NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2512 7.8827 121.4537 61.2520 38.5142 173.7639 17 V 4.3841 8.7902 126.4441 61.7300 32.7798 174.4946 18 G 4.1333 8.5185 114.1720 46.7611 0.0000 173.2384 19 G 4.2573 7.7554 109.9404 44.1184 0.0000 172.5278 20 Y 4.9631 7.6442 116.4801 55.2948 42.2939 174.7691 21 T 4.2812 8.5882 117.0114 63.7902 68.3649 175.3469 22 C 4.2724 8.4318 125.1374 59.6552 35.4153 175.5585 23 G 4.0073 8.6132 105.4641 44.5987 0.0000 172.4900 24 A 4.0885 8.5483 124.8702 53.6578 18.4197 176.9385 25 N 4.2708 8.8623 119.6728 54.7372 36.0937 175.5449 26 T 4.1899 7.6085 108.2207 62.8551 69.8858 175.0932 27 V 4.1180 7.0581 122.0119 59.7885 31.3153 173.6341 28 P 4.6635 0.0000 0.0000 64.2511 31.8720 178.2544 29 Y 5.0631 7.0362 115.2406 56.7100 38.7939 174.5985 30 Q 4.6260 7.3377 123.5962 56.2683 29.5709 175.4553 31 V 4.8945 8.8659 118.7027 59.6407 36.3077 174.1658 32 S 4.9247 8.6578 116.9668 56.5825 65.0637 172.6479 33 L 4.4987 8.5119 127.6367 53.3228 42.9958 175.0390 34 N 5.7088 8.9640 122.9645 49.9574 42.1330 174.7913 *37 S 4.2028 8.3305 119.0895 58.3332 64.1006 174.5614 38 G 3.9918 10.0747 108.0160 45.8859 0.0000 172.6158 39 Y 4.4955 6.6836 114.8678 56.2583 39.8536 172.4989 40 H 4.5087 8.9058 122.0695 56.0994 30.3438 174.7414 41 F 4.9919 7.6471 120.4164 57.0734 39.8837 174.2614 42 C 4.8001 6.8130 114.7445 56.0213 44.6883 173.6514 43 G 4.2571 8.8667 109.8668 45.7186 0.0000 172.2708 44 G 4.5602 8.2810 105.7633 46.3033 0.0000 172.6296 45 S 5.4891 8.9014 115.6153 56.4503 66.7973 173.5760 46 L 4.8749 9.0387 127.5679 54.7192 42.2468 177.1149 47 I 4.3177 8.5664 120.3882 61.6590 38.6840 174.5827 48 N 4.7215 7.6763 117.2289 51.9915 39.6396 174.9258 49 S 4.2831 8.7251 111.9480 61.0559 62.9715 175.2231 50 Q 4.6166 8.2486 116.8938 55.0543 30.8453 174.9673 51 W 5.6114 8.3013 118.1314 54.8860 33.6636 174.3724 52 V 5.0732 9.2054 123.2257 61.1351 34.5966 174.1381 53 V 4.9352 8.9895 126.5935 61.6254 33.8273 174.6225 54 S 5.0225 9.1436 121.0641 57.5559 66.2761 171.9267 55 A 4.6095 8.5368 120.9576 50.8927 20.0819 178.5182 56 A 3.8112 8.4043 124.8952 55.3393 18.4642 179.1553 57 H 4.5163 8.3020 109.1796 57.2950 28.6602 175.4471 58 C 4.5735 7.7453 117.2296 57.7482 40.6587 173.4328 59 Y 4.2670 7.5518 121.3183 57.5574 38.8190 175.5784 60 K 3.5932 6.0885 123.1842 56.1062 34.1338 174.6230 61 S 4.0452 8.1678 115.3252 58.9572 64.1736 173.2196 62 G 3.6811 8.3738 109.9252 46.1216 0.0000 172.3312 63 I 4.5384 7.2501 121.0431 59.6571 41.0193 174.9439 64 Q 4.7685 8.8554 127.9936 54.1705 31.4580 174.3012 65 V 4.2289 8.7270 127.8693 62.3545 33.1871 174.7198 66 R 5.0138 8.9399 127.9024 54.7892 31.9633 175.6015 67 L 4.6293 9.1146 125.0283 52.9299 44.4724 177.7442 *69 G 3.6902 8.3459 107.7987 45.3180 0.0000 173.0874 70 E 4.3679 8.1414 118.3328 55.9519 30.0749 174.5976 71 D 4.7624 7.9140 117.3151 55.1264 44.2779 174.1324 72 N 4.8843 8.4788 119.8360 52.9599 39.3514 175.8324 73 I 3.9360 8.5096 119.6130 61.6836 37.9430 176.1339 74 N 4.7349 8.7468 118.3316 53.2369 39.7736 174.9957 75 V 4.3087 7.2395 117.2042 60.6147 34.0395 175.0686 76 V 4.0826 8.4102 126.9269 62.4003 30.9720 174.9818 77 E 4.5224 9.5723 124.8952 55.5493 30.1565 176.6855 78 G 3.9137 8.2793 106.9132 46.9853 0.0000 174.2002 79 N 4.6302 8.7143 117.6477 52.8343 36.9714 174.9705 80 E 4.5388 7.6735 116.5572 56.5499 30.7507 176.7001 81 Q 4.3068 8.9474 120.7504 54.5846 32.8920 173.9767 82 F 5.5346 8.7466 123.6293 56.1819 40.5332 175.6352 83 I 4.6881 8.7575 124.5472 59.4011 41.0009 175.3691 84 S 4.7059 8.7239 122.5280 58.3230 64.3096 173.0997 85 A 4.6064 8.4179 126.1710 51.7401 18.2048 177.9600 86 S 4.4015 8.7837 118.8865 60.8014 64.2094 174.9559 87 K 4.4931 7.4680 116.2954 55.9268 35.2959 174.4291 88 S 5.1874 8.9440 118.6961 57.0273 65.5187 173.5436 89 I 4.4073 9.7916 127.4124 59.6788 38.4396 174.9491 90 V 4.2185 8.2444 127.6091 61.9182 32.7366 175.1945 91 H 3.9692 8.6612 127.5388 56.0594 29.9318 174.4114 92 P 4.3223 0.0000 0.0000 65.2632 31.3633 177.1235 93 S 4.6445 8.0223 111.7178 57.9942 63.1500 173.4227 94 Y 4.3032 7.8717 122.8658 57.8295 39.0338 174.9524 95 N 4.5113 8.1206 125.2177 51.2615 40.3999 175.1975 96 S 4.0251 7.9391 121.0210 60.7270 63.4162 175.2562 97 N 4.3969 8.2757 118.6989 55.0100 38.5455 175.9327 98 T 4.0274 7.6240 105.7102 60.5191 70.3783 174.9864 99 L 3.7469 8.0881 120.6221 55.2588 39.8805 173.8441 100 N 4.4861 7.5812 117.8268 54.6297 39.4518 174.6214 101 N 4.9506 8.7189 120.1250 54.5686 35.7585 175.3792 102 D 4.7523 7.9849 117.3226 53.1162 39.5474 174.5568 103 I 4.7943 7.1293 120.7312 59.2138 42.4496 173.1202 104 M 5.3804 9.3898 127.9593 54.0031 35.7768 173.3763 105 L 5.3334 9.4955 125.7958 53.3663 44.4132 175.3748 106 I 4.8987 9.3014 124.4007 59.4246 40.2973 174.3472 107 K 3.6892 8.6481 129.3465 54.7131 33.4207 175.8082 108 L 4.3926 8.0590 127.7221 54.1390 42.0740 177.1207 109 K 4.1713 8.8723 124.6490 58.9562 32.5621 177.2324 110 S 4.6628 7.7362 111.0999 55.6599 66.1590 173.1607 111 A 4.3318 8.4287 123.2416 52.1771 18.6258 177.4145 112 A 4.1921 8.9014 124.2944 51.7901 19.7024 177.4585 113 S 4.4750 9.2184 116.2994 57.0102 62.7569 173.9168 114 L 4.5968 8.4776 128.3356 54.4254 41.7380 176.6721 115 N 4.6895 9.0505 120.3231 52.6618 39.6339 175.1264 116 S 4.4001 8.8366 110.6932 61.5623 62.8519 176.3816 117 R 4.2090 8.7497 119.1643 56.9123 30.6196 176.0436 118 V 4.6222 7.6559 117.7711 60.8731 33.7168 173.8050 119 A 5.1511 8.5039 128.0922 50.5493 22.9011 175.3520 120 S 5.0146 8.7108 114.4107 58.0283 64.6720 173.0936 121 I 4.4181 8.3466 121.5396 59.2786 39.6942 175.3708 122 S 4.4694 8.3315 123.8475 58.1178 64.1476 173.8535 123 L 4.2214 8.3811 123.5975 53.4829 42.3510 175.3676 124 P 4.4440 0.0000 0.0000 63.1655 31.7169 176.3631 125 T 4.2402 8.2435 108.8055 62.0431 69.9180 174.3378 *127 S 4.2754 7.5508 115.3911 58.0926 64.0700 174.0891 128 C 4.3492 8.4740 119.0436 56.6441 40.6273 173.8527 129 A 4.2095 8.1891 127.0517 51.9306 18.8388 177.1972 130 S 4.3234 8.1544 114.6964 57.0422 64.8854 173.2626 *132 A 4.0640 8.1387 123.3250 53.2038 19.2440 176.8053 133 G 4.0457 8.9139 109.0037 45.5664 0.0000 174.7358 134 T 3.9517 7.3071 117.3152 63.7277 69.4399 173.4785 135 Q 4.6997 8.5929 127.5475 55.9221 30.0912 175.4193 136 C 5.2873 9.4314 122.9002 55.0898 46.4093 172.5259 137 L 5.1329 9.0529 123.4477 53.7728 43.4895 175.0911 138 I 5.0692 9.3666 128.3049 59.0299 39.7159 175.0066 139 S 4.8529 8.2581 118.9814 56.6608 66.3446 173.1128 140 G 3.7362 7.4961 108.3634 46.2494 0.0000 172.9189 141 W 4.6248 8.5983 116.9158 56.2923 29.3097 177.0420 142 G 4.1448 8.3736 108.9812 44.3966 0.0000 173.4769 143 N 3.8499 9.1882 118.6128 54.3851 38.9382 174.5521 144 T 5.0788 7.9862 112.6745 60.6281 69.8078 174.4099 145 K 4.6195 8.1099 122.3133 54.8321 34.4186 176.6595 146 S 4.2623 8.7542 119.2125 61.7422 63.2077 175.6624 147 S 4.4806 8.0438 113.9663 60.5425 63.8398 175.2097 148 G 3.9803 7.5828 109.9468 45.3627 0.0000 171.9370 149 T 4.5756 8.1790 116.5432 61.9004 72.2246 174.2227 150 S 4.2810 8.3708 121.4037 57.8560 64.7444 171.9861 151 Y 4.9562 8.5072 125.8119 56.0469 38.8953 174.3390 152 P 4.6898 0.0000 0.0000 62.4498 32.9797 175.9564 153 D 4.5758 8.7872 119.0516 56.6834 41.4046 177.1411 154 V 5.4716 7.4085 109.7795 58.6100 34.2333 175.9259 155 L 3.0838 8.2852 124.9649 55.2098 42.9322 176.1078 156 K 4.7927 8.1670 125.2332 55.0321 34.9870 174.6880 157 C 5.2834 8.6824 119.4494 55.2594 42.9902 172.9564 158 L 4.9607 8.6887 122.1588 54.0276 45.6574 174.2103 159 K 5.1247 9.0174 125.6854 55.1291 33.5028 175.7246 160 A 4.8655 9.4640 126.5810 48.9072 23.1719 173.0625 161 P 5.0763 0.0000 0.0000 61.5700 34.0039 175.0422 162 I 4.3660 8.2915 123.1249 61.4982 37.9812 175.7793 163 L 4.8329 8.6860 127.5383 53.3461 43.2649 177.0307 164 S 4.3619 8.4393 115.0484 58.1890 63.8841 175.2225 165 D 4.4860 8.6429 121.7741 57.2810 40.6201 179.2736 166 S 4.1438 7.9958 114.7665 61.6236 63.1762 176.6449 167 S 4.1416 7.8524 118.8580 61.0775 62.5304 175.7913 168 C 4.2716 8.2050 121.2177 59.8743 41.7634 175.9818 169 K 3.9615 8.4776 120.1009 59.3386 31.3221 179.5707 170 S 4.1943 7.7451 114.4428 61.1842 62.8048 176.0653 171 A 4.0691 7.7058 122.9682 53.5785 19.7095 177.2542 172 Y 4.7572 7.7199 114.8464 54.7655 38.2872 171.6108 173 P 4.5601 0.0000 0.0000 63.1431 32.0653 176.6646 174 G 4.0194 9.0621 110.4422 46.3903 0.0000 173.6977 175 Q 4.5714 8.1194 116.5681 55.1634 30.7161 175.6367 176 I 4.4163 7.9020 119.4587 60.0366 38.5271 175.2316 177 T 4.6348 8.2067 115.1107 59.3875 71.1177 175.2367 178 S 4.2824 8.5546 115.3367 60.6640 63.1996 174.5413 179 N 4.9261 8.0072 118.2405 53.3344 38.4058 173.8575 180 M 5.5885 7.9324 117.2573 53.9169 36.3502 174.5433 181 F 5.0825 8.6082 114.1504 56.1560 41.8599 172.5720 182 C 5.4438 9.0319 117.0179 56.0493 40.5379 172.4912 183 A 4.9611 8.9630 121.8717 51.5092 22.4858 175.6577 184A G 3.9506 7.1606 106.8792 44.5243 0.0000 172.4308 184 Y 4.7244 8.4307 118.2488 56.1613 41.1852 176.5279 185 L 4.2646 8.5712 123.7836 57.0649 42.2118 178.8706 186 E 3.8982 8.2256 117.2361 57.2981 29.6881 177.4831 187 G 3.8836 7.3968 104.8386 45.0531 0.0000 172.6904 188A G 4.0635 9.5723 105.9763 44.6934 0.0000 173.6068 188 K 5.5802 7.2555 117.2212 53.9051 35.7568 175.2444 189 D 4.6226 8.3985 122.7854 53.9702 44.5838 174.8616 190 S 4.9053 8.8357 116.5108 58.0636 65.0865 173.6972 191 C 4.7893 9.6974 118.9213 55.4741 44.7674 172.4487 192 Q 4.3477 8.7216 117.8184 58.0008 28.6019 177.1522 193 G 4.0268 9.2826 110.3651 46.0182 0.0000 174.2823 194 D 4.6436 8.5731 118.7281 55.6598 41.6290 176.6761 195 S 4.4510 8.1148 115.3402 60.5356 63.3880 175.6070 196 G 4.1094 9.0658 112.4935 46.2925 0.0000 173.6554 197 G 4.3374 8.0033 107.6306 45.0877 0.0000 171.5881 198 P 5.1139 0.0000 0.0000 62.4273 33.5629 175.6499 199 V 4.5315 8.4699 120.5603 61.4298 34.2489 174.0339 200 V 4.8621 8.7136 129.0253 61.2820 33.9355 173.6912 201 C 5.0476 8.6811 124.9455 55.4168 43.6385 174.6635 202 S 3.6838 9.5627 120.7904 59.8145 59.8244 173.0824 203 G 3.9127 8.4357 104.4135 45.7824 0.0000 173.8519 204 K 4.7316 7.4089 117.5862 53.0208 35.1814 175.5397 *209 L 4.4354 8.2626 122.8857 55.4464 42.0575 175.7188 210 Q 4.4571 8.7911 126.1112 56.8804 30.7963 175.8957 211 G 5.3164 8.0134 104.3048 45.7040 0.0000 171.4622 212 I 5.2389 8.2517 119.3934 58.8873 41.3379 175.0679 213 V 3.5365 9.0535 127.4826 64.1957 31.7758 174.3123 214 S 4.9753 8.5704 121.7190 58.6506 64.1405 175.3070 215 W 5.0422 7.6029 115.1338 56.7311 31.8596 172.8364 216 G 3.8669 8.3882 107.0116 47.0657 0.0000 172.9137 217 S 4.6771 8.1275 115.0491 56.5421 62.1795 172.7744 *219 G 4.2053 7.9250 118.1092 45.4955 0.0000 170.6857 220 C 4.7424 8.2882 116.7414 56.6049 45.3243 173.8076 221A A 3.9685 8.8979 126.4584 53.0489 16.5343 176.2599 221 Q 4.5824 7.3711 119.9324 56.0432 30.1644 175.3830 222 K 4.1574 8.4006 123.4501 58.2678 33.1662 176.4628 223 N 4.3050 8.8767 117.6778 54.0144 36.7613 175.4577 224 K 4.2970 7.5011 117.8111 53.8031 32.4943 173.8170 225 P 4.6420 0.0000 0.0000 61.8797 33.3678 176.9235 226 G 3.6093 8.4756 106.9874 45.9764 0.0000 172.8288 227 V 4.3754 7.7746 122.9795 60.8105 33.7406 174.2133 228 Y 4.8776 8.2862 124.1970 55.9882 42.4348 174.8118 229 T 4.4684 8.6967 119.3693 63.4763 69.9433 174.7407 230 K 5.1558 9.5029 128.6093 55.5678 30.7458 177.0476 231 V 3.9415 8.8814 125.6423 65.8612 31.4269 174.7714 232 C 4.3828 8.2995 112.3545 57.9078 41.5998 174.5848 233 N 4.3276 8.0593 117.2659 54.0610 38.6331 174.8945 234 Y 4.8206 7.9028 117.5257 57.3423 39.5965 177.4060 235 V 3.6716 8.1544 121.3231 66.4104 31.3781 178.0572 236 S 4.1434 8.0927 114.1350 61.2873 62.7057 176.2841 237 W 4.1315 8.3117 130.5151 60.5261 30.5951 177.7725 238 I 3.2373 8.4147 120.0970 64.3572 36.7208 178.6345 239 K 3.8222 7.9815 119.1176 59.4895 31.6099 179.5645 240 Q 3.9103 7.9843 117.7426 58.9958 28.7614 178.5717 241 T 3.6800 7.6066 117.1353 66.5168 68.2596 176.8317 242 I 2.7088 7.0719 121.3768 64.0202 36.7598 178.4073 243 A 4.0599 7.5655 120.1846 53.9770 18.1942 178.7271 244 S 4.6448 7.3319 110.6999 58.2378 63.5297 174.0691 245 N 4.6749 7.9073 125.4189 53.8577 39.2092 174.0370 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 16 I 7.88 4.25 1.81 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 1.36 0.54 0.89 0.00 0.00 17 V 8.79 4.38 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 0.99 0.00 0.00 0.99 0.00 0.00 18 G 8.52 4.13 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 0.00 0.00 0.00 19 G 7.76 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 0.00 0.00 0.00 0.00 20 Y 7.64 4.96 0.00 2.99 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 21 T 8.59 4.28 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 1.25 0.00 0.00 22 C 8.43 4.27 0.00 2.75 3.05 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 23 G 8.61 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 0.00 0.00 0.00 24 A 8.55 4.09 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 25 N 8.86 4.27 0.00 2.89 2.92 0.00 0.00 7.18 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 T 7.61 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 1.26 0.00 0.00 27 V 7.06 4.12 1.71 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 0.25 0.00 0.00 0.74 0.00 0.00 28 P 0.00 4.66 0.00 2.40 2.32 0.00 3.84 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 2.22 1.99 0.00 29 Y 7.04 5.06 0.00 3.28 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 30 Q 7.34 4.63 0.00 1.73 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.73 0.00 0.00 0.00 0.00 0.00 1.83 2.43 0.00 31 V 8.87 4.89 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 0.84 0.00 0.00 0.98 0.00 0.00 32 S 8.66 4.92 0.00 3.13 3.33 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 33 L 8.51 4.50 0.00 0.35 0.80 0.78 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 34 N 8.96 5.71 0.00 2.38 2.44 0.00 0.00 6.77 7.72 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 *37 S 8.33 4.20 0.00 3.84 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 38 G 10.07 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 0.00 0.00 0.00 39 Y 6.68 4.50 0.00 3.03 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 40 H 8.91 4.51 0.00 2.84 3.15 0.00 5.86 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 41 F 7.65 4.99 0.00 2.96 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 42 C 6.81 4.80 0.00 2.31 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 43 G 8.87 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 G 8.28 4.56 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 S 8.90 5.49 0.00 3.82 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 L 9.04 4.87 0.00 1.89 1.68 1.09 0.70 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 47 I 8.57 4.32 1.90 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 1.60 0.88 0.96 0.00 0.00 48 N 7.68 4.72 0.00 2.95 3.00 0.00 0.00 6.02 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 S 8.73 4.28 0.00 4.05 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 Q 8.25 4.62 0.00 2.04 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.90 0.00 0.00 0.00 0.00 0.00 2.28 2.36 0.00 51 W 8.30 5.61 0.00 3.24 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 52 V 9.21 5.07 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 0.94 0.00 0.00 0.98 0.00 0.00 53 V 8.99 4.94 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 1.06 0.00 0.00 1.02 0.00 0.00 54 S 9.14 5.02 0.00 3.88 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 A 8.54 4.61 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 56 A 8.40 3.81 0.38 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 57 H 8.30 4.52 0.00 3.41 3.58 0.00 5.55 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 7.75 4.57 0.00 3.24 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 Y 7.55 4.27 0.00 2.95 2.95 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 60 K 6.09 3.59 0.00 1.52 1.35 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.55 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.75 0.81 7.81 61 S 8.17 4.05 0.00 3.94 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 G 8.37 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 I 7.25 4.54 1.85 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.98 0.91 0.00 0.00 64 Q 8.86 4.77 0.00 1.99 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.95 0.00 0.00 0.00 0.00 0.00 2.07 2.21 0.00 65 V 8.73 4.23 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 0.95 0.00 0.00 0.89 0.00 0.00 66 R 8.94 5.01 0.00 1.54 1.82 0.00 2.21 0.00 0.00 2.40 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.33 0.00 67 L 9.11 4.63 0.00 1.62 1.65 0.96 0.65 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 *69 G 8.35 3.69 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 70 E 8.14 4.37 0.00 2.17 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 2.38 2.06 0.00 71 D 7.91 4.76 0.00 2.77 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 72 N 8.48 4.88 0.00 2.85 2.85 0.00 0.00 7.20 7.91 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 73 I 8.51 3.94 1.38 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.50 -0.52 0.00 0.00 74 N 8.75 4.73 0.00 2.82 2.89 0.00 0.00 6.62 7.47 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 75 V 7.24 4.31 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 0.78 0.00 0.00 0.95 0.00 0.00 76 V 8.41 4.08 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.98 0.00 0.00 77 E 9.57 4.52 0.00 2.06 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 2.38 2.23 0.00 78 G 8.28 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 N 8.71 4.63 0.00 2.89 3.14 0.00 0.00 7.00 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 80 E 7.67 4.54 0.00 1.57 1.81 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 2.67 2.46 0.00 81 Q 8.95 4.31 0.00 2.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.79 0.00 0.00 0.00 0.00 0.00 2.24 2.31 0.00 82 F 8.75 5.53 0.00 2.81 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 I 8.76 4.69 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.90 0.93 0.00 0.00 84 S 8.72 4.71 0.00 3.75 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 85 A 8.42 4.61 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 86 S 8.78 4.40 0.00 3.82 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 K 7.47 4.49 0.00 1.83 1.88 0.00 1.48 0.00 0.00 1.90 0.00 0.00 2.83 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.23 1.28 7.81 88 S 8.94 5.19 0.00 4.09 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 I 9.79 4.41 2.07 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 1.24 1.02 1.06 0.00 0.00 90 V 8.24 4.22 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 0.65 0.00 0.00 0.72 0.00 0.00 91 H 8.66 3.97 0.00 2.88 3.08 0.00 5.65 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 P 0.00 4.32 0.00 2.09 2.15 0.00 3.33 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.22 0.00 93 S 8.02 4.64 0.00 3.98 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 94 Y 7.87 4.30 0.00 2.96 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 95 N 8.12 4.51 0.00 2.59 2.43 0.00 0.00 6.62 7.06 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 96 S 7.94 4.03 0.00 3.93 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 N 8.28 4.40 0.00 2.73 2.78 0.00 0.00 6.86 7.47 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 98 T 7.62 4.03 4.11 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 1.09 0.00 0.00 99 L 8.09 3.75 0.00 1.38 1.85 0.68 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 100 N 7.58 4.49 0.00 2.74 2.64 0.00 0.00 7.26 6.38 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 0.00 101 N 8.72 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0.00 0.00 1.73 0.00 0.00 2.95 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.42 1.35 7.81 110 S 7.74 4.66 0.00 3.93 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 0.00 111 A 8.43 4.33 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 0.00 112 A 8.90 4.19 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 0.00 113 S 9.22 4.48 0.00 3.85 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 0.00 114 L 8.48 4.60 0.00 1.70 1.61 0.96 1.10 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 0.00 115 N 9.05 4.69 0.00 2.87 2.88 0.00 0.00 6.35 8.28 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 0.00 116 S 8.84 4.40 0.00 3.86 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 0.00 117 R 8.75 4.21 0.00 1.91 2.18 0.00 3.29 0.00 0.00 3.10 7.38 0.00 0.00 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0.00 1.20 0.00 0.00 *127 S 7.55 4.28 0.00 4.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 C 8.47 4.35 0.00 2.93 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 0.00 129 A 8.19 4.21 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 S 8.15 4.32 0.00 3.97 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 *132 A 8.14 4.06 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 0.00 133 G 8.91 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 T 7.31 3.95 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 1.15 0.00 0.00 135 Q 8.59 4.70 0.00 2.04 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.72 6.80 0.00 0.00 0.00 0.00 0.00 2.35 2.48 0.00 136 C 9.43 5.29 0.00 2.76 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 0.00 137 L 9.05 5.13 0.00 1.76 1.59 1.00 1.26 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 0.00 138 I 9.37 5.07 1.89 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 0.75 1.29 0.99 0.00 0.00 139 S 8.26 4.85 0.00 3.55 3.58 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 0.00 140 G 7.50 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 0.00 141 W 8.60 4.62 0.00 3.08 2.95 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 0.00 142 G 8.37 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 0.00 143 N 9.19 3.85 0.00 2.33 2.67 0.00 0.00 7.11 7.40 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 0.00 144 T 7.99 5.08 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 145 K 8.11 4.62 0.00 1.84 1.71 0.00 1.69 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.32 1.47 7.81 146 S 8.75 4.26 0.00 3.86 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 0.00 147 S 8.04 4.48 0.00 3.85 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 0.00 148 G 7.58 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 0.00 149 T 8.18 4.58 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 1.23 0.00 0.00 150 S 8.37 4.28 0.00 3.81 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 Y 8.51 4.96 0.00 2.99 2.95 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 0.00 152 P 0.00 4.69 0.00 2.47 2.11 0.00 4.18 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.07 0.00 153 D 8.79 4.58 0.00 2.88 2.95 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 0.00 154 V 7.41 5.47 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 0.88 0.00 0.00 0.97 0.00 0.00 155 L 8.29 3.08 0.00 1.29 1.26 -0.54 0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.17 4.79 0.00 1.74 1.52 0.00 1.60 0.00 0.00 1.56 0.00 0.00 2.82 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.47 1.49 7.81 157 C 8.68 5.28 0.00 1.70 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 0.00 0.00 0.00 158 L 8.69 4.96 0.00 1.69 1.46 1.05 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 159 K 9.02 5.12 0.00 1.83 1.84 0.00 1.82 0.00 0.00 1.79 0.00 0.00 2.73 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.50 1.69 7.81 160 A 9.46 4.87 1.15 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 0.00 161 P 0.00 5.08 0.00 2.03 2.09 0.00 3.04 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.76 0.00 162 I 8.29 4.37 1.75 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.53 0.78 0.00 0.00 163 L 8.69 4.83 0.00 1.56 1.60 0.93 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 164 S 8.44 4.36 0.00 4.00 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 0.00 165 D 8.64 4.49 0.00 2.73 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 0.00 166 S 8.00 4.14 0.00 4.05 4.13 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 0.00 167 S 7.85 4.14 0.00 4.02 3.95 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 0.00 168 C 8.21 4.27 0.00 3.19 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 169 K 8.48 3.96 0.00 1.91 1.90 0.00 1.75 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.54 1.73 7.81 170 S 7.75 4.19 0.00 4.03 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 0.00 171 A 7.71 4.07 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 Y 7.72 4.76 0.00 3.13 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 0.00 173 P 0.00 4.56 0.00 2.08 2.06 0.00 3.92 0.00 0.00 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.18 0.00 174 G 9.06 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 0.00 175 Q 8.12 4.57 0.00 2.36 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.27 6.62 0.00 0.00 0.00 0.00 0.00 2.29 2.58 0.00 176 I 7.90 4.42 1.98 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.94 1.00 0.00 0.00 177 T 8.21 4.63 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 178 S 8.55 4.28 0.00 4.00 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 0.00 179 N 8.01 4.93 0.00 2.91 3.12 0.00 0.00 6.58 7.33 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 0.00 180 M 7.93 5.59 0.00 1.88 2.00 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.61 0.00 181 F 8.61 5.08 0.00 3.09 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 0.00 182 C 9.03 5.44 0.00 2.99 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 0.00 183 A 8.96 4.96 1.20 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 0.00 0.00 184A G 7.16 3.95 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 0.00 184 Y 8.43 4.72 0.00 3.09 3.05 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 0.00 185 L 8.57 4.26 0.00 1.74 1.72 0.92 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 186 E 8.23 3.90 0.00 1.97 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 2.35 2.42 0.00 187 G 7.40 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188A G 9.57 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188 K 7.26 5.58 0.00 1.61 1.77 0.00 0.87 0.00 0.00 2.10 0.00 0.00 2.38 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.42 1.04 7.81 189 D 8.40 4.62 0.00 2.84 2.56 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 0.00 0.00 0.00 0.00 190 S 8.84 4.91 0.00 4.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 191 C 9.70 4.79 0.00 2.90 3.12 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 0.00 192 Q 8.72 4.35 0.00 2.36 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.29 0.00 0.00 0.00 0.00 0.00 2.56 2.46 0.00 193 G 9.28 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 0.00 194 D 8.57 4.64 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 0.00 195 S 8.11 4.45 0.00 3.96 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 0.00 196 G 9.07 4.11 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 0.00 0.00 0.00 197 G 8.00 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 0.00 198 P 0.00 5.11 0.00 2.34 2.37 0.00 3.70 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.22 0.00 199 V 8.47 4.53 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 0.81 0.00 0.00 0.53 0.00 0.00 200 V 8.71 4.86 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 0.81 0.00 0.00 0.67 0.00 0.00 201 C 8.68 5.05 0.00 2.80 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 0.00 202 S 9.56 3.68 0.00 3.97 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 203 G 8.44 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 204 K 7.41 4.73 0.00 1.97 1.64 0.00 1.55 0.00 0.00 1.75 0.00 0.00 2.95 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.30 1.54 7.81 *209 L 8.26 4.44 0.00 1.52 1.65 1.07 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 210 Q 8.79 4.46 0.00 1.99 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.39 0.00 0.00 0.00 0.00 0.00 2.40 2.34 0.00 211 G 8.01 5.32 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 0.00 212 I 8.25 5.24 1.93 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 1.30 0.91 0.94 0.00 0.00 213 V 9.05 3.54 2.38 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 0.86 0.00 0.00 1.17 0.00 0.00 214 S 8.57 4.98 0.00 3.92 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 0.00 215 W 7.60 5.04 0.00 3.36 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 0.00 216 G 8.39 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 217 S 8.13 4.68 0.00 4.27 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 *219 G 7.92 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 0.00 220 C 8.29 4.74 0.00 2.96 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221A A 8.90 3.97 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 0.00 221 Q 7.37 4.58 0.00 2.23 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.03 6.93 0.00 0.00 0.00 0.00 0.00 2.35 2.35 0.00 222 K 8.40 4.16 0.00 2.05 1.98 0.00 1.75 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.41 1.46 7.81 223 N 8.88 4.30 0.00 2.86 2.91 0.00 0.00 6.75 7.14 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 0.00 224 K 7.50 4.30 0.00 1.82 1.79 0.00 1.70 0.00 0.00 1.40 0.00 0.00 2.91 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.48 1.51 7.81 225 P 0.00 4.64 0.00 2.13 2.10 0.00 3.57 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 2.11 1.99 0.00 226 G 8.48 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 0.00 0.00 0.00 227 V 7.77 4.38 0.67 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 0.33 0.00 0.00 -0.85 0.00 0.00 228 Y 8.29 4.88 0.00 1.43 2.42 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 0.00 0.00 0.00 0.00 229 T 8.70 4.47 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 0.00 230 K 9.50 5.16 0.00 2.10 1.94 0.00 1.80 0.00 0.00 1.83 0.00 0.00 2.88 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.53 1.59 7.81 231 V 8.88 3.94 2.35 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 1.21 0.00 0.00 1.11 0.00 0.00 232 C 8.30 4.38 0.00 3.16 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 0.00 233 N 8.06 4.33 0.00 2.47 2.35 0.00 0.00 6.77 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 0.00 234 Y 7.90 4.82 0.00 3.12 3.20 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 0.00 235 V 8.15 3.67 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 1.09 0.00 0.00 1.07 0.00 0.00 236 S 8.09 4.14 0.00 3.98 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 0.00 237 W 8.31 4.13 0.00 3.53 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 0.00 238 I 8.41 3.24 2.05 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.32 0.78 0.00 0.00 239 K 7.98 3.82 0.00 1.75 1.77 0.00 1.64 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.38 1.54 7.81 240 Q 7.98 3.91 0.00 1.92 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.96 0.00 0.00 0.00 0.00 0.00 2.35 2.51 0.00 241 T 7.61 3.68 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 242 I 7.07 2.71 1.42 0.00 0.00 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.58 0.39 0.00 0.00 243 A 7.57 4.06 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 0.00 244 S 7.33 4.64 0.00 3.96 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 245 N 7.91 4.67 0.00 3.00 3.02 0.00 0.00 6.74 8.81 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 * Residues marked with a * may have inaccurate shift predictions.