NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4774 8.3044 120.3425 54.8320 33.4847 173.7402 2 K 4.0505 8.6745 121.1660 56.7259 32.5984 175.7340 3 M 4.5174 8.8180 125.3325 55.7593 33.6046 177.3492 4 K 3.8126 8.2105 120.3715 59.9326 32.3053 177.9424 5 E 4.0141 8.3080 117.8058 59.4246 29.4790 179.0900 6 F 4.3284 8.4390 120.0267 61.4520 39.6041 176.9135 7 L 3.7231 8.5468 118.9170 57.8127 41.3391 179.3557 8 D 4.2897 8.0864 118.7722 57.2624 40.9038 178.7513 9 L 3.9180 7.6427 118.9673 57.7142 41.4167 179.2676 10 L 3.7703 7.2979 118.8824 58.2647 42.0240 178.4799 11 N 4.4820 7.8703 114.8365 55.3070 38.7010 176.4519 12 E 4.2822 7.9264 118.0316 55.8942 30.3177 176.4114 13 S 4.3386 7.2943 114.7704 57.6900 63.0979 174.1947 14 R 4.0907 8.5391 123.9900 58.3809 30.0577 176.5137 15 L 4.5865 8.2836 121.0951 53.8298 45.5967 174.9537 16 T 5.1591 8.6572 122.5861 61.8916 71.8365 173.5625 17 V 4.9048 8.7145 117.9169 59.7920 36.2146 174.4348 18 T 5.0260 8.4580 116.1083 60.2034 71.0915 172.2214 19 L 5.3013 8.8054 129.5269 53.4634 44.7744 175.0802 20 T 5.1031 8.9934 116.7668 60.1257 72.1507 173.9200 21 G 4.5784 8.4909 111.3904 43.6320 0.0000 172.6611 22 A 4.0200 8.8220 120.5751 55.4015 18.2839 180.3304 23 G 3.6645 8.3731 102.1015 47.4890 0.0000 174.9412 24 I 4.0045 7.6002 119.0345 62.3729 38.4738 176.7538 25 S 4.6668 7.7252 114.6234 59.9170 63.7976 176.0038 26 T 4.6906 7.8944 114.2795 63.9149 68.0734 174.6049 27 P 4.3820 0.0000 0.0000 64.6389 31.4371 177.0124 28 S 4.4417 7.8342 112.4802 58.4596 62.8090 174.9854 29 G 3.9120 8.1284 109.1413 45.0930 0.0000 173.7861 30 I 4.0074 7.4780 121.8539 59.5709 37.5826 173.6264 31 P 4.3364 0.0000 0.0000 62.4430 31.7486 175.2072 32 D 4.5122 8.2321 121.6001 53.2672 42.2457 175.6212 33 F 4.6735 8.4049 129.7319 56.8726 40.3708 174.4191 *46 N 4.1005 8.3800 120.5985 53.9523 39.6707 176.4643 47 V 3.0598 7.6559 116.3510 64.0123 31.6915 177.1742 48 F 4.9904 7.9456 116.2759 57.4755 39.3224 174.3587 49 D 5.2688 8.3410 122.8718 53.2079 42.6026 177.1156 50 I 3.1828 8.6028 124.7341 64.1964 38.0643 177.9804 51 D 4.4912 8.1735 119.4678 56.3462 39.2427 178.2441 52 F 4.0551 8.2065 121.6718 60.9001 39.3029 176.5760 53 F 3.7672 7.8477 119.0723 61.6482 39.1293 176.5848 54 Y 4.0800 7.2422 114.4876 60.8115 37.6478 178.1224 55 S 4.1961 7.7015 115.6116 60.2955 64.6591 174.4756 56 H 4.8624 7.9107 117.9228 52.4905 29.2599 172.1355 57 P 3.9236 0.0000 0.0000 65.7721 31.5362 178.5400 58 E 4.2792 8.1099 117.8311 59.2930 29.4532 178.9731 59 E 4.0196 8.1112 118.0746 59.3767 29.5778 178.8082 60 F 4.2524 8.1790 120.5408 61.8863 39.0741 176.8843 61 Y 4.0416 8.3088 115.8578 60.7488 37.3803 178.5437 62 R 4.0708 8.0288 119.5164 59.0946 30.0746 178.7323 63 F 4.1350 8.3164 120.3479 61.1358 39.2826 176.9397 64 A 2.9285 7.5342 120.5404 54.7390 17.6718 179.6307 65 K 4.0555 7.3312 116.2872 58.9404 32.1868 178.1884 66 E 4.6768 7.1862 116.0043 55.6586 31.3378 177.2270 67 G 3.8872 7.5843 103.2948 43.9768 0.0000 172.8730 68 I 4.3333 6.6997 118.8194 62.7978 39.7684 177.7007 69 F 4.6057 7.7683 119.1202 60.3617 38.8056 176.0215 70 P 4.4048 0.0000 0.0000 65.4023 31.1577 178.2878 71 M 4.2056 8.1026 117.7235 58.0302 31.5125 178.5203 72 L 4.0925 7.9169 118.8860 57.7930 41.8912 178.3616 73 Q 4.1308 7.9371 115.3144 57.1624 29.0735 176.4932 74 A 4.1118 7.5754 121.6474 52.1539 18.9195 176.8321 75 K 4.6326 8.2408 121.1789 53.4373 34.4168 174.8360 76 P 4.2509 0.0000 0.0000 62.9187 31.9775 175.9214 77 N 4.9813 8.5848 118.1002 51.0532 41.1200 174.9175 78 L 3.9249 8.4790 120.0081 58.6797 41.9388 178.8808 79 A 4.0007 8.2413 120.5768 55.2606 18.2062 179.3554 80 H 4.1626 8.2316 114.2905 59.0828 28.8192 177.9968 81 V 3.6181 7.9401 120.0176 65.8181 31.2462 177.6281 82 L 3.9416 8.2353 120.3578 58.3607 41.9092 179.0120 83 L 4.0233 7.9122 118.0686 57.7929 41.5398 179.4523 84 A 4.0510 7.8503 120.5614 54.9689 18.2892 179.9010 85 K 3.9535 8.3071 117.3600 59.5897 32.1341 179.6252 86 L 4.0086 8.3238 119.7190 57.5683 41.4435 179.0874 87 E 4.1997 8.1202 120.6455 58.8689 29.4023 178.4746 88 E 3.9591 7.8854 117.7259 59.0830 29.7498 178.1010 89 K 4.3247 7.8500 115.7125 56.1273 32.3530 177.6045 90 G 3.8965 8.0756 107.8558 46.1507 0.0000 174.6316 91 L 4.3806 8.3974 119.4282 54.8988 42.3693 176.9903 92 I 4.7232 7.3023 119.4915 59.4448 40.6247 175.4062 93 E 4.1682 9.4016 126.5377 58.7830 30.4369 176.0661 94 A 4.6221 7.5554 117.6727 51.1422 22.8940 175.0623 95 V 4.5198 8.6109 120.0413 61.1454 34.0380 174.4657 96 I 4.7696 8.7834 129.1887 59.8336 39.5140 174.6005 97 T 5.0230 8.9070 121.5780 60.5530 70.4821 174.1425 98 Q 4.1615 8.8066 124.9971 56.5744 29.5892 176.1545 99 N 4.6139 8.2814 117.5183 52.8995 39.4888 174.9912 100 I 4.5981 8.3687 112.8313 59.9333 38.2579 176.4980 101 D 4.4899 8.0270 119.7981 53.9994 40.0578 176.7570 102 R 4.2756 8.0473 117.1890 56.6077 28.1134 177.9167 103 L 3.9687 8.5877 121.5375 57.9374 41.3590 179.1325 104 H 4.2617 8.0223 116.0037 59.0089 28.6006 177.6754 105 Q 4.2204 8.0383 119.3967 58.9819 28.4393 178.6820 106 R 3.9827 7.8226 117.4010 58.3918 30.1675 177.9697 107 A 4.3670 7.5087 118.4090 52.1547 19.0241 177.8886 108 G 4.0271 7.7716 105.2858 44.9220 0.0000 174.3350 109 S 4.4643 7.8016 116.6994 58.4441 63.4004 174.3949 110 K 4.0839 9.5191 125.4528 58.1655 32.5403 176.9128 111 K 4.3605 8.3531 122.8222 54.8380 32.2948 174.6254 112 V 4.7732 8.0858 125.4647 60.8167 34.2909 174.2460 113 I 4.2594 9.1487 129.6945 59.8778 38.6285 175.0344 114 E 4.6277 8.6299 128.3107 54.8305 29.1701 177.2387 115 L 3.9626 8.6223 126.1955 57.2018 42.0481 178.4569 116 H 4.8036 7.9525 114.3112 55.1921 29.4867 175.4523 117 G 3.6686 8.7106 108.8318 45.4600 0.0000 172.8095 118 N 4.9725 8.2978 116.4092 52.2943 40.2419 174.5071 119 V 4.1812 8.2764 111.7154 61.6772 31.9229 176.8966 120 E 4.6413 8.9773 122.6815 57.5182 31.3205 175.9165 121 E 5.0744 8.3645 118.5472 55.3567 31.8841 175.0020 122 Y 5.3218 9.1489 119.8438 57.0872 43.1138 173.5731 123 Y 5.6070 8.6375 117.6722 56.0473 42.1584 173.3968 124 C 4.7451 9.4527 122.7186 59.6082 32.1001 175.1752 125 V 3.8393 8.9357 120.5738 64.3518 30.7907 176.8768 126 R 4.1600 7.4167 120.1348 57.7670 30.4468 176.0872 127 C 4.3378 7.9551 115.2673 58.1887 30.7887 174.2469 128 E 4.2085 8.3934 118.8259 56.8928 27.1835 174.1012 129 K 4.0629 8.0392 120.8664 56.9295 33.1470 176.0459 130 K 4.9167 8.5512 126.4690 56.6892 33.1880 175.8805 131 Y 4.9555 9.4343 120.8991 56.7200 43.0401 174.7875 132 T 5.0422 9.0083 112.9112 60.4996 71.1965 176.2533 133 V 3.4159 8.5875 122.3479 65.0491 31.2867 178.4102 134 E 3.8740 8.0985 118.5002 58.7960 29.3481 178.7779 135 D 4.3374 7.8788 119.1862 57.2651 40.8557 178.8797 136 V 3.3132 7.4463 118.4911 65.9288 31.2330 178.1136 137 I 3.2889 7.1621 118.4778 63.9422 37.0904 178.1083 138 K 4.0007 7.9084 120.4311 59.5147 31.9831 179.1261 139 K 3.9493 8.0229 118.7378 59.2267 31.7125 178.5800 140 L 5.0130 7.5729 117.9289 55.4686 41.6334 178.2762 141 E 4.2806 7.9306 119.2779 57.6666 29.5605 177.2781 142 S 4.6987 7.0867 111.5107 57.1427 63.8976 173.4846 143 S 4.5166 7.3441 111.9336 58.1841 64.5555 175.8984 144 D 4.5719 8.7261 125.6200 55.9125 41.1036 176.7838 145 V 4.2608 7.2464 118.1978 60.0235 34.5094 172.5374 146 P 4.2857 0.0000 0.0000 62.7334 32.1627 175.0868 147 L 5.1452 8.1327 124.0063 52.4195 44.8238 175.9714 148 C 4.3013 9.1536 123.1025 59.8665 32.2845 174.2609 149 D 4.6545 9.2947 124.5795 56.0725 41.1412 177.5368 150 D 4.6504 8.3117 118.5819 56.1417 41.5760 177.0181 151 C 4.6842 7.7500 110.1504 56.9516 30.3969 173.6981 152 N 4.7658 8.2207 115.4961 54.1122 37.2025 173.7802 153 S 4.6210 7.3482 112.3344 56.9256 64.9996 173.2467 154 L 4.4583 8.4286 123.3732 55.5965 43.0041 175.4340 155 I 4.9427 8.4997 127.6030 60.0466 38.4441 175.3264 156 R 5.3060 9.1241 123.2306 52.4653 32.8205 173.3801 157 P 3.7177 0.0000 0.0000 61.8399 32.4154 175.9102 158 N 5.0407 8.3241 121.7763 53.4948 37.1187 173.7767 159 I 4.8213 7.1362 112.0524 58.9978 41.4993 176.6978 160 V 4.1715 8.1982 124.4039 62.1285 32.0722 175.7587 161 F 4.4380 9.1931 127.0908 56.2298 40.9855 175.6488 162 F 4.2074 9.0862 120.8361 59.2766 39.1660 176.9091 163 G 4.1012 9.3317 112.9980 45.0663 0.0000 172.6472 164 E 4.7506 7.4855 119.1212 54.0603 31.8573 175.1920 165 N 4.6429 8.4299 120.6495 52.9420 39.4223 175.2472 166 L 4.3654 8.1316 121.0352 53.0152 43.0725 175.6453 167 P 4.3000 0.0000 0.0000 63.2144 31.8920 177.1038 168 Q 4.0021 8.7645 122.4570 59.0882 28.7849 178.6271 169 D 4.3097 8.0500 119.0907 57.2771 40.9018 178.5470 170 A 3.9811 7.8821 120.8582 54.9474 18.3777 179.3050 171 L 3.8642 8.0470 118.8903 58.3394 42.1125 179.3778 172 R 3.8928 8.2455 118.3427 59.3224 29.9625 178.7224 173 E 3.9005 8.3768 118.8696 59.0295 29.5036 178.7480 174 A 3.9481 8.1295 121.0912 55.1154 18.4216 179.6535 175 I 3.7139 8.1164 118.8040 64.3393 37.1746 178.8244 176 G 3.6277 8.3403 106.8212 47.9594 0.0000 175.7386 177 L 4.0285 8.0612 122.0368 57.4267 41.4805 179.8603 178 S 4.1253 8.3961 115.7401 61.6030 62.5679 176.9398 179 S 4.1435 8.1103 115.7880 60.9526 62.8582 175.9882 180 R 4.2078 7.6411 119.5606 56.3293 30.6164 176.8929 181 A 4.2443 7.4670 122.3630 52.3098 19.0357 177.4878 182 S 4.5231 8.8934 116.7650 59.6343 65.0078 173.8306 183 L 5.1329 7.6977 122.7039 53.6819 45.6204 173.9731 184 M 5.1756 9.3010 126.3279 53.7693 35.2005 174.1302 185 I 4.9801 8.6973 126.7448 59.6260 40.2862 174.5935 186 V 4.4816 8.9754 128.5028 61.7273 33.3580 174.7171 187 L 4.7818 8.8134 127.7064 53.5132 44.9111 177.0756 188 G 3.7389 9.3458 112.7627 45.7924 0.0000 171.6786 189 S 4.9478 7.7984 113.2469 56.0809 64.2887 174.1315 190 S 4.3250 8.7302 120.7411 58.2382 63.8036 173.5325 191 L 3.6331 7.5571 119.9020 56.8413 39.0677 175.1127 192 V 4.4298 7.7801 107.9680 60.8519 33.8654 176.1575 193 V 4.4505 7.6634 120.9649 61.3962 32.4934 174.1870 194 Y 4.8189 8.7395 124.9424 56.0509 39.8377 173.8794 195 P 4.6972 0.0000 0.0000 63.2429 32.3868 177.7013 196 A 3.8950 8.1068 122.1000 55.6022 17.9154 179.3884 197 A 3.7647 7.6977 118.2327 54.9216 18.5807 178.9191 198 E 3.9377 7.8732 115.6240 57.4171 29.7905 178.7177 199 L 3.9041 7.6917 120.2737 57.3714 41.6763 177.5142 200 P 4.1379 0.0000 0.0000 65.2629 31.1306 178.3695 201 L 3.8233 7.3266 118.7444 58.0774 42.0427 178.8996 202 I 3.6681 7.5777 119.7361 64.5926 36.9596 178.4671 203 T 4.1353 7.6739 117.7184 66.0607 68.3398 176.8009 204 V 3.9201 7.5660 121.2305 65.7748 31.4174 178.3385 205 R 4.0037 8.0703 116.4652 59.0785 29.9440 178.5522 206 S 4.4272 7.7903 113.1197 58.4612 63.1871 174.4871 207 G 3.8939 7.6365 108.4723 45.0804 0.0000 174.2405 208 G 4.0176 8.4384 108.5368 45.4428 0.0000 172.8333 209 K 4.8004 8.9359 119.0506 54.5081 35.1449 175.6044 210 L 5.2161 8.3634 123.6208 53.3026 45.3248 175.0206 211 V 4.9572 9.0686 125.9309 61.1568 34.7584 173.9709 212 I 4.8265 8.8622 128.4114 59.4261 40.3818 174.5606 213 V 4.6199 8.5538 127.4066 61.5171 33.7318 173.7897 214 N 4.7732 8.6830 124.8551 52.6231 43.0020 173.5744 215 L 4.6301 8.7263 129.0324 54.8385 41.0348 174.9169 216 G 4.3419 7.9155 110.1726 42.3131 0.0000 171.0627 217 E 4.4290 8.1732 119.4632 55.8144 30.7742 176.0229 218 T 4.7567 8.8633 109.4918 59.1072 71.8054 173.3282 219 P 4.1889 0.0000 0.0000 64.5929 31.5433 177.3287 220 F 4.9831 7.7980 116.5499 57.2083 39.6242 177.1507 221 D 4.4715 8.0633 124.7978 57.3232 40.7619 178.6635 222 D 4.3854 8.1805 117.9617 55.7010 39.3973 176.9175 223 I 4.1837 7.5155 110.2443 60.3418 38.1767 175.3519 224 A 4.4251 7.5883 125.3203 52.2757 19.0302 178.0866 225 T 4.2094 8.8000 120.4259 66.0856 69.3773 175.4586 226 L 4.6977 7.8044 120.1837 52.8058 46.3510 175.3001 227 K 4.7839 8.4598 124.0159 54.8648 34.9035 174.7292 228 Y 4.2947 9.2308 126.3814 56.5062 39.5929 174.3836 229 N 5.9956 8.8957 125.1687 51.3224 37.6218 173.2401 230 M 4.7453 7.7647 119.5274 53.4185 34.9780 174.2224 231 D 4.3972 8.6402 118.7760 54.2031 42.0974 177.0606 232 V 3.6175 8.5335 125.5509 66.1682 31.4589 178.4293 233 V 3.5799 7.8273 117.5282 65.9840 31.4672 177.4884 234 E 3.9028 8.7571 119.2685 58.9730 29.3414 178.6419 235 F 3.9313 8.2728 120.6477 61.1830 39.5244 176.9064 236 A 3.7878 8.3681 120.7972 55.0922 18.1281 179.5529 237 R 3.7751 8.1788 117.3590 59.6697 30.0956 179.0056 238 R 3.8258 7.7857 117.8516 59.1059 29.9665 179.1855 239 V 3.3820 7.4585 118.1488 66.2563 31.3877 178.0692 240 M 4.0396 7.9617 118.3716 58.2247 31.2776 178.6905 241 E 3.9068 8.1314 118.7088 59.6721 29.5914 179.3539 242 E 4.0243 8.3078 117.1016 58.5804 29.7084 178.3409 243 G 3.7405 8.1584 106.4090 45.0690 0.0000 173.6093 244 G 3.7456 7.4987 107.0664 46.8060 0.0000 173.7513 245 I 4.2165 7.9533 120.3063 60.2181 38.7462 176.6775 246 S 4.0496 8.7494 120.3325 59.1554 62.8653 172.1314 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 1 M 8.30 4.48 0.00 2.19 2.48 0.00 0.00 0.00 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.63 0.00 2 K 8.67 4.05 0.00 1.87 1.83 0.00 1.80 0.00 0.00 1.76 0.00 0.00 3.00 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.59 1.59 7.81 3 M 8.82 4.52 0.00 2.07 2.09 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.62 0.00 4 K 8.21 3.81 0.00 1.83 1.89 0.00 1.80 0.00 0.00 1.87 0.00 0.00 2.95 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.54 1.53 7.81 5 E 8.31 4.01 0.00 2.22 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 0.00 2.46 2.45 0.00 6 F 8.44 4.33 0.00 3.40 3.34 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 7 L 8.55 3.72 0.00 1.81 1.65 0.95 1.08 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 8 D 8.09 4.29 0.00 2.85 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 9 L 7.64 3.92 0.00 1.77 1.67 1.03 0.45 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 10 L 7.30 3.77 0.00 0.98 1.51 0.90 0.85 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 11 N 7.87 4.48 0.00 2.69 2.81 0.00 0.00 7.06 7.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 E 7.93 4.28 0.00 1.93 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 2.28 2.50 0.00 13 S 7.29 4.34 0.00 3.94 3.72 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 14 R 8.54 4.09 0.00 1.95 2.03 0.00 3.05 0.00 0.00 3.14 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.60 0.00 15 L 8.28 4.59 0.00 1.69 1.49 0.91 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 16 T 8.66 5.16 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 17 V 8.71 4.90 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 0.67 0.00 0.00 0.91 0.00 0.00 18 T 8.46 5.03 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 1.25 0.00 0.00 19 L 8.81 5.30 0.00 1.71 1.41 0.90 0.46 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 20 T 8.99 5.10 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 21 G 8.49 4.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 A 8.82 4.02 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 23 G 8.37 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 I 7.60 4.00 1.83 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 1.18 0.76 1.01 0.00 0.00 25 S 7.73 4.67 0.00 3.91 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 26 T 7.89 4.69 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 1.25 0.00 0.00 27 P 0.00 4.38 0.00 2.04 2.15 0.00 3.69 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 2.01 2.16 0.00 28 S 7.83 4.44 0.00 4.05 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 49 D 8.34 5.27 0.00 2.96 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 I 8.60 3.18 1.92 0.00 0.00 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.25 1.04 0.00 0.00 51 D 8.17 4.49 0.00 2.97 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 F 8.21 4.06 0.00 3.21 3.41 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 53 F 7.85 3.77 0.00 2.08 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 Y 7.24 4.08 0.00 2.94 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 55 S 7.70 4.20 0.00 3.53 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 H 7.91 4.86 0.00 2.12 2.84 0.00 5.62 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 P 0.00 3.92 0.00 2.19 1.82 0.00 3.51 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.90 0.00 58 E 8.11 4.28 0.00 2.10 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 0.00 2.41 2.49 0.00 59 E 8.11 4.02 0.00 2.10 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.36 0.00 60 F 8.18 4.25 0.00 3.40 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 61 Y 8.31 4.04 0.00 3.23 3.07 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 62 R 8.03 4.07 0.00 2.15 2.04 0.00 3.17 0.00 0.00 3.13 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.86 0.00 63 F 8.32 4.13 0.00 3.03 3.11 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 64 A 7.53 2.93 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 K 7.33 4.06 0.00 1.77 1.97 0.00 1.83 0.00 0.00 2.11 0.00 0.00 3.20 0.00 0.00 3.42 0.00 0.00 0.00 0.00 1.81 1.70 7.81 66 E 7.19 4.68 0.00 1.85 1.92 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 2.22 2.24 0.00 67 G 7.58 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 68 I 6.70 4.33 1.30 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.04 0.93 0.00 0.00 69 F 7.77 4.61 0.00 3.04 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 P 0.00 4.40 0.00 2.17 2.13 0.00 3.59 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 2.17 2.23 0.00 71 M 8.10 4.21 0.00 2.15 2.43 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.68 0.00 72 L 7.92 4.09 0.00 1.73 1.78 0.98 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 73 Q 7.94 4.13 0.00 2.21 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.82 0.00 0.00 0.00 0.00 0.00 2.41 2.34 0.00 74 A 7.58 4.11 1.30 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 0.00 0.00 0.00 75 K 8.24 4.63 0.00 1.74 1.72 0.00 1.76 0.00 0.00 1.76 0.00 0.00 3.03 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.35 1.50 7.81 76 P 0.00 4.25 0.00 2.18 2.14 0.00 3.72 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.10 0.00 77 N 8.58 4.98 0.00 3.01 3.03 0.00 0.00 5.75 6.67 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 78 L 8.48 3.92 0.00 1.77 1.72 0.92 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 79 A 8.24 4.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 H 8.23 4.16 0.00 3.40 3.36 0.00 5.83 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 V 7.94 3.62 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 1.02 0.00 0.00 82 L 8.24 3.94 0.00 1.86 1.86 0.93 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 83 L 7.91 4.02 0.00 2.00 1.74 0.98 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 84 A 7.85 4.05 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 85 K 8.31 3.95 0.00 2.00 1.88 0.00 1.68 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 1.46 1.64 7.81 86 L 8.32 4.01 0.00 1.83 1.74 1.02 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 87 E 8.12 4.20 0.00 2.13 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.18 0.00 88 E 7.89 3.96 0.00 2.10 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 2.33 2.36 0.00 89 K 7.85 4.32 0.00 1.92 1.82 0.00 1.81 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.63 7.81 90 G 8.08 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 2.23 2.38 0.00 99 N 8.28 4.61 0.00 2.73 2.91 0.00 0.00 6.81 7.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 I 8.37 4.60 1.83 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 1.07 1.28 0.89 0.00 0.00 101 D 8.03 4.49 0.00 2.81 2.87 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 0.00 102 R 8.05 4.28 0.00 2.05 2.06 0.00 3.59 0.00 0.00 3.49 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.69 0.00 103 L 8.59 3.97 0.00 1.43 1.17 0.88 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 104 H 8.02 4.26 0.00 3.19 3.35 0.00 5.62 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 Q 8.04 4.22 0.00 2.15 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.91 0.00 0.00 0.00 0.00 0.00 2.46 2.53 0.00 106 R 7.82 3.98 0.00 1.92 1.98 0.00 3.14 0.00 0.00 3.23 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.83 0.00 107 A 7.51 4.37 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 0.00 108 G 7.77 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 0.00 109 S 7.80 4.46 0.00 4.08 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 0.00 110 K 9.52 4.08 0.00 1.71 1.85 0.00 1.69 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.37 7.81 111 K 8.35 4.36 0.00 1.98 1.70 0.00 1.57 0.00 0.00 1.56 0.00 0.00 2.75 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.36 1.62 7.81 112 V 8.09 4.77 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 0.88 0.00 0.00 0.94 0.00 0.00 113 I 9.15 4.26 1.83 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 0.60 0.88 0.00 0.00 114 E 8.63 4.63 0.00 1.90 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 0.00 2.34 2.32 0.00 115 L 8.62 3.96 0.00 1.43 1.56 0.81 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 116 H 7.95 4.80 0.00 3.15 3.02 0.00 5.71 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 G 8.71 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 N 8.30 4.97 0.00 2.78 3.02 0.00 0.00 6.85 7.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 V 8.28 4.18 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 0.75 0.00 0.00 1.06 0.00 0.00 120 E 8.98 4.64 0.00 2.10 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 0.00 2.36 2.35 0.00 121 E 8.36 5.07 0.00 1.96 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 2.41 2.41 0.00 122 Y 9.15 5.32 0.00 3.20 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 Y 8.64 5.61 0.00 3.41 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 0.00 124 C 9.45 4.75 0.00 3.27 3.15 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 0.00 125 V 8.94 3.84 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 1.09 0.00 0.00 126 R 7.42 4.16 0.00 1.80 1.89 0.00 3.31 0.00 0.00 3.30 7.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.72 0.00 127 C 7.96 4.34 0.00 3.17 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 E 8.39 4.21 0.00 2.24 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 2.25 2.32 0.00 129 K 8.04 4.06 0.00 1.93 1.91 0.00 1.83 0.00 0.00 1.99 0.00 0.00 2.88 0.00 0.00 2.51 0.00 0.00 0.00 0.00 1.13 1.37 7.81 130 K 8.55 4.92 0.00 1.64 1.76 0.00 1.76 0.00 0.00 1.73 0.00 0.00 2.91 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.50 1.49 7.81 131 Y 9.43 4.96 0.00 2.98 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 T 9.01 5.04 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 133 V 8.59 3.42 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 0.92 0.00 0.00 1.14 0.00 0.00 134 E 8.10 3.87 0.00 2.01 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.36 0.00 135 D 7.88 4.34 0.00 3.05 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 0.00 136 V 7.45 3.31 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.43 0.00 0.00 137 I 7.16 3.29 1.69 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.12 -0.10 0.66 0.00 0.00 138 K 7.91 4.00 0.00 1.87 1.91 0.00 1.61 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.39 1.43 7.81 139 K 8.02 3.95 0.00 1.80 1.69 0.00 1.41 0.00 0.00 1.42 0.00 0.00 2.81 0.00 0.00 2.40 0.00 0.00 0.00 0.00 1.36 1.53 7.81 140 L 7.57 5.01 0.00 1.69 1.70 1.07 0.59 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 0.00 141 E 7.93 4.28 0.00 2.00 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 2.29 2.57 0.00 142 S 7.09 4.70 0.00 3.85 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 0.00 143 S 7.34 4.52 0.00 3.77 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 D 8.73 4.57 0.00 2.70 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 0.00 145 V 7.25 4.26 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 0.81 0.00 0.00 0.97 0.00 0.00 146 P 0.00 4.29 0.00 1.87 1.81 0.00 3.25 0.00 0.00 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.17 0.00 147 L 8.13 5.15 0.00 1.46 1.68 0.97 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 148 C 9.15 4.30 0.00 3.05 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 0.00 149 D 9.29 4.65 0.00 2.85 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 0.00 150 D 8.31 4.65 0.00 2.73 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 0.00 151 C 7.75 4.68 0.00 3.08 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 0.00 152 N 8.22 4.77 0.00 2.85 2.91 0.00 0.00 7.38 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 S 7.35 4.62 0.00 4.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 L 8.43 4.46 0.00 1.80 1.61 1.04 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 155 I 8.50 4.94 1.89 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.57 1.01 0.00 0.00 156 R 9.12 5.31 0.00 1.39 2.20 0.00 3.01 0.00 0.00 3.21 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.50 0.00 157 P 0.00 3.72 0.00 1.77 1.94 0.00 3.11 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.75 0.00 158 N 8.32 5.04 0.00 3.04 2.83 0.00 0.00 6.89 7.86 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 0.00 159 I 7.14 4.82 1.59 0.00 0.00 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.06 0.79 0.00 0.00 160 V 8.20 4.17 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 0.70 0.00 0.00 0.91 0.00 0.00 161 F 9.19 4.44 0.00 2.99 3.11 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 0.00 162 F 9.09 4.21 0.00 3.40 3.03 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 0.00 163 G 9.33 4.10 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 0.00 0.00 0.00 164 E 7.49 4.75 0.00 2.03 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.33 0.00 165 N 8.43 4.64 0.00 2.79 2.76 0.00 0.00 6.99 7.85 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 0.00 166 L 8.13 4.37 0.00 1.63 1.60 0.94 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 167 P 0.00 4.30 0.00 2.24 2.19 0.00 3.84 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.04 0.00 168 Q 8.76 4.00 0.00 2.08 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.95 0.00 0.00 0.00 0.00 0.00 2.46 2.41 0.00 169 D 8.05 4.31 0.00 2.67 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 0.00 170 A 7.88 3.98 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 0.00 171 L 8.05 3.86 0.00 1.94 1.67 0.93 0.83 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 0.00 172 R 8.25 3.89 0.00 2.07 1.96 0.00 3.18 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.84 0.00 173 E 8.38 3.90 0.00 2.12 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 0.00 2.29 2.31 0.00 174 A 8.13 3.95 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 0.00 175 I 8.12 3.71 2.01 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 1.44 0.72 0.90 0.00 0.00 176 G 8.34 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 0.00 0.00 0.00 177 L 8.06 4.03 0.00 1.81 1.71 0.90 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 178 S 8.40 4.13 0.00 3.93 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 0.00 179 S 8.11 4.14 0.00 4.01 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 0.00 180 R 7.64 4.21 0.00 1.79 2.01 0.00 3.16 0.00 0.00 3.39 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00 181 A 7.47 4.24 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 0.00 182 S 8.89 4.52 0.00 3.90 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 0.00 183 L 7.70 5.13 0.00 1.73 1.49 1.01 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 184 M 9.30 5.18 0.00 2.10 1.84 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.46 0.00 185 I 8.70 4.98 1.94 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.68 0.92 0.00 0.00 186 V 8.98 4.48 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 0.84 0.00 0.00 0.87 0.00 0.00 187 L 8.81 4.78 0.00 1.51 1.46 0.93 0.37 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 0.00 188 G 9.35 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 0.00 189 S 7.80 4.95 0.00 3.86 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 0.00 190 S 8.73 4.32 0.00 4.04 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 0.00 191 L 7.56 3.63 0.00 2.01 1.96 1.02 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 192 V 7.78 4.43 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.99 0.00 0.00 193 V 7.66 4.45 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 1.14 0.00 0.00 194 Y 8.74 4.82 0.00 3.02 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 0.00 195 P 0.00 4.70 0.00 2.26 2.38 0.00 3.78 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.00 0.00 196 A 8.11 3.90 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 0.00 197 A 7.70 3.76 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 198 E 7.87 3.94 0.00 2.19 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 2.48 2.53 0.00 199 L 7.69 3.90 0.00 1.65 1.63 0.85 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 200 P 0.00 4.14 0.00 1.73 1.93 0.00 3.33 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.99 0.00 201 L 7.33 3.82 0.00 1.35 1.73 1.01 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 202 I 7.58 3.67 1.99 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.73 0.91 0.00 0.00 203 T 7.67 4.14 4.35 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 1.25 0.00 0.00 204 V 7.57 3.92 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 1.35 0.00 0.00 0.98 0.00 0.00 205 R 8.07 4.00 0.00 1.86 1.99 0.00 3.39 0.00 0.00 3.24 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.84 0.00 206 S 7.79 4.43 0.00 3.99 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 207 G 7.64 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 0.00 208 G 8.44 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 0.00 209 K 8.94 4.80 0.00 1.68 1.74 0.00 1.62 0.00 0.00 1.59 0.00 0.00 2.77 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.38 1.37 7.81 210 L 8.36 5.22 0.00 1.72 1.49 0.89 0.73 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 0.00 211 V 9.07 4.96 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 1.08 0.00 0.00 1.21 0.00 0.00 212 I 8.86 4.83 1.87 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.58 0.89 0.00 0.00 213 V 8.55 4.62 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 0.32 0.00 0.00 -0.56 0.00 0.00 214 N 8.68 4.77 0.00 2.74 2.56 0.00 0.00 6.49 6.03 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 0.00 215 L 8.73 4.63 0.00 1.67 1.58 0.93 1.08 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 0.00 216 G 7.92 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 0.00 0.00 0.00 0.00 217 E 8.17 4.43 0.00 2.20 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.28 0.00 218 T 8.86 4.76 4.47 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 1.23 0.00 0.00 219 P 0.00 4.19 0.00 1.47 1.86 0.00 3.71 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.04 0.00 220 F 7.80 4.98 0.00 3.02 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 0.00 221 D 8.06 4.47 0.00 2.65 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 0.00 222 D 8.18 4.39 0.00 2.79 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 0.00 223 I 7.52 4.18 1.93 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.78 1.01 0.00 0.00 224 A 7.59 4.43 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 0.00 225 T 8.80 4.21 4.39 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 1.25 0.00 0.00 226 L 7.80 4.70 0.00 1.70 1.48 1.21 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 227 K 8.46 4.78 0.00 1.65 1.56 0.00 1.81 0.00 0.00 1.85 0.00 0.00 2.79 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.26 1.43 7.81 228 Y 9.23 4.29 0.00 2.62 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 0.00 229 N 8.90 6.00 0.00 2.72 2.75 0.00 0.00 7.15 7.65 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 0.00 230 M 7.76 4.75 0.00 2.10 2.06 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.63 0.00 231 D 8.64 4.40 0.00 2.78 2.60 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 0.00 232 V 8.53 3.62 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 1.04 0.00 0.00 0.87 0.00 0.00 233 V 7.83 3.58 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.96 0.00 0.00 234 E 8.76 3.90 0.00 2.13 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.38 0.00 235 F 8.27 3.93 0.00 3.07 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 0.00 236 A 8.37 3.79 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 0.00 237 R 8.18 3.78 0.00 1.94 2.06 0.00 3.08 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.64 0.00 238 R 7.79 3.83 0.00 1.75 1.79 0.00 3.30 0.00 0.00 3.07 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.73 0.00 239 V 7.46 3.38 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 1.08 0.00 0.00 0.03 0.00 0.00 240 M 7.96 4.04 0.00 2.24 2.17 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.55 0.00 241 E 8.13 3.91 0.00 2.08 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 2.43 2.46 0.00 242 E 8.31 4.02 0.00 1.98 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 2.42 2.39 0.00 243 G 8.16 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 0.00 244 G 7.50 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 245 I 7.95 4.22 1.85 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 1.29 0.64 0.91 0.00 0.00 246 S 8.75 4.05 0.00 3.98 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.