.03 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.14 0.00 216 H 8.75 5.18 0.00 2.71 2.25 0.00 5.61 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 217 I 8.36 4.36 1.82 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 1.16 0.54 0.92 0.00 0.00 218 Y 8.66 4.89 0.00 2.99 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 0.00 0.00 0.00 0.00 219 S 9.58 4.20 0.00 4.04 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 0.00 220 S 8.29 4.25 0.00 4.04 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 0.00 221 I 8.11 4.80 1.85 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 1.45 1.93 0.87 0.00 0.00 222 I 7.31 4.69 2.03 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 1.21 0.82 0.92 0.00 0.00 223 D 8.93 4.52 0.00 2.67 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 0.00 224 S 8.61 4.20 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 0.00 225 K 8.35 4.13 0.00 1.86 1.91 0.00 1.66 0.00 0.00 1.75 0.00 0.00 3.02 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.48 1.58 7.81 226 T 7.86 4.30 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 0.00 227 G 8.33 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 0.00 228 N 7.80 4.95 0.00 2.80 2.75 0.00 0.00 6.99 7.02 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 0.00 229 T 8.55 4.22 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 1.27 0.00 0.00 230 R 9.14 4.09 0.00 1.93 2.01 0.00 3.34 0.00 0.00 3.29 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.60 0.00 231 P 0.00 4.32 0.00 2.15 2.10 0.00 3.59 0.00 0.00 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.15 0.00 232 E 8.12 4.03 0.00 2.14 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 2.34 2.32 0.00 233 D 7.94 4.32 0.00 2.97 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 0.00 234 V 7.63 3.48 2.20 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 1.09 0.00 0.00 0.90 0.00 0.00 235 K 8.08 3.85 0.00 1.80 1.87 0.00 1.67 0.00 0.00 1.74 0.00 0.00 2.90 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.39 1.60 7.81 236 T 7.86 3.80 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 237 L 7.72 3.44 0.00 1.56 1.05 0.64 -0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 238 L 7.97 3.78 0.00 1.70 1.76 0.81 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 239 D 8.22 4.34 0.00 2.82 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 0.00 240 I 7.69 3.72 2.23 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.77 1.14 0.00 0.00 241 V 8.02 3.63 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 0.88 0.00 0.00 1.19 0.00 0.00 242 K 7.95 3.89 0.00 1.72 1.79 0.00 1.63 0.00 0.00 1.58 0.00 0.00 2.95 0.00 0.00 2.79 0.00 0.00 0.00 0.00 0.82 1.02 7.81 243 K 7.76 4.11 0.00 1.88 2.01 0.00 1.80 0.00 0.00 1.77 0.00 0.00 3.10 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.47 1.45 7.81 244 I 7.83 4.40 2.03 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 1.66 0.78 0.97 0.00 0.00 245 V 8.05 4.07 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 0.88 0.00 0.00 1.02 0.00 0.00 246 Q 8.31 4.19 0.00 2.04 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.42 0.00 0.00 0.00 0.00 0.00 2.29 2.51 0.00 * Residues marked with a * may have inaccurate shift predictions.