NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 N 4.7101 8.2827 119.2177 53.7163 40.8742 176.2035 4 I 3.6492 7.7517 117.5927 63.1010 38.3200 176.0214 5 Q 4.3193 9.0935 120.5452 58.9692 29.6541 178.1326 6 K 4.0874 7.6364 115.4324 58.9884 32.4525 177.8779 7 R 4.4462 8.2932 116.9412 56.4476 30.8175 175.7468 8 F 4.8496 8.0462 118.5508 55.9278 39.7963 174.5256 9 Y 3.5792 9.1649 128.1593 58.4527 38.6110 175.8335 10 K 3.6565 9.0560 126.2836 57.2568 29.7920 176.2391 11 G 3.9430 8.1047 104.7343 45.8557 0.0000 174.8487 12 R 4.8384 8.2369 118.6822 56.2398 33.0284 176.5451 13 V 5.5660 8.1764 117.4712 60.1904 35.3054 173.7744 14 A 5.0420 8.4800 128.6516 49.8668 21.8970 175.3930 15 L 4.4647 8.5932 121.8077 54.5970 43.5728 175.8134 16 N 5.5153 8.8116 119.8443 51.0607 41.6306 173.5865 17 V 5.2770 8.1550 117.9493 58.4796 36.5477 174.7723 18 L 4.7234 8.5926 121.2601 53.9236 43.1355 175.9862 19 A 4.8038 8.0457 122.5344 50.3093 20.7119 176.7318 20 N 4.3947 9.0280 119.7577 56.1885 39.5867 174.6633 21 N 4.9041 7.5056 115.2946 51.8500 40.6262 175.1687 22 I 3.2334 7.5626 120.7238 64.2268 36.9691 178.1579 23 E 3.8703 8.0365 119.6953 59.3420 29.4486 178.3039 24 N 4.3117 8.8546 117.1140 56.4880 38.9492 176.5018 25 A 4.1021 8.3775 122.5128 55.3487 18.4941 179.7535 26 K 3.9722 8.3723 117.0463 59.8474 32.0542 179.3996 27 D 4.4237 8.2108 119.1538 57.2706 40.6166 178.9033 28 I 3.7130 8.2559 120.8534 64.4009 37.1485 178.2509 29 F 4.2456 8.7107 124.1538 61.8446 39.1865 177.6913 30 E 3.8719 8.4318 117.7783 61.1149 29.3681 181.0253 31 A 4.1976 8.0876 120.9339 54.4898 18.7070 178.6680 32 A 4.2649 8.2993 117.3567 51.2514 18.7989 177.2515 33 E 3.5683 8.7647 116.0446 57.3112 27.6505 176.1491 34 G 2.8505 7.4702 105.9216 45.5137 0.0000 174.4571 35 Y 4.9756 7.5009 119.5904 55.4531 37.0974 175.0018 36 V 4.9519 7.0027 116.9319 60.7987 34.8927 175.0139 37 V 4.5864 8.6198 115.9933 59.6423 34.8108 174.6388 38 V 4.6006 8.7974 125.7229 61.0836 33.6436 174.9531 39 G 4.0332 9.2305 116.5548 45.9865 0.0000 172.4081 40 V 4.5617 8.5715 124.4341 60.8242 34.8376 174.0443 41 L 4.7651 8.3720 127.9235 53.3431 42.8732 177.8664 42 S 4.2647 9.2410 119.9337 61.2726 62.9993 176.3971 43 K 4.2810 7.2923 118.8689 58.3713 32.4837 177.3149 44 D 4.3536 7.6876 118.7634 55.3976 40.9452 175.7188 45 Y 4.7602 7.5011 117.0372 55.3329 41.1756 174.0801 46 P 4.4896 0.0000 0.0000 64.7740 32.3310 176.6472 47 T 4.7634 7.3404 107.5439 58.7040 73.1123 174.7624 48 V 3.6547 8.4880 123.5007 67.1023 31.5233 178.6752 49 E 3.9223 8.1593 117.3016 61.2969 29.5512 180.6408 50 E 4.1045 8.2344 119.2027 58.9942 29.2753 179.3145 51 A 3.3147 7.8005 120.1179 54.8290 18.5289 179.5141 52 V 3.5744 7.6715 115.8120 66.4289 31.6101 177.9755 53 T 3.9149 7.8568 115.1936 66.4718 68.2571 176.8159 54 A 3.9092 7.3881 118.3466 53.0835 17.9037 179.0657 *56 K 3.4822 8.0314 121.5118 57.4483 34.1620 178.3535 57 A 3.9123 7.4500 119.4108 55.1020 18.5920 178.8106 58 Y 4.1534 8.1179 115.4580 61.3822 38.0197 179.3748 59 G 3.9863 8.0518 107.2236 47.1674 0.0000 175.4220 60 K 4.2038 8.0148 123.5391 59.7994 32.2246 178.9769 61 E 4.2486 7.9223 117.7081 59.1142 30.2771 180.0296 62 I 4.0390 7.1261 111.5683 60.8367 37.9431 174.7244 63 D 4.3921 8.6081 114.4890 56.9221 39.6991 172.2086 64 D 4.4828 8.3498 112.6771 54.9291 39.6478 174.3339 65 A 4.6160 7.6336 119.5639 52.1453 18.4482 178.2545 66 V 4.5425 7.5414 121.6038 62.5131 34.0382 174.8624 67 S 5.1578 8.9033 123.3038 56.7368 64.0632 172.9536 68 I 4.2363 9.0485 130.2082 61.1471 37.9661 175.4835 69 G 4.3130 8.8384 114.6186 44.5464 0.0000 174.6169 70 L 3.9294 8.5056 122.6742 57.7519 42.1590 177.2292 71 G 4.1436 8.5046 109.7558 46.9597 0.0000 173.0435 72 A 3.7391 9.0244 132.8331 53.1201 16.3765 177.8096 73 G 3.7205 8.1892 103.6011 47.1987 0.0000 173.4863 74 D 4.3445 8.0311 120.2276 54.2653 40.8982 176.9187 75 N 4.6199 8.7612 124.6548 54.7556 37.8565 177.2299 76 R 4.0014 8.1550 117.8950 58.6503 30.3226 177.2606 77 Q 4.3250 8.0887 115.7873 56.0902 29.5152 177.4727 78 A 4.1032 7.9665 121.0332 55.2711 18.3654 179.6856 79 A 3.9417 7.9683 118.7742 55.0875 18.3981 179.9006 80 V 3.5083 7.7184 116.3466 66.2575 31.8402 178.3093 81 V 3.5838 8.1625 118.1024 65.8973 31.1106 177.7482 82 A 4.0157 8.0202 119.7975 55.2343 18.5028 179.2039 83 E 4.0683 8.2527 117.0832 59.5818 29.4734 179.3707 84 I 3.7805 8.1479 119.9672 64.5839 36.9861 178.2029 85 A 4.2927 7.7027 121.2609 54.1745 18.1782 179.4681 86 K 4.4987 7.7369 117.8352 58.4822 32.0637 177.4987 87 H 4.9113 8.2297 114.4802 56.0219 31.3788 173.7690 88 Y 4.8368 7.6913 120.0145 56.3199 41.5071 174.9714 89 S 4.2774 8.0980 121.1398 57.5627 64.8525 176.0095 90 G 3.4673 5.4708 109.0518 46.8493 0.0000 172.6704 91 S 4.7256 8.4824 112.4864 59.1332 65.8092 173.9180 92 H 5.2460 7.9233 118.6334 54.8312 33.4891 172.0617 93 I 4.9117 8.8761 125.5645 59.6026 40.7620 174.0923 94 N 5.2508 9.0132 125.2707 52.7391 39.3772 174.5296 95 Q 4.6491 9.2336 123.6324 54.5987 33.4190 174.4954 96 V 4.2205 8.8513 117.7913 60.6522 32.8573 177.0854 97 F 4.2710 9.0635 124.7067 60.3526 39.0669 175.6731 98 P 4.5282 0.0000 0.0000 63.9931 31.6675 177.0275 99 S 4.6292 8.0807 115.1820 58.4439 63.1900 175.7925 100 V 3.6133 7.4811 122.8503 65.9602 31.2142 178.1425 101 G 3.4921 7.9052 104.6750 47.7477 0.0000 175.2904 102 A 3.9859 7.8987 122.9265 55.1034 18.5476 179.7948 103 T 3.7786 7.8206 114.0884 66.6954 68.3532 176.9212 104 R 3.8376 7.9868 119.3519 59.4064 30.3815 177.9720 105 A 4.1193 8.1372 120.5338 55.4206 18.4322 179.4376 106 N 4.3181 8.4483 114.8467 56.1363 38.4913 177.4899 107 L 4.2223 7.9937 120.2596 55.3251 41.5481 177.5258 108 G 4.0036 8.9751 106.5170 46.4881 0.0000 174.8425 109 G 3.9696 8.4454 107.6324 44.7257 0.0000 174.9412 110 K 4.0355 7.6009 119.4777 56.1313 32.5580 176.2240 111 D 4.4551 8.5195 122.8052 54.3085 41.5657 175.0457 112 S 4.6594 8.2597 119.5025 57.4324 65.9454 172.7012 113 W 4.8199 8.5382 131.7227 55.5878 32.8435 174.3381 114 I 5.0503 8.0120 127.4920 59.5114 39.6021 175.0057 115 N 5.1780 8.9154 124.9578 51.1557 39.6303 174.4418 116 S 4.7758 8.5251 112.9053 56.1738 65.3162 172.6581 117 L 4.6685 8.9960 131.0274 55.4257 42.3959 176.4835 118 V 4.8997 9.1547 118.9820 59.8410 36.3175 174.7828 119 S 5.2025 8.6381 117.5111 54.7803 66.7831 172.2258 120 P 4.9613 0.0000 0.0000 63.2889 31.4262 176.4316 121 T 4.4233 9.1309 109.9445 60.2611 70.0315 175.2916 122 G 3.8426 8.6361 109.5134 45.4197 0.0000 173.3295 123 K 4.3494 7.9808 121.1424 53.7377 33.1138 175.3866 124 V 3.8321 8.3661 126.5584 64.6534 31.9258 176.2350 125 G 4.0013 9.6280 115.1273 45.0362 0.0000 171.9422 126 Y 5.2444 7.8295 116.1814 56.1899 41.5192 175.3730 127 V 4.7885 8.9234 115.5148 59.5485 36.3493 174.2714 128 N 5.1149 9.1050 123.0205 52.9481 39.5741 175.1539 129 I 3.8831 8.2584 119.5663 60.3447 38.5200 176.9857 130 S 4.4987 8.2617 122.8866 58.0301 61.1188 174.5859 131 T 4.5998 7.7059 106.9831 61.1720 69.9029 175.9280 132 G 4.0443 7.9768 110.7210 43.0837 0.0000 173.1191 133 P 4.5226 0.0000 0.0000 65.6366 31.3942 178.3770 134 I 3.9641 7.7044 119.8233 63.6573 37.3513 178.3689 135 S 4.1406 8.0576 114.5438 61.4082 62.7583 176.0078 136 A 4.3040 8.6142 124.1459 53.1523 18.2883 178.5655 137 A 4.2945 7.5846 118.2381 52.4409 19.1633 178.1795 138 G 3.7570 7.0635 106.1829 45.3737 0.0000 174.1590 139 E 4.1432 8.6573 120.3333 57.8297 29.9382 176.9219 140 E 4.8058 7.9031 116.4527 54.2227 33.1252 174.9321 141 K 4.5043 8.2518 119.0200 54.2883 35.3073 176.2215 142 A 4.2166 8.9093 124.0078 51.9211 19.1209 176.8617 143 I 4.8662 8.3326 123.5368 60.5924 38.7419 175.8788 144 V 4.7530 8.7310 120.1697 58.4319 36.3307 174.0403 145 P 4.0478 0.0000 0.0000 62.4559 32.1771 177.4964 146 I 3.6184 8.1675 123.6146 64.9163 37.0996 179.1435 147 K 3.9651 7.8757 118.4513 59.3364 31.9085 179.4049 148 T 3.8715 7.8024 110.0113 64.5256 68.6051 176.6744 149 A 4.0448 7.8464 123.1683 54.9322 18.4257 179.3485 150 I 3.2313 7.7535 118.1038 64.4161 37.1256 178.5018 151 A 3.8314 7.8945 121.3790 55.0459 17.9552 179.6519 152 L 3.9282 7.6264 116.3605 57.9794 41.9560 179.5922 153 V 3.5771 8.0777 118.3702 65.9534 31.2174 178.2611 154 R 3.9434 7.8744 117.1769 59.1120 30.0230 180.2233 155 D 4.6259 7.8888 117.7928 53.9719 40.8530 177.3699 *157 G 3.7793 7.9736 105.7577 45.0609 0.0000 173.9718 158 G 3.8926 8.1075 108.6084 44.8445 0.0000 173.9349 159 N 4.4846 8.4736 116.3501 52.9417 40.2685 174.5775 160 S 3.8563 7.1868 111.6707 57.0783 66.6176 173.3202 161 L 5.0604 8.5259 121.0606 53.5744 43.4638 175.8343 162 K 4.8348 9.1026 126.3607 55.4776 33.6509 174.7952 163 Y 5.3254 8.8663 130.9818 56.7963 39.7664 173.9584 164 F 5.2100 8.8985 128.3531 57.0534 43.5513 172.2134 165 P 3.5439 0.0000 0.0000 60.3066 33.9957 175.1006 *167 K 4.0530 8.0920 114.8187 56.7828 34.3691 177.8338 168 G 3.7879 8.1037 115.9883 47.2313 0.0000 174.3291 169 L 4.5687 8.5773 123.5747 54.0527 41.7682 177.7609 170 A 4.1760 7.8955 124.7088 54.7846 18.5209 178.6478 171 H 5.0110 7.5083 114.1605 55.0524 29.9255 176.1416 172 E 4.0873 8.5687 121.3963 59.5811 29.5284 176.8316 173 E 3.9650 8.2869 118.6671 59.5026 29.6603 178.5154 174 E 4.0440 8.2718 117.9708 59.6043 29.5761 178.5105 175 Y 4.1425 8.6458 119.9739 60.8471 38.8744 178.1850 176 R 3.6121 8.4508 119.1589 59.2462 30.1577 178.9409 177 A 3.9046 7.7839 120.1485 54.9081 18.2878 179.7975 178 V 3.3266 7.7428 116.6212 66.0003 31.4479 178.0948 179 A 3.7696 7.8238 120.7777 54.9096 18.1063 179.4369 180 K 3.7310 7.9991 117.8954 59.6168 32.2502 178.8978 181 A 3.9219 7.9724 120.9432 55.3396 18.2024 179.4118 182 C 4.1561 8.3544 115.3186 62.8170 28.1611 176.1999 183 A 3.9720 8.2209 122.5706 55.3285 17.7795 179.5727 184 E 3.9604 8.2010 115.9207 58.8934 29.5942 178.4560 185 E 4.4922 8.0084 115.7439 55.0546 30.0295 176.1496 186 G 3.9161 7.7258 106.5973 46.6256 0.0000 173.3643 187 F 5.1037 8.3465 120.7176 55.9494 41.8367 174.9593 188 A 4.6862 7.0236 125.9691 51.4226 20.5949 176.1115 189 L 5.1226 8.6919 120.0253 53.6729 46.1482 175.2961 190 E 5.8904 9.7654 125.6201 52.3936 31.0852 172.0796 191 P 4.8869 0.0000 0.0000 63.0728 32.5632 175.7551 192 T 4.7327 9.1923 119.4795 62.9858 73.6530 173.5919 193 G 3.9787 9.6957 114.4439 46.8793 0.0000 174.0304 194 G 3.9280 8.8532 113.2583 45.6239 0.0000 172.2032 195 I 4.2306 7.5854 120.3820 60.5630 38.0559 174.8838 196 D 5.1663 9.2903 123.2821 49.6873 42.5296 176.2080 197 K 4.1352 8.7396 119.8085 59.7827 31.8625 179.3894 198 E 4.3224 8.3797 117.9129 59.5466 30.3527 182.1055 199 N 5.0668 8.6195 114.9406 52.6601 38.0125 176.4616 200 F 4.0618 8.1075 123.9928 61.6302 39.4817 176.3217 201 E 3.9520 8.4090 118.2824 59.7497 29.4761 178.7883 202 T 3.9131 7.8676 115.1235 66.6977 68.2663 176.6308 203 I 3.8176 7.8185 121.7458 64.3226 37.1170 178.3340 204 L 3.9084 7.9808 121.6168 57.9313 41.8667 178.8657 205 R 3.7618 8.3585 119.1988 59.3209 30.0873 178.4778 206 I 3.5789 7.9403 119.4235 64.3181 37.1087 178.2768 207 A 3.8211 7.5565 120.1053 55.1572 18.2572 179.7628 208 L 3.8589 7.9428 119.9936 58.3914 41.3888 180.2039 209 E 3.6581 7.8498 117.6109 60.7658 29.7093 180.8218 210 A 4.2103 7.5025 119.0446 52.4425 18.6338 176.7121 211 N 4.1972 7.8569 114.6064 54.3357 37.6371 174.4676 212 V 3.6986 7.4986 116.5604 62.4168 32.3616 175.3247 213 E 4.0567 9.0130 128.2604 58.7312 30.2353 176.0083 214 Q 4.9017 7.9282 117.1488 53.9446 32.5107 174.5471 215 V 4.9638 9.1745 123.6369 61.3221 35.3914 174.3704 216 I 5.2320 9.1229 128.0522 57.5850 39.1165 172.1243 217 P 4.9100 0.0000 0.0000 62.8561 32.8780 174.8521 218 H 5.3039 8.8356 120.7373 54.2241 30.1323 174.5453 219 V 4.1154 8.8299 122.9172 62.8020 34.3715 174.2857 220 Y 4.7813 8.8299 125.6013 58.2422 37.9316 178.5569 221 S 4.3111 9.5918 129.5440 61.6129 64.0350 177.0749 222 S 4.2768 8.2679 115.7450 60.1480 63.1071 175.2327 223 I 4.7929 7.6820 113.2434 59.5740 37.5657 174.3183 224 I 4.6616 7.3162 121.7684 59.7045 38.5211 175.1053 225 D 4.3507 9.1349 128.2098 54.7800 41.2621 177.8901 226 K 3.9979 8.8348 131.2941 58.1633 32.2350 175.4212 227 E 4.2318 8.4645 113.7232 59.0776 29.9131 181.3856 228 T 4.1868 8.3223 108.4484 61.4878 69.5256 176.1407 229 G 3.9566 8.3741 109.6223 45.1065 0.0000 173.1774 230 N 4.6090 7.8536 118.0254 52.5990 39.3290 174.8903 231 T 4.3253 7.6389 117.3474 63.5426 69.2519 174.2909 232 K 4.2688 9.0063 127.0181 55.9496 32.8258 178.3716 233 T 3.9485 8.6022 115.5775 64.6836 68.7962 176.4471 234 E 3.9358 8.1418 120.0831 59.3461 29.2724 178.8453 235 D 4.2786 7.9630 119.3638 57.0049 40.9190 178.5246 236 V 3.5193 7.7617 118.7760 66.1383 31.5161 178.2598 237 R 3.8485 8.2652 118.0544 59.1746 29.9660 178.6512 238 E 3.8861 8.1111 119.0459 59.2332 29.5481 178.9041 239 L 3.5289 7.9304 119.2074 57.5210 41.5050 179.2296 240 L 3.8332 8.0774 120.2700 57.9664 41.9961 178.7932 241 A 3.8842 8.0115 120.7652 55.0848 18.2091 179.7665 242 V 3.5735 7.6317 116.1756 66.0903 31.6112 178.1719 243 V 3.6693 8.0974 118.2238 66.2546 31.2386 178.1932 244 K 3.4861 8.0019 118.1519 58.9948 31.6645 179.2354 245 K 3.9055 8.0733 119.9006 59.5968 32.1548 178.9148 246 L 4.1547 8.2536 119.3988 57.8484 41.4061 179.6337 247 V 3.7875 8.1444 117.5612 66.1552 31.5724 177.4178 248 D 4.5607 8.3791 118.1282 57.4293 40.6972 178.3345 249 Q 3.9400 7.7010 119.4072 58.5805 29.1480 175.9459 250 Y 4.4429 7.9110 121.0741 58.0487 38.3446 175.3648 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 3 N 8.28 4.71 0.00 2.85 2.90 0.00 0.00 6.70 6.93 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 4 I 7.75 3.65 2.04 0.00 0.00 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 1.31 1.04 0.00 0.00 5 Q 9.09 4.32 0.00 2.21 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.98 6.65 0.00 0.00 0.00 0.00 0.00 2.58 2.41 0.00 6 K 7.64 4.09 0.00 1.98 1.92 0.00 1.73 0.00 0.00 1.74 0.00 0.00 3.07 0.00 0.00 3.26 0.00 0.00 0.00 0.00 1.52 1.47 7.81 7 R 8.29 4.45 0.00 1.52 1.82 0.00 3.32 0.00 0.00 3.47 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.62 0.00 8 F 8.05 4.85 0.00 3.04 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 9 Y 9.16 3.58 0.00 2.19 2.75 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 10 K 9.06 3.66 0.00 1.44 1.59 0.00 1.55 0.00 0.00 1.50 0.00 0.00 2.82 0.00 0.00 2.84 0.00 0.00 0.00 0.00 0.88 0.21 7.81 11 G 8.10 3.94 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 0.00 0.00 0.00 12 R 8.24 4.84 0.00 1.79 1.99 0.00 3.24 0.00 0.00 3.18 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.55 0.00 13 V 8.18 5.57 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 1.26 0.00 0.00 1.03 0.00 0.00 14 A 8.48 5.04 0.41 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 15 L 8.59 4.46 0.00 1.64 1.60 0.88 0.36 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 16 N 8.81 5.52 0.00 2.46 2.28 0.00 0.00 6.85 7.76 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 17 V 8.16 5.28 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.96 0.00 0.00 18 L 8.59 4.72 0.00 1.47 1.47 0.48 0.27 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 19 A 8.05 4.80 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 20 N 9.03 4.39 0.00 2.82 2.99 0.00 0.00 6.91 7.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 N 7.51 4.90 0.00 2.94 2.89 0.00 0.00 6.74 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 22 I 7.56 3.23 1.57 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.15 -0.36 0.70 0.00 0.00 23 E 8.04 3.87 0.00 2.04 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 0.00 2.37 2.43 0.00 24 N 8.85 4.31 0.00 3.11 3.00 0.00 0.00 7.11 9.23 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 25 A 8.38 4.10 1.57 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 0.00 0.00 26 K 8.37 3.97 0.00 1.97 1.90 0.00 1.65 0.00 0.00 1.60 0.00 0.00 3.03 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.69 7.81 27 D 8.21 4.42 0.00 2.88 2.73 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 28 I 8.26 3.71 2.10 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 0.87 0.97 0.00 0.00 29 F 8.71 4.25 0.00 3.20 3.22 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 30 E 8.43 3.87 0.00 2.03 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.20 0.00 31 A 8.09 4.20 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 32 A 8.30 4.26 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 33 E 8.76 3.57 0.00 2.18 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 2.20 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 K 7.29 4.28 0.00 1.90 2.09 0.00 1.74 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.47 1.36 7.81 44 D 7.69 4.35 0.00 2.51 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 Y 7.50 4.76 0.00 3.00 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 46 P 0.00 4.49 0.00 2.20 2.19 0.00 3.86 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 2.43 1.98 0.00 47 T 7.34 4.76 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 1.27 0.00 0.00 48 V 8.49 3.65 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 1.15 0.00 0.00 0.96 0.00 0.00 49 E 8.16 3.92 0.00 2.01 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 2.32 1.98 0.00 50 E 8.23 4.10 0.00 2.23 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.47 0.96 0.00 0.00 69 G 8.84 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 L 8.51 3.93 0.00 1.70 1.89 0.93 1.10 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 71 G 8.50 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 A 9.02 3.74 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 73 G 8.19 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 0.00 0.00 0.00 74 D 8.03 4.34 0.00 2.84 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 N 8.76 4.62 0.00 3.03 3.17 0.00 0.00 6.21 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 R 8.16 4.00 0.00 1.99 2.05 0.00 3.16 0.00 0.00 3.24 7.38 0.00 0.00 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0.00 0.00 85 A 7.70 4.29 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 86 K 7.74 4.50 0.00 1.48 1.64 0.00 1.67 0.00 0.00 1.50 0.00 0.00 3.00 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.41 1.28 7.81 87 H 8.23 4.91 0.00 3.16 3.33 0.00 5.65 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 88 Y 7.69 4.84 0.00 2.97 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 89 S 8.10 4.28 0.00 3.88 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 90 G 5.47 3.47 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 0.00 91 S 8.48 4.73 0.00 3.74 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 92 H 7.92 5.25 0.00 3.15 3.06 0.00 5.80 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 I 8.88 4.91 1.88 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 1.23 0.63 0.93 0.00 0.00 94 N 9.01 5.25 0.00 2.76 2.79 0.00 0.00 6.76 7.28 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 95 Q 9.23 4.65 0.00 2.14 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.96 0.00 0.00 0.00 0.00 0.00 2.24 2.39 0.00 96 V 8.85 4.22 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 97 F 9.06 4.27 0.00 3.34 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 P 0.00 4.53 0.00 2.29 2.32 0.00 3.90 0.00 0.00 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.11 0.00 99 S 8.08 4.63 0.00 4.02 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 0.00 100 V 7.48 3.61 1.87 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 1.01 0.00 0.00 0.99 0.00 0.00 101 G 7.91 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 A 7.90 3.99 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 0.00 103 T 7.82 3.78 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 1.20 0.00 0.00 104 R 7.99 3.84 0.00 1.72 2.05 0.00 3.29 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.67 0.00 105 A 8.14 4.12 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 0.00 106 N 8.45 4.32 0.00 2.94 2.85 0.00 0.00 7.06 7.35 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 0.00 107 L 7.99 4.22 0.00 1.88 1.84 0.90 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 108 G 8.98 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 0.00 109 G 8.45 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 K 7.60 4.04 0.00 1.77 1.73 0.00 1.68 0.00 0.00 1.63 0.00 0.00 2.70 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.46 1.55 7.81 111 D 8.52 4.46 0.00 2.63 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 0.00 112 S 8.26 4.66 0.00 3.85 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 0.00 113 W 8.54 4.82 0.00 3.66 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 I 8.01 5.05 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 1.39 0.49 0.88 0.00 0.00 115 N 8.92 5.18 0.00 2.83 3.23 0.00 0.00 6.62 8.33 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 0.00 116 S 8.53 4.78 0.00 3.96 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 0.00 117 L 9.00 4.67 0.00 1.95 1.70 0.97 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 118 V 9.15 4.90 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 1.02 0.00 0.00 1.17 0.00 0.00 119 S 8.64 5.20 0.00 3.72 3.59 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 0.00 120 P 0.00 4.96 0.00 1.48 1.66 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 1.62 1.05 0.00 121 T 9.13 4.42 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 1.35 0.00 0.00 122 G 8.64 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 K 7.98 4.35 0.00 1.71 1.69 0.00 1.31 0.00 0.00 0.66 0.00 0.00 2.13 0.00 0.00 2.53 0.00 0.00 0.00 0.00 1.15 1.17 7.81 124 V 8.37 3.83 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 0.87 0.00 0.00 0.99 0.00 0.00 125 G 9.63 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 0.00 126 Y 7.83 5.24 0.00 2.98 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 0.00 127 V 8.92 4.79 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 0.83 0.00 0.00 0.94 0.00 0.00 128 N 9.10 5.11 0.00 2.84 2.83 0.00 0.00 7.04 8.82 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 0.00 129 I 8.26 3.88 0.56 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.42 0.41 0.00 0.00 130 S 8.26 4.50 0.00 4.01 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 0.00 131 T 7.71 4.60 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 1.33 0.00 0.00 132 G 7.98 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 0.00 133 P 0.00 4.52 0.00 2.26 2.31 0.00 3.41 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.06 0.00 134 I 7.70 3.96 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 1.71 0.96 0.93 0.00 0.00 135 S 8.06 4.14 0.00 4.07 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 0.00 136 A 8.61 4.30 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 0.00 137 A 7.58 4.29 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 0.00 138 G 7.06 3.76 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 0.00 0.00 0.00 139 E 8.66 4.14 0.00 1.97 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.33 0.00 140 E 7.90 4.81 0.00 1.89 1.79 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 2.19 2.22 0.00 141 K 8.25 4.50 0.00 1.69 1.83 0.00 1.76 0.00 0.00 1.71 0.00 0.00 3.10 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.32 1.32 7.81 142 A 8.91 4.22 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 I 8.33 4.87 1.86 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 1.52 0.93 0.93 0.00 0.00 144 V 8.73 4.75 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 0.75 0.00 0.00 0.86 0.00 0.00 145 P 0.00 4.05 0.00 1.98 1.57 0.00 3.57 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 2.01 1.83 0.00 146 I 8.17 3.62 1.75 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 1.42 0.86 0.84 0.00 0.00 147 K 7.88 3.97 0.00 1.70 1.77 0.00 1.59 0.00 0.00 1.92 0.00 0.00 2.96 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.44 1.40 7.81 148 T 7.80 3.87 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 1.15 0.00 0.00 149 A 7.85 4.04 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 0.00 150 I 7.75 3.23 1.77 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 1.27 0.78 -0.00 0.00 0.00 151 A 7.89 3.83 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 0.00 152 L 7.63 3.93 0.00 2.07 1.94 1.08 0.98 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 0.00 153 V 8.08 3.58 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 1.17 0.00 0.00 154 R 7.87 3.94 0.00 1.81 1.91 0.00 2.94 0.00 0.00 3.12 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.39 0.00 155 D 7.89 4.63 0.00 2.76 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *157 G 7.97 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 G 8.11 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 0.00 159 N 8.47 4.48 0.00 1.44 1.42 0.00 0.00 6.89 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 0.00 160 S 7.19 3.86 0.00 3.98 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 0.00 161 L 8.53 5.06 0.00 1.82 1.83 1.02 1.20 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 0.00 162 K 9.10 4.83 0.00 1.94 1.81 0.00 1.73 0.00 0.00 1.55 0.00 0.00 2.47 0.00 0.00 2.59 0.00 0.00 0.00 0.00 1.43 1.50 7.81 163 Y 8.87 5.33 0.00 3.21 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 0.00 164 F 8.90 5.21 0.00 3.14 2.81 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 0.00 165 P 0.00 3.54 0.00 1.51 0.49 0.00 3.49 0.00 0.00 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.51 0.00 *167 K 8.09 4.05 0.00 1.82 1.83 0.00 1.77 0.00 0.00 1.77 0.00 0.00 2.84 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.35 1.32 7.81 168 G 8.10 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 0.00 169 L 8.58 4.57 0.00 1.71 1.68 0.94 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 170 A 7.90 4.18 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 0.00 171 H 7.51 5.01 0.00 3.41 3.39 0.00 5.83 0.00 0.00 0.00 0.00 7.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 E 8.57 4.09 0.00 2.26 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 2.47 2.52 0.00 173 E 8.29 3.97 0.00 2.11 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 2.41 2.44 0.00 174 E 8.27 4.04 0.00 2.46 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.49 0.00 175 Y 8.65 4.14 0.00 3.24 3.30 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 0.00 176 R 8.45 3.61 0.00 1.99 1.89 0.00 3.19 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.83 0.00 177 A 7.78 3.90 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 178 V 7.74 3.33 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.44 0.00 0.00 179 A 7.82 3.77 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 K 8.00 3.73 0.00 1.83 1.88 0.00 1.59 0.00 0.00 1.60 0.00 0.00 2.95 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.40 7.81 181 A 7.97 3.92 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 0.00 182 C 8.35 4.16 0.00 3.10 3.27 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 0.00 183 A 8.22 3.97 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 0.00 184 E 8.20 3.96 0.00 2.04 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 2.32 2.42 0.00 185 E 8.01 4.49 0.00 1.93 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 2.37 2.36 0.00 186 G 7.73 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 0.00 187 F 8.35 5.10 0.00 2.85 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 0.00 188 A 7.02 4.69 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 189 L 8.69 5.12 0.00 1.83 1.53 1.09 0.79 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 0.00 190 E 9.77 5.89 0.00 2.04 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 2.48 2.42 0.00 191 P 0.00 4.89 0.00 1.97 2.17 0.00 3.96 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.10 0.00 192 T 9.19 4.73 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 1.00 0.00 0.00 193 G 9.70 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 G 8.85 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 0.00 195 I 7.59 4.23 2.03 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 1.43 0.54 1.09 0.00 0.00 196 D 9.29 5.17 0.00 2.82 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 0.00 197 K 8.74 4.14 0.00 1.74 2.04 0.00 2.01 0.00 0.00 1.78 0.00 0.00 2.88 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.36 1.46 7.81 198 E 8.38 4.32 0.00 2.06 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 2.21 1.93 0.00 199 N 8.62 5.07 0.00 2.97 3.08 0.00 0.00 6.54 8.98 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 0.00 200 F 8.11 4.06 0.00 3.37 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 0.00 201 E 8.41 3.95 0.00 2.20 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 2.44 2.48 0.00 202 T 7.87 3.91 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 1.25 0.00 0.00 203 I 7.82 3.82 1.72 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.20 0.69 0.00 0.00 204 L 7.98 3.91 0.00 1.05 1.32 0.85 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 205 R 8.36 3.76 0.00 2.02 2.05 0.00 3.22 0.00 0.00 3.31 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.83 0.00 206 I 7.94 3.58 2.13 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 1.45 1.13 0.54 0.00 0.00 207 A 7.56 3.82 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 0.00 208 L 7.94 3.86 0.00 1.18 1.34 0.97 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 209 E 7.85 3.66 0.00 2.02 1.87 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 2.26 2.20 0.00 210 A 7.50 4.21 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 0.00 211 N 7.86 4.20 0.00 2.85 2.93 0.00 0.00 7.10 7.20 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 0.00 212 V 7.50 3.70 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 0.84 0.00 0.00 0.94 0.00 0.00 213 E 9.01 4.06 0.00 2.07 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 0.00 2.33 2.31 0.00 214 Q 7.93 4.90 0.00 2.01 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.64 0.00 0.00 0.00 0.00 0.00 2.07 2.13 0.00 215 V 9.17 4.96 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 1.09 0.00 0.00 0.97 0.00 0.00 216 I 9.12 5.23 2.00 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 2.32 0.82 0.00 0.00 217 P 0.00 4.91 0.00 2.29 2.10 0.00 4.01 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.02 0.00 218 H 8.84 5.30 0.00 2.71 2.48 0.00 5.79 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 0.00 219 V 8.83 4.12 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 1.03 0.00 0.00 1.04 0.00 0.00 220 Y 8.83 4.78 0.00 3.03 2.39 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 0.00 221 S 9.59 4.31 0.00 4.05 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 0.00 222 S 8.27 4.28 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 0.00 223 I 7.68 4.79 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 1.44 2.03 0.92 0.00 0.00 224 I 7.32 4.66 2.01 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 1.20 0.80 0.96 0.00 0.00 225 D 9.13 4.35 0.00 2.65 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 226 K 8.83 4.00 0.00 1.82 1.72 0.00 1.86 0.00 0.00 1.74 0.00 0.00 2.94 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.36 1.01 7.81 227 E 8.46 4.23 0.00 1.98 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 1.86 0.00 228 T 8.32 4.19 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 0.00 229 G 8.37 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 0.00 230 N 7.85 4.61 0.00 2.82 2.89 0.00 0.00 6.94 6.50 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 0.00 231 T 7.64 4.33 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 1.23 0.00 0.00 232 K 9.01 4.27 0.00 1.79 1.89 0.00 1.78 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.45 1.37 7.81 233 T 8.60 3.95 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 234 E 8.14 3.94 0.00 2.16 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.33 0.00 235 D 7.96 4.28 0.00 2.93 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 0.00 236 V 7.76 3.52 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 1.08 0.00 0.00 0.98 0.00 0.00 237 R 8.27 3.85 0.00 2.00 1.93 0.00 3.16 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 1.62 1.80 0.00 238 E 8.11 3.89 0.00 2.11 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.31 0.00 239 L 7.93 3.53 0.00 1.56 0.97 0.65 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 240 L 8.08 3.83 0.00 1.76 1.74 0.88 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 241 A 8.01 3.88 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 0.00 242 V 7.63 3.57 2.46 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 1.32 0.00 0.00 1.01 0.00 0.00 243 V 8.10 3.67 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 1.00 0.00 0.00 1.21 0.00 0.00 244 K 8.00 3.49 0.00 1.60 1.59 0.00 1.52 0.00 0.00 1.31 0.00 0.00 2.58 0.00 0.00 2.76 0.00 0.00 0.00 0.00 0.30 1.07 7.81 245 K 8.07 3.91 0.00 1.92 1.99 0.00 1.65 0.00 0.00 1.66 0.00 0.00 2.98 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.46 1.50 7.81 246 L 8.25 4.15 0.00 1.83 1.89 0.97 1.25 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 0.00 247 V 8.14 3.79 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 1.16 0.00 0.00 248 D 8.38 4.56 0.00 2.89 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 0.00 249 Q 7.70 3.94 0.00 1.83 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.77 0.00 0.00 0.00 0.00 0.00 1.16 1.91 0.00 250 Y 7.91 4.44 0.00 3.04 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 * Residues marked with a * may have inaccurate shift predictions.